A0A3Q0KUF4_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A3Q0KUF4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 223 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
1M65Low78.5Confident196 Ų196100.4 Ų100.497%0.96648%0.48SS*.  0-48.80-166.1171.8176.700113.1S4 Q5M1-S4 PolarHBondContact O-OG 3.39Å; M1-Q5 PolarHBondContact O-N 2.95Å
2F71.2Confident79.4Confident124 Ų12498.4 Ų98.454%0.54447%0.474SS..Hα-helixtrans-63.4-46.2-179.3-175-103.6000114.1S4 Q5 L6F2-S4 PolarHBondContact O-N 3.48Å; F2-Q5 PolarHBondContact O-N 3.26Å; F2-L6 PolarHBondContact O-N 3.33Å
3L71.5Confident80.2Confident98 Ų9896.5 Ų96.551%0.51347%0.467SS..Hα-helixtrans-62-40.3178.9-68.9172.6000113Q5 L6 Q7 N219L3-Q5 VanDerWaalsContact C-N 3.32Å; L3-Q5 PolarHBondContact O-N 3.41Å; L3-L6 PolarHBondContact O-N 3.46Å; L3-Q7 WeakPolarHBondContact O-CB 3.45Å; L3-Q7 PolarHBondContact O-N 3.14Å; L3-N219 HydrophobicContact CD2-CB 4.47Å
4S77.8Confident81Confident81 Ų8189.7 Ų89.757%0.56643%0.434SS*.Hα-helixtrans-65.4-36.3178.152.20000112.2M1 F2 K8M1-S4 PolarHBondContact O-OG 3.39Å; F2-S4 PolarHBondContact O-N 3.48Å; S4-K8 PolarHBondContact O-N 3.47Å
5Q79.4Confident81.9Confident97 Ų9787.9 Ų87.945%0.45343%0.426SS..Hα-helixtrans-70.5-43.4176.3-171.9171.60.500111.3M1 F2 L3 Q7 K8 Y9M1-Q5 PolarHBondContact O-N 2.95Å; F2-Q5 PolarHBondContact O-N 3.26Å; L3-Q5 VanDerWaalsContact C-N 3.32Å; L3-Q5 PolarHBondContact O-N 3.41Å; Q5-Q7 VanDerWaalsContact C-N 3.34Å; Q5-Q7 PolarHBondContact O-N 3.07Å; Q5-K8 PolarHBondContact O-N 3.35Å; Q5-Y9 HydrophobicContact CG-CD2 3.97Å; Q5-Y9 HydrophobicContact CG-CE2 3.53Å; Q5-Y9 WeakPolarHBondContact O-CD2 3.5Å; Q5-Y9 PolarHBondContact O-N 3.11Å; Q5-Y9 VanDerWaalsContact O-N 3.11Å
6L78.1Confident82.7Confident35 Ų3589.6 Ų89.618%0.18344%0.436CS..Hα-helixtrans-59.5-43.4175.6-173.264.8000112F2 L3 K8 Y9 W10 L212 K215F2-L6 PolarHBondContact O-N 3.33Å; L3-L6 PolarHBondContact O-N 3.46Å; L6-K8 VanDerWaalsContact C-N 3.34Å; L6-K8 PolarHBondContact O-N 3.24Å; L6-Y9 PolarHBondContact O-N 3.48Å; L6-W10 PolarHBondContact O-N 3.12Å; L6-L212 HydrophobicContact CD1-CD2 3.77Å; L6-L212 HydrophobicContact CG-CD2 4.42Å; L6-K215 HydrophobicContact CD2-CD 4.29Å
7Q79.5Confident83.4Confident100 Ų10085.5 Ų85.547%0.46742%0.419SS..Hα-helixtrans-62-41.1176.9-173.763.735.900112.1L3 Q5 W10 N11L3-Q7 WeakPolarHBondContact O-CB 3.45Å; L3-Q7 PolarHBondContact O-N 3.14Å; Q5-Q7 VanDerWaalsContact C-N 3.34Å; Q5-Q7 PolarHBondContact O-N 3.07Å; Q7-W10 PolarHBondContact O-N 3.14Å; Q7-N11 PolarHBondContact NE2-OD1 3.27Å; Q7-N11 VanDerWaalsContact O-CG 3.28Å; Q7-N11 PolarHBondContact O-N 3.25Å; Q7-N11 PolarHBondContact O-OD1 3.36Å
8K84.5Confident84.1Confident144 Ų14480.7 Ų80.763%0.62640%0.396SS*.Hα-helixtrans-63-43.2178-171.8175.2-179.6178.50111.5S4 Q5 L6 N11 N12S4-K8 PolarHBondContact O-N 3.47Å; Q5-K8 PolarHBondContact O-N 3.35Å; L6-K8 VanDerWaalsContact C-N 3.34Å; L6-K8 PolarHBondContact O-N 3.24Å; K8-N11 PolarHBondContact O-N 3.43Å; K8-N12 VanDerWaalsContact O-CG 3.3Å; K8-N12 PolarHBondContact O-N 2.95Å; K8-N12 VanDerWaalsContact O-N 3.07Å; K8-N12 PolarHBondContact O-OD1 3Å
9Y84.5Confident84.7Confident137 Ų13781.5 Ų81.554%0.53740%0.401SS..Hα-helixtrans-63.6-44.1175.5-76-65.2000112.3Q5 L6 N11 N12 I13Q5-Y9 HydrophobicContact CG-CD2 3.97Å; Q5-Y9 HydrophobicContact CG-CE2 3.53Å; Q5-Y9 WeakPolarHBondContact O-CD2 3.5Å; Q5-Y9 PolarHBondContact O-N 3.11Å; Q5-Y9 VanDerWaalsContact O-N 3.11Å; L6-Y9 PolarHBondContact O-N 3.48Å; Y9-N11 PolarHBondContact O-N 3.17Å; Y9-N12 PolarHBondContact O-N 3.11Å; Y9-I13 WeakPolarHBondContact O-CG1 3.48Å; Y9-I13 PolarHBondContact O-N 3.32Å
10W83.7Confident85.3Confident44 Ų4481 Ų8117%0.16740%0.4CS..Hα-helixtrans-59.9-47.3177-175.988000111.7L6 Q7 N12 I13 F14 L75 I83 L212L6-W10 PolarHBondContact O-N 3.12Å; Q7-W10 PolarHBondContact O-N 3.14Å; W10-N12 VanDerWaalsContact C-N 3.32Å; W10-N12 PolarHBondContact O-N 3.08Å; W10-I13 PolarHBondContact O-N 3.46Å; W10-F14 AromaticContact CH2-CD2 3.68Å; W10-F14 HydrophobicContact CH2-CD2 3.68Å; W10-F14 HydrophobicContact CH2-CE2 4.13Å; W10-F14 HydrophobicContact CH2-CG 4.31Å; W10-F14 AromaticContact CZ2-CD2 3.84Å; W10-F14 HydrophobicContact CZ2-CD2 3.84Å; W10-F14 HydrophobicContact CZ2-CE2 4.43Å; W10-F14 HydrophobicContact CZ3-CD2 4.34Å; W10-F14 WeakPolarHBondContact O-CB 3.49Å; W10-F14 PolarHBondContact O-N 3Å; W10-L75 HydrophobicContact CZ3-CD1 3.97Å; W10-I83 HydrophobicContact CH2-CD1 4.15Å; W10-I83 HydrophobicContact CH2-CG2 4.42Å; W10-L212 VanDerWaalsContact CD1-CD1 3.47Å; W10-L212 HydrophobicContact CG-CD1 4.38Å
11N88.2Confident85.9Confident48 Ų4877.1 Ų77.126%0.25738%0.381SS..Hα-helixtrans-58.5-43177.2-71.8-4.1000111.9Q7 K8 Y9 F14 I15Q7-N11 PolarHBondContact NE2-OD1 3.27Å; Q7-N11 VanDerWaalsContact O-CG 3.28Å; Q7-N11 PolarHBondContact O-N 3.25Å; Q7-N11 PolarHBondContact O-OD1 3.36Å; K8-N11 PolarHBondContact O-N 3.43Å; Y9-N11 PolarHBondContact O-N 3.17Å; N11-F14 PolarHBondContact O-N 3.26Å; N11-I15 VanDerWaalsContact O-CG1 3.29Å; N11-I15 WeakPolarHBondContact O-CG1 3.46Å; N11-I15 PolarHBondContact O-N 2.77Å
12N89.5Confident87.5Confident77 Ų7769.5 Ų69.541%0.41234%0.343SS..Hα-helixtrans-64.8-46.2179.3-73.2-3.3000111.8K8 Y9 W10 F14 I15 I16K8-N12 VanDerWaalsContact O-CG 3.3Å; K8-N12 PolarHBondContact O-N 2.95Å; K8-N12 VanDerWaalsContact O-N 3.07Å; K8-N12 PolarHBondContact O-OD1 3Å; Y9-N12 PolarHBondContact O-N 3.11Å; W10-N12 VanDerWaalsContact C-N 3.32Å; W10-N12 PolarHBondContact O-N 3.08Å; N12-F14 VanDerWaalsContact C-N 3.3Å; N12-F14 PolarHBondContact O-N 3.47Å; N12-I15 PolarHBondContact O-N 2.95Å; N12-I16 WeakPolarHBondContact O-CB 3.36Å; N12-I16 VanDerWaalsContact O-CG1 3.27Å; N12-I16 WeakPolarHBondContact O-CG1 3.28Å; N12-I16 PolarHBondContact O-N 3.02Å
13I89.2Confident88.8Confident74 Ų7468 Ų6838%0.37935%0.345SS..Hα-helixtrans-60.3-43.5176.1-68.4169.1000110.3Y9 W10 S17Y9-I13 WeakPolarHBondContact O-CG1 3.48Å; Y9-I13 PolarHBondContact O-N 3.32Å; W10-I13 PolarHBondContact O-N 3.46Å; I13-S17 VanDerWaalsContact O-CB 3.25Å; I13-S17 WeakPolarHBondContact O-CB 3.47Å; I13-S17 PolarHBondContact O-N 3.42Å; I13-S17 PolarHBondContact O-OG 3Å
14F92.2Very high90Very high1 Ų165.3 Ų65.30%0.00433%0.329CS..Hα-helixtrans-58.6-51177.6-174.7-79.6000111.2W10 N11 N12 S17 N18 G71 L75 I83 Y205W10-F14 AromaticContact CH2-CD2 3.68Å; W10-F14 HydrophobicContact CH2-CD2 3.68Å; W10-F14 HydrophobicContact CH2-CE2 4.13Å; W10-F14 HydrophobicContact CH2-CG 4.31Å; W10-F14 AromaticContact CZ2-CD2 3.84Å; W10-F14 HydrophobicContact CZ2-CD2 3.84Å; W10-F14 HydrophobicContact CZ2-CE2 4.43Å; W10-F14 HydrophobicContact CZ3-CD2 4.34Å; W10-F14 WeakPolarHBondContact O-CB 3.49Å; W10-F14 PolarHBondContact O-N 3Å; N11-F14 PolarHBondContact O-N 3.26Å; N12-F14 VanDerWaalsContact C-N 3.3Å; N12-F14 PolarHBondContact O-N 3.47Å; F14-S17 PolarHBondContact O-N 3.11Å; F14-N18 WeakPolarHBondContact CD1-ND2 3.42Å; F14-N18 VanDerWaalsContact CE1-ND2 3.3Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.25Å; F14-N18 WeakPolarHBondContact O-CB 3.34Å; F14-N18 PolarHBondContact O-N 3.37Å; F14-N18 PolarHBondContact O-ND2 3.43Å; F14-G71 WeakPolarHBondContact CZ-O 3.26Å; F14-L75 HydrophobicContact CD1-CB 4.44Å; F14-L75 HydrophobicContact CD1-CD2 3.84Å; F14-L75 HydrophobicContact CE1-CB 4.06Å; F14-L75 HydrophobicContact CE1-CD2 4.21Å; F14-I83 HydrophobicContact CE2-CG2 4.46Å; F14-Y205 HydrophobicContact CD2-CE2 4.16Å; F14-Y205 WeakPolarHBondContact CD2-OH 3.24Å; F14-Y205 WeakPolarHBondContact CE2-OH 3.38Å
15I94.2Very high91Very high62 Ų6261.4 Ų61.432%0.31830%0.302SS..Hα-helixtrans-62.4-49.5-179.1-69.1163.3000110.7N11 N12 S17 N18 L19 L75N11-I15 VanDerWaalsContact O-CG1 3.29Å; N11-I15 WeakPolarHBondContact O-CG1 3.46Å; N11-I15 PolarHBondContact O-N 2.77Å; N12-I15 PolarHBondContact O-N 2.95Å; I15-S17 PolarHBondContact O-N 3.23Å; I15-N18 PolarHBondContact O-N 3.01Å; I15-L19 HydrophobicContact CG2-CD1 3.99Å; I15-L19 HydrophobicContact CG2-CG 4.43Å; I15-L19 WeakPolarHBondContact O-CG 3.46Å; I15-L19 PolarHBondContact O-N 2.87Å; I15-L75 HydrophobicContact CD1-CD2 3.92Å; I15-L75 HydrophobicContact CG1-CD2 3.57Å
16I94.5Very high91.9Very high115 Ų11561.1 Ų61.159%0.5930%0.302SS*.Hα-helixtrans-61.9-44.6-178.2-67.4166.4000110.8N12 L19 L20N12-I16 WeakPolarHBondContact O-CB 3.36Å; N12-I16 VanDerWaalsContact O-CG1 3.27Å; N12-I16 WeakPolarHBondContact O-CG1 3.28Å; N12-I16 PolarHBondContact O-N 3.02Å; I16-L19 PolarHBondContact O-N 3.36Å; I16-L20 PolarHBondContact O-N 2.97Å
17S94.6Very high92.9Very high20 Ų2061 Ų6114%0.1431%0.306CS..Hα-helixtrans-64.7-43.3179.3-54.30000111.4I13 F14 I15 L19 L20 F21I13-S17 VanDerWaalsContact O-CB 3.25Å; I13-S17 WeakPolarHBondContact O-CB 3.47Å; I13-S17 PolarHBondContact O-N 3.42Å; I13-S17 PolarHBondContact O-OG 3Å; F14-S17 PolarHBondContact O-N 3.11Å; I15-S17 PolarHBondContact O-N 3.23Å; S17-L19 PolarHBondContact O-N 3.44Å; S17-L20 WeakPolarHBondContact O-CB 3.49Å; S17-L20 PolarHBondContact O-N 3.44Å; S17-F21 WeakPolarHBondContact O-CD1 3.4Å; S17-F21 WeakPolarHBondContact O-CD2 3.32Å; S17-F21 WeakPolarHBondContact O-CG 3.16Å; S17-F21 PolarHBondContact O-N 3.18Å
18N95.8Very high93.7Very high0 Ų056.2 Ų56.20%028%0.283CS..Hα-helixtrans-66.9-36.7178.8-83.5-85.9000112.8F14 I15 L20 F21 I22 V68 F72 H86F14-N18 WeakPolarHBondContact CD1-ND2 3.42Å; F14-N18 VanDerWaalsContact CE1-ND2 3.3Å; F14-N18 WeakPolarHBondContact CE1-ND2 3.25Å; F14-N18 WeakPolarHBondContact O-CB 3.34Å; F14-N18 PolarHBondContact O-N 3.37Å; F14-N18 PolarHBondContact O-ND2 3.43Å; I15-N18 PolarHBondContact O-N 3.01Å; N18-L20 VanDerWaalsContact C-N 3.33Å; N18-F21 PolarHBondContact O-N 3.33Å; N18-I22 WeakPolarHBondContact O-CG1 3.47Å; N18-I22 PolarHBondContact O-N 3.46Å; N18-V68 HydrophobicContact CB-CG1 3.89Å; N18-V68 WeakPolarHBondContact OD1-CG1 3.36Å; N18-F72 HydrophobicContact CB-CE1 4.29Å; N18-F72 HydrophobicContact CB-CE2 3.92Å; N18-F72 HydrophobicContact CB-CZ 3.67Å; N18-H86 PolarHBondContact OD1-CE1 3.46Å
19L96.6Very high94.3Very high95 Ų9550.6 Ų50.650%0.49726%0.26SS..Hα-helixtrans-62.9-41.6171.7-70.8173.9000111.4I15 I16 S17 F21 I22 V23 F72I15-L19 HydrophobicContact CG2-CD1 3.99Å; I15-L19 HydrophobicContact CG2-CG 4.43Å; I15-L19 WeakPolarHBondContact O-CG 3.46Å; I15-L19 PolarHBondContact O-N 2.87Å; I16-L19 PolarHBondContact O-N 3.36Å; S17-L19 PolarHBondContact O-N 3.44Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-I22 PolarHBondContact O-N 2.93Å; L19-V23 PolarHBondContact O-N 3.45Å; L19-F72 HydrophobicContact CD2-CZ 4.14Å; L19-F72 HydrophobicContact CG-CZ 4.33Å
20L96.6Very high95Very high72 Ų7246.6 Ų46.638%0.37726%0.256SS..Hα-helixtrans-62.6-41.9174.2-173.262000111.1I16 S17 N18 I22 V23 F24 I201I16-L20 PolarHBondContact O-N 2.97Å; S17-L20 WeakPolarHBondContact O-CB 3.49Å; S17-L20 PolarHBondContact O-N 3.44Å; N18-L20 VanDerWaalsContact C-N 3.33Å; L20-I22 VanDerWaalsContact C-N 3.34Å; L20-I22 PolarHBondContact O-N 3.28Å; L20-V23 WeakPolarHBondContact O-CB 3.43Å; L20-V23 PolarHBondContact O-N 2.93Å; L20-V23 VanDerWaalsContact O-N 3.11Å; L20-F24 HydrophobicContact CD1-CD2 4.05Å; L20-F24 HydrophobicContact CD1-CE2 3.74Å; L20-F24 HydrophobicContact CD2-CE2 4.36Å; L20-F24 HydrophobicContact CG-CD2 3.95Å; L20-F24 HydrophobicContact CG-CE2 3.84Å; L20-F24 WeakPolarHBondContact O-CD2 3.35Å; L20-F24 PolarHBondContact O-N 3.5Å; L20-F24 VanDerWaalsContact O-N 3.11Å; L20-I201 HydrophobicContact CD2-CD1 4.24Å; L20-I201 HydrophobicContact CD2-CG2 3.94Å
21F97.9Very high95.7Very high0 Ų047.2 Ų47.20%026%0.262CS..Hα-helixtrans-61.1-41.7178.9-61.8-13.1000112.2S17 N18 L19 V23 F24 D25 V68 L90 F198 I201 K202 Y205S17-F21 WeakPolarHBondContact O-CD1 3.4Å; S17-F21 WeakPolarHBondContact O-CD2 3.32Å; S17-F21 WeakPolarHBondContact O-CG 3.16Å; S17-F21 PolarHBondContact O-N 3.18Å; N18-F21 PolarHBondContact O-N 3.33Å; L19-F21 VanDerWaalsContact C-N 3.33Å; F21-V23 VanDerWaalsContact C-N 3.27Å; F21-V23 PolarHBondContact O-N 2.9Å; F21-F24 PolarHBondContact O-N 2.95Å; F21-D25 WeakPolarHBondContact O-CB 3.39Å; F21-D25 PolarHBondContact O-N 3.39Å; F21-V68 HydrophobicContact CB-CG2 3.75Å; F21-V68 HydrophobicContact CD2-CG2 4.23Å; F21-L90 HydrophobicContact CD2-CD1 3.79Å; F21-L90 HydrophobicContact CD2-CD2 4.49Å; F21-L90 HydrophobicContact CE2-CD1 3.6Å; F21-F198 HydrophobicContact CB-CE2 4.05Å; F21-F198 HydrophobicContact CB-CZ 4.12Å; F21-F198 HydrophobicContact CD1-CD2 4.35Å; F21-F198 AromaticContact CD1-CE2 3.51Å; F21-F198 HydrophobicContact CD1-CE2 3.51Å; F21-F198 HydrophobicContact CD1-CZ 4.39Å; F21-F198 HydrophobicContact CE1-CE2 4.18Å; F21-F198 AromaticContact CG-CE2 3.99Å; F21-F198 HydrophobicContact CG-CE2 3.99Å; F21-F198 HydrophobicContact CG-CZ 4.46Å; F21-I201 HydrophobicContact CE1-CG2 3.78Å; F21-K202 HydrophobicContact CE1-CG 4.12Å; F21-K202 HydrophobicContact CZ-CG 4.18Å; F21-Y205 AromaticContact CE2-CD1 3.66Å; F21-Y205 HydrophobicContact CE2-CD1 3.66Å; F21-Y205 HydrophobicContact CE2-CD2 4.4Å; F21-Y205 AromaticContact CE2-CE1 3.94Å; F21-Y205 HydrophobicContact CE2-CE1 3.94Å; F21-Y205 AromaticContact CE2-CG 3.89Å; F21-Y205 HydrophobicContact CE2-CG 3.89Å; F21-Y205 AromaticContact CZ-CD1 3.79Å; F21-Y205 HydrophobicContact CZ-CD1 3.79Å; F21-Y205 HydrophobicContact CZ-CD2 4.35Å; F21-Y205 AromaticContact CZ-CG 3.67Å; F21-Y205 HydrophobicContact CZ-CG 3.67Å
22I98.2Very high96.2Very high35 Ų3545 Ų4518%0.17925%0.25CC..Hα-helixtrans-54.5-45.3173.5-72.2166.4000111.1N18 L19 L20 D25 I26 L65 V68 F72N18-I22 WeakPolarHBondContact O-CG1 3.47Å; N18-I22 PolarHBondContact O-N 3.46Å; L19-I22 PolarHBondContact O-N 2.93Å; L20-I22 VanDerWaalsContact C-N 3.34Å; L20-I22 PolarHBondContact O-N 3.28Å; I22-D25 PolarHBondContact O-N 3.33Å; I22-I26 HydrophobicContact CG2-CD1 3.63Å; I22-I26 HydrophobicContact CG2-CG1 4.34Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 VanDerWaalsContact O-CG1 3.23Å; I22-I26 WeakPolarHBondContact O-CG1 3.36Å; I22-I26 PolarHBondContact O-N 3Å; I22-L65 HydrophobicContact CB-CD2 4.37Å; I22-L65 HydrophobicContact CG1-CD2 4.22Å; I22-L65 HydrophobicContact CG2-CD2 4.19Å; I22-V68 HydrophobicContact CD1-CG1 3.88Å; I22-V68 HydrophobicContact CG1-CB 4.43Å; I22-V68 HydrophobicContact CG1-CG1 3.69Å; I22-F72 HydrophobicContact CD1-CE2 3.77Å
23V97.9Very high96.6Very high94 Ų9445.5 Ų45.557%0.5725%0.252SS*.Hα-helixtrans-62.6-45.9-179.9176.80000111L19 L20 F21 A27L19-V23 PolarHBondContact O-N 3.45Å; L20-V23 WeakPolarHBondContact O-CB 3.43Å; L20-V23 PolarHBondContact O-N 2.93Å; L20-V23 VanDerWaalsContact O-N 3.11Å; F21-V23 VanDerWaalsContact C-N 3.27Å; F21-V23 PolarHBondContact O-N 2.9Å; V23-A27 PolarHBondContact O-N 3.5Å
24F98Very high97Very high40 Ų4049.8 Ų49.818%0.17526%0.263CS..Hα-helixtrans-65.1-44.8177.7-86.3-91.3000112.4L20 F21 I26 A27 L28 I194 A197 F198 I201L20-F24 HydrophobicContact CD1-CD2 4.05Å; L20-F24 HydrophobicContact CD1-CE2 3.74Å; L20-F24 HydrophobicContact CD2-CE2 4.36Å; L20-F24 HydrophobicContact CG-CD2 3.95Å; L20-F24 HydrophobicContact CG-CE2 3.84Å; L20-F24 WeakPolarHBondContact O-CD2 3.35Å; L20-F24 PolarHBondContact O-N 3.5Å; L20-F24 VanDerWaalsContact O-N 3.11Å; F21-F24 PolarHBondContact O-N 2.95Å; F24-I26 PolarHBondContact O-N 2.89Å; F24-A27 WeakPolarHBondContact O-CB 3.31Å; F24-A27 PolarHBondContact O-N 3.07Å; F24-L28 WeakPolarHBondContact O-CG 3.36Å; F24-L28 PolarHBondContact O-N 2.95Å; F24-I194 HydrophobicContact CD1-CG2 3.77Å; F24-I194 HydrophobicContact CE1-CG2 4.13Å; F24-A197 HydrophobicContact CE1-CB 4.4Å; F24-F198 HydrophobicContact CB-CD1 3.74Å; F24-F198 HydrophobicContact CB-CD2 3.59Å; F24-F198 HydrophobicContact CB-CE1 3.56Å; F24-F198 HydrophobicContact CB-CE2 3.45Å; F24-F198 VanDerWaalsContact CB-CE2 3.45Å; F24-F198 HydrophobicContact CB-CG 3.73Å; F24-F198 HydrophobicContact CB-CZ 3.41Å; F24-F198 VanDerWaalsContact CB-CZ 3.41Å; F24-F198 HydrophobicContact CD1-CB 3.62Å; F24-F198 HydrophobicContact CD1-CD1 4.28Å; F24-F198 AromaticContact CD1-CD2 3.93Å; F24-F198 HydrophobicContact CD1-CD2 3.93Å; F24-F198 AromaticContact CD1-CG 3.72Å; F24-F198 HydrophobicContact CD1-CG 3.72Å; F24-F198 HydrophobicContact CD2-CD2 4.17Å; F24-F198 HydrophobicContact CD2-CE2 4.38Å; F24-F198 HydrophobicContact CE1-CB 4.06Å; F24-F198 HydrophobicContact CG-CB 4.25Å; F24-F198 HydrophobicContact CG-CD1 4.32Å; F24-F198 AromaticContact CG-CD2 3.64Å; F24-F198 HydrophobicContact CG-CD2 3.64Å; F24-F198 AromaticContact CG-CE2 3.95Å; F24-F198 HydrophobicContact CG-CE2 3.95Å; F24-F198 AromaticContact CG-CG 3.84Å; F24-F198 HydrophobicContact CG-CG 3.84Å; F24-F198 HydrophobicContact CG-CZ 4.37Å; F24-I201 HydrophobicContact CE1-CD1 4.38Å; F24-I201 HydrophobicContact CE2-CD1 3.68Å; F24-I201 HydrophobicContact CZ-CD1 3.55Å
25D98.3Very high97.3Very high0 Ų050 Ų500%026%0.264CS..Hα-helixtrans-63.9-40.1179-71.6-45.8000111.4F21 I22 A27 L28 L29 G64 L65 F198F21-D25 WeakPolarHBondContact O-CB 3.39Å; F21-D25 PolarHBondContact O-N 3.39Å; I22-D25 PolarHBondContact O-N 3.33Å; D25-A27 VanDerWaalsContact C-N 3.34Å; D25-A27 PolarHBondContact O-N 3.49Å; D25-L28 PolarHBondContact O-N 3Å; D25-L29 WeakPolarHBondContact O-CG 3.42Å; D25-L29 PolarHBondContact O-N 2.99Å; D25-G64 VanDerWaalsContact OD2-C 3.27Å; D25-L65 HydrophobicContact CB-CD2 3.79Å; D25-L65 HydrophobicContact CB-CG 3.75Å; D25-L65 PolarHBondContact OD2-N 3.31Å; D25-F198 WeakPolarHBondContact OD1-CE1 3.31Å; D25-F198 WeakPolarHBondContact OD1-CZ 3.4Å
26I98.2Very high97.5Very high91 Ų9148.7 Ų48.747%0.46726%0.258SS..Hα-helixtrans-61.6-42.7173-70.8169.9000110.9I22 F24 L28 L29 A30 L65I22-I26 HydrophobicContact CG2-CD1 3.63Å; I22-I26 HydrophobicContact CG2-CG1 4.34Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 VanDerWaalsContact O-CG1 3.23Å; I22-I26 WeakPolarHBondContact O-CG1 3.36Å; I22-I26 PolarHBondContact O-N 3Å; F24-I26 PolarHBondContact O-N 2.89Å; I26-L28 VanDerWaalsContact C-N 3.35Å; I26-L29 WeakPolarHBondContact O-CB 3.49Å; I26-L29 PolarHBondContact O-N 3.37Å; I26-L29 VanDerWaalsContact O-N 3.16Å; I26-A30 WeakPolarHBondContact O-CB 3.1Å; I26-A30 PolarHBondContact O-N 3.28Å; I26-L65 HydrophobicContact CG1-CD1 4.49Å; I26-L65 HydrophobicContact CG1-CD2 4.32Å
27A97.9Very high97.6Very high31 Ų3148.5 Ų48.526%0.25626%0.258SS..Hα-helixtrans-63.2-42.1176.800000111.8V23 F24 D25 L29 A30 L31V23-A27 PolarHBondContact O-N 3.5Å; F24-A27 WeakPolarHBondContact O-CB 3.31Å; F24-A27 PolarHBondContact O-N 3.07Å; D25-A27 VanDerWaalsContact C-N 3.34Å; D25-A27 PolarHBondContact O-N 3.49Å; A27-L29 PolarHBondContact O-N 2.97Å; A27-A30 PolarHBondContact O-N 3.44Å; A27-L31 WeakPolarHBondContact O-CB 3.26Å; A27-L31 WeakPolarHBondContact O-CG 3.48Å; A27-L31 PolarHBondContact O-N 3.25Å
28L97.6Very high97.7Very high0 Ų048.5 Ų48.50%026%0.257CS..Hα-helixtrans-67.4-17.9175.3-69.7-171.8000113.3F24 D25 I26 P32 V57 I191 I194 F198F24-L28 WeakPolarHBondContact O-CG 3.36Å; F24-L28 PolarHBondContact O-N 2.95Å; D25-L28 PolarHBondContact O-N 3Å; I26-L28 VanDerWaalsContact C-N 3.35Å; L28-P32 WeakPolarHBondContact O-CD 2.97Å; L28-P32 WeakPolarHBondContact O-CG 3.35Å; L28-V57 HydrophobicContact CB-CG1 3.78Å; L28-V57 HydrophobicContact CD1-CG1 4.37Å; L28-V57 HydrophobicContact CD2-CG1 3.79Å; L28-V57 HydrophobicContact CG-CG1 4.18Å; L28-V57 WeakPolarHBondContact O-CG1 2.99Å; L28-I191 HydrophobicContact CD2-CG2 4.43Å; L28-I194 HydrophobicContact CD2-CB 4.18Å; L28-I194 HydrophobicContact CD2-CG2 3.64Å; L28-I194 HydrophobicContact CG-CG2 4.18Å; L28-F198 HydrophobicContact CD1-CD1 3.67Å; L28-F198 HydrophobicContact CD1-CE1 4.01Å
29L97.4Very high97.7Very high27 Ų2748.6 Ų48.614%0.14126%0.258CS..Hα-helixtrans-84.5-53.9168.6-69.5168000112D25 I26 A27 L31 P32 I33 I58 I62 L65D25-L29 WeakPolarHBondContact O-CG 3.42Å; D25-L29 PolarHBondContact O-N 2.99Å; I26-L29 WeakPolarHBondContact O-CB 3.49Å; I26-L29 PolarHBondContact O-N 3.37Å; I26-L29 VanDerWaalsContact O-N 3.16Å; A27-L29 PolarHBondContact O-N 2.97Å; L29-L31 PolarHBondContact O-N 3.44Å; L29-P32 WeakPolarHBondContact O-CD 3.39Å; L29-I33 HydrophobicContact CB-CD1 4.41Å; L29-I33 WeakPolarHBondContact O-CB 3.47Å; L29-I33 VanDerWaalsContact O-CD1 3.26Å; L29-I33 WeakPolarHBondContact O-CD1 3.31Å; L29-I33 WeakPolarHBondContact O-CG1 3.33Å; L29-I33 PolarHBondContact O-N 3.28Å; L29-I58 HydrophobicContact CD2-CB 4.42Å; L29-I58 HydrophobicContact CD2-CG2 3.9Å; L29-I58 WeakPolarHBondContact CD2-O 3.45Å; L29-I62 HydrophobicContact CD2-CD1 4.44Å; L29-I62 HydrophobicContact CD2-CG1 3.58Å; L29-L65 HydrophobicContact CD1-CD1 3.46Å; L29-L65 VanDerWaalsContact CD1-CD1 3.46Å; L29-L65 HydrophobicContact CD1-CG 4.4Å
30A98.3Very high97.7Very high53 Ų5345.8 Ų45.844%0.43825%0.248SC..Hα-helixtrans-65.5-41.8-17000000112.5I26 A27 I33 R34I26-A30 WeakPolarHBondContact O-CB 3.1Å; I26-A30 PolarHBondContact O-N 3.28Å; A27-A30 PolarHBondContact O-N 3.44Å; A30-I33 PolarHBondContact O-N 3.3Å; A30-R34 WeakPolarHBondContact O-CB 3.39Å; A30-R34 PolarHBondContact O-N 3.49Å
31L98.3Very high97.7Very high57 Ų5746.7 Ų46.730%0.29825%0.254SS..Hα-helixtrans-65-53.1-175.3-66.4172.2000112.3A27 L29 I33 R34 T35 I190 I191 I194A27-L31 WeakPolarHBondContact O-CB 3.26Å; A27-L31 WeakPolarHBondContact O-CG 3.48Å; A27-L31 PolarHBondContact O-N 3.25Å; L29-L31 PolarHBondContact O-N 3.44Å; L31-I33 PolarHBondContact O-N 2.81Å; L31-R34 PolarHBondContact O-N 3.29Å; L31-T35 PolarHBondContact O-N 3.09Å; L31-T35 VanDerWaalsContact O-N 3.13Å; L31-T35 PolarHBondContact O-OG1 2.81Å; L31-I190 HydrophobicContact CD1-CG2 4.17Å; L31-I191 HydrophobicContact CB-CG1 4.26Å; L31-I194 HydrophobicContact CD1-CD1 3.38Å
32P98.3Very high97.6Very high0 Ų046.8 Ų46.80%025%0.254CS..Hα-helixtrans-64.4-36.9176-21.433.4000113.4L28 L29 R34 T35 L36 F54 V57 I58 I191L28-P32 WeakPolarHBondContact O-CD 2.97Å; L28-P32 WeakPolarHBondContact O-CG 3.35Å; L29-P32 WeakPolarHBondContact O-CD 3.39Å; P32-R34 VanDerWaalsContact C-N 3.34Å; P32-R34 PolarHBondContact O-N 2.87Å; P32-T35 PolarHBondContact O-N 2.87Å; P32-L36 WeakPolarHBondContact O-CB 3.39Å; P32-L36 VanDerWaalsContact O-CG 3.27Å; P32-L36 WeakPolarHBondContact O-CG 3.37Å; P32-L36 PolarHBondContact O-N 3.41Å; P32-F54 HydrophobicContact CB-CB 3.93Å; P32-F54 HydrophobicContact CB-CD1 3.92Å; P32-F54 HydrophobicContact CB-CG 4.33Å; P32-V57 HydrophobicContact CG-CB 4.26Å; P32-V57 HydrophobicContact CG-CG1 3.99Å; P32-I58 HydrophobicContact CB-CD1 3.9Å; P32-I58 HydrophobicContact CB-CG1 3.72Å; P32-I58 HydrophobicContact CG-CG1 4.22Å; P32-I191 HydrophobicContact CB-CD1 4.39Å; P32-I191 HydrophobicContact CG-CD1 3.8Å; P32-I191 HydrophobicContact CG-CG1 4.38Å
33I98.5Very high97.4Very high89 Ų8946.6 Ų46.646%0.45625%0.253SS..Hα-helixtrans-59.4-48.1177.7-71.8168.8000109.9L29 A30 L31 T35 L36 D37 I58L29-I33 HydrophobicContact CB-CD1 4.41Å; L29-I33 WeakPolarHBondContact O-CB 3.47Å; L29-I33 VanDerWaalsContact O-CD1 3.26Å; L29-I33 WeakPolarHBondContact O-CD1 3.31Å; L29-I33 WeakPolarHBondContact O-CG1 3.33Å; L29-I33 PolarHBondContact O-N 3.28Å; A30-I33 PolarHBondContact O-N 3.3Å; L31-I33 PolarHBondContact O-N 2.81Å; I33-T35 VanDerWaalsContact C-N 3.33Å; I33-T35 PolarHBondContact O-N 2.86Å; I33-L36 PolarHBondContact O-N 3.04Å; I33-D37 WeakPolarHBondContact O-CB 3.46Å; I33-D37 PolarHBondContact O-N 3.02Å; I33-I58 HydrophobicContact CG1-CD1 3.65Å; I33-I58 HydrophobicContact CG1-CG1 4.02Å
34R98.2Very high97.2Very high164 Ų16443.5 Ų43.562%0.61923%0.234SC*.Hα-helixtrans-57.7-45.1176.2-178.5-177.1178.1-129.8-1111.8A30 L31 P32 D37 V38A30-R34 WeakPolarHBondContact O-CB 3.39Å; A30-R34 PolarHBondContact O-N 3.49Å; L31-R34 PolarHBondContact O-N 3.29Å; P32-R34 VanDerWaalsContact C-N 3.34Å; P32-R34 PolarHBondContact O-N 2.87Å; R34-D37 PolarHBondContact O-N 2.72Å; R34-V38 PolarHBondContact O-N 3.46Å; R34-V38 VanDerWaalsContact O-N 3.16Å
35T97.7Very high97.1Very high5 Ų541.6 Ų41.63%0.03123%0.226CC..Hα-helixtrans-67-37.3179.2-55.80000112.2L31 P32 I33 D37 V38 L39 F54 Y183 I184 C187L31-T35 PolarHBondContact O-N 3.09Å; L31-T35 VanDerWaalsContact O-N 3.13Å; L31-T35 PolarHBondContact O-OG1 2.81Å; P32-T35 PolarHBondContact O-N 2.87Å; I33-T35 VanDerWaalsContact C-N 3.33Å; I33-T35 PolarHBondContact O-N 2.86Å; T35-D37 VanDerWaalsContact C-N 3.34Å; T35-V38 PolarHBondContact O-N 3.42Å; T35-L39 PolarHBondContact O-N 2.92Å; T35-F54 HydrophobicContact CG2-CE1 3.97Å; T35-F54 HydrophobicContact CG2-CE2 3.77Å; T35-F54 HydrophobicContact CG2-CZ 3.43Å; T35-F54 VanDerWaalsContact CG2-CZ 3.43Å; T35-Y183 HydrophobicContact CG2-CE1 4.44Å; T35-I184 HydrophobicContact CG2-CD1 3.38Å; T35-C187 HydrophobicContact CG2-CB 4.06Å
36L97.9Very high96.9Very high35 Ų3541.8 Ų41.818%0.18323%0.227CC..Hα-helixtrans-67.4-34.6175.7-74.7177.9000112.6P32 I33 L39 A40 K50 F54 I58P32-L36 WeakPolarHBondContact O-CB 3.39Å; P32-L36 VanDerWaalsContact O-CG 3.27Å; P32-L36 WeakPolarHBondContact O-CG 3.37Å; P32-L36 PolarHBondContact O-N 3.41Å; I33-L36 PolarHBondContact O-N 3.04Å; L36-L39 PolarHBondContact O-N 3.48Å; L36-A40 WeakPolarHBondContact O-CB 3.38Å; L36-A40 PolarHBondContact O-N 3.25Å; L36-K50 HydrophobicContact CD2-CB 4.03Å; L36-K50 HydrophobicContact CD2-CD 3.78Å; L36-K50 HydrophobicContact CD2-CG 3.78Å; L36-F54 HydrophobicContact CD1-CB 3.9Å; L36-F54 HydrophobicContact CD2-CB 3.84Å; L36-F54 HydrophobicContact CD2-CD2 3.81Å; L36-F54 HydrophobicContact CD2-CG 4.21Å; L36-F54 HydrophobicContact CG-CB 3.78Å; L36-F54 HydrophobicContact CG-CD2 4.3Å; L36-F54 HydrophobicContact CG-CG 4.29Å; L36-I58 HydrophobicContact CD1-CD1 3.57Å
37D97.3Very high96.6Very high111 Ų11141.4 Ų41.459%0.59423%0.226SC*.Hα-helixtrans-64.2-46.3175.1-169.751.1000111.1I33 R34 T35 L39 A40I33-D37 WeakPolarHBondContact O-CB 3.46Å; I33-D37 PolarHBondContact O-N 3.02Å; R34-D37 PolarHBondContact O-N 2.72Å; T35-D37 VanDerWaalsContact C-N 3.34Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 3.44Å; D37-A40 VanDerWaalsContact O-CB 3.29Å; D37-A40 WeakPolarHBondContact O-CB 3.3Å; D37-A40 PolarHBondContact O-N 3Å
38V96.4Very high96.4Very high20 Ų2046.9 Ų46.912%0.12124%0.241CC..Hα-helixtrans-58.4-45.8172.5173.60000111.3R34 T35 A40 N41 Y42 F143 Y183R34-V38 PolarHBondContact O-N 3.46Å; R34-V38 VanDerWaalsContact O-N 3.16Å; T35-V38 PolarHBondContact O-N 3.42Å; V38-A40 PolarHBondContact O-N 3.42Å; V38-N41 WeakPolarHBondContact O-CB 3.34Å; V38-N41 PolarHBondContact O-N 3.2Å; V38-Y42 HydrophobicContact CG1-CE2 4.22Å; V38-Y42 WeakPolarHBondContact O-CD2 3.36Å; V38-Y42 WeakPolarHBondContact O-CE2 3.25Å; V38-F143 HydrophobicContact CG1-CZ 4.29Å; V38-Y183 HydrophobicContact CB-CE1 4.39Å; V38-Y183 HydrophobicContact CG1-CE1 3.89Å
39L96.5Very high96.2Very high1 Ų149.6 Ų49.61%0.00525%0.253CS..Hα-helixtrans-64.5-25.9176.6-103.659.7000113.4T35 L36 D37 N41 Y42 N43 L46 K50 F111 L180 I184T35-L39 PolarHBondContact O-N 2.92Å; L36-L39 PolarHBondContact O-N 3.48Å; D37-L39 VanDerWaalsContact C-N 3.34Å; D37-L39 PolarHBondContact O-N 3.44Å; L39-N41 PolarHBondContact O-N 3.19Å; L39-Y42 PolarHBondContact O-N 3.01Å; L39-Y42 VanDerWaalsContact O-N 3.11Å; L39-N43 PolarHBondContact O-N 3.4Å; L39-L46 HydrophobicContact CG-CD1 4.33Å; L39-K50 HydrophobicContact CD2-CG 4.13Å; L39-F111 HydrophobicContact CD2-CE2 4.15Å; L39-L180 HydrophobicContact CD1-CD1 4.47Å; L39-I184 HydrophobicContact CD1-CD1 3.13Å; L39-I184 HydrophobicContact CD1-CG1 3.86Å; L39-I184 HydrophobicContact CD2-CD1 4.03Å; L39-I184 HydrophobicContact CG-CD1 4.22Å
40A96.3Very high96Very high36 Ų3651.9 Ų51.930%0.29826%0.262SS..Hα-helixtrans-66.1-29.1-179.500000112.2L36 D37 V38 Y42 N43L36-A40 WeakPolarHBondContact O-CB 3.38Å; L36-A40 PolarHBondContact O-N 3.25Å; D37-A40 VanDerWaalsContact O-CB 3.29Å; D37-A40 WeakPolarHBondContact O-CB 3.3Å; D37-A40 PolarHBondContact O-N 3Å; V38-A40 PolarHBondContact O-N 3.42Å; A40-Y42 PolarHBondContact O-N 2.99Å; A40-N43 WeakPolarHBondContact CA-ND2 3.45Å; A40-N43 VanDerWaalsContact O-CG 3.3Å; A40-N43 PolarHBondContact O-N 3.4Å; A40-N43 PolarHBondContact O-ND2 2.95Å
41N95.9Very high95.8Very high92 Ų9249.9 Ų49.949%0.49225%0.245SC..THydrogen-bonded Turntrans-64.5-18.2175.1-66.2-28.7000113.2V38 L39 Q135V38-N41 WeakPolarHBondContact O-CB 3.34Å; V38-N41 PolarHBondContact O-N 3.2Å; L39-N41 PolarHBondContact O-N 3.19Å; N41-Q135 WeakPolarHBondContact O-CG 3.27Å; N41-Q135 PolarHBondContact O-OE1 3.41Å
42Y95.8Very high95.7Very high1 Ų150.2 Ų50.20%0.00425%0.249CC..THydrogen-bonded Turntrans-120.418.1-176.2-45.5-58.1000112.9V38 L39 A40 T44 I45 L46 N138 L139 E142 F143V38-Y42 HydrophobicContact CG1-CE2 4.22Å; V38-Y42 WeakPolarHBondContact O-CD2 3.36Å; V38-Y42 WeakPolarHBondContact O-CE2 3.25Å; L39-Y42 PolarHBondContact O-N 3.01Å; L39-Y42 VanDerWaalsContact O-N 3.11Å; A40-Y42 PolarHBondContact O-N 2.99Å; Y42-T44 VanDerWaalsContact C-N 3.27Å; Y42-T44 PolarHBondContact O-N 3.25Å; Y42-I45 HydrophobicContact CD1-CD1 4.24Å; Y42-I45 HydrophobicContact CG-CD1 4.46Å; Y42-I45 WeakPolarHBondContact O-CG1 3.29Å; Y42-I45 PolarHBondContact O-N 3.48Å; Y42-L46 WeakPolarHBondContact O-CB 3.49Å; Y42-L46 WeakPolarHBondContact O-CG 3.28Å; Y42-L46 PolarHBondContact O-N 3.37Å; Y42-N138 HydrophobicContact CE1-CB 4.41Å; Y42-L139 HydrophobicContact CD1-CB 4.05Å; Y42-L139 HydrophobicContact CD1-CD1 4.12Å; Y42-L139 HydrophobicContact CD2-CD1 3.99Å; Y42-L139 HydrophobicContact CE1-CB 3.83Å; Y42-L139 HydrophobicContact CE1-CD1 3.96Å; Y42-L139 HydrophobicContact CE2-CD1 3.8Å; Y42-L139 HydrophobicContact CG-CD1 4.13Å; Y42-E142 PolarHBondContact OH-OE2 2.9Å; Y42-F143 AromaticContact CE2-CE2 3.84Å; Y42-F143 HydrophobicContact CE2-CE2 3.84Å; Y42-F143 AromaticContact CZ-CE2 3.99Å; Y42-F143 WeakPolarHBondContact OH-CE2 3.12Å
43N94.5Very high95.7Very high31 Ų3150.3 Ų50.317%0.16625%0.249CC..THydrogen-bonded Turntrans-55.2-39-174.4-82.4-39.4000112.9L39 A40 D47 Y48 K50L39-N43 PolarHBondContact O-N 3.4Å; A40-N43 WeakPolarHBondContact CA-ND2 3.45Å; A40-N43 VanDerWaalsContact O-CG 3.3Å; A40-N43 PolarHBondContact O-N 3.4Å; A40-N43 PolarHBondContact O-ND2 2.95Å; N43-D47 PolarHBondContact O-N 2.72Å; N43-Y48 HydrophobicContact CB-CD1 3.63Å; N43-Y48 HydrophobicContact CB-CE1 3.62Å; N43-Y48 HydrophobicContact CB-CG 4.23Å; N43-Y48 PolarHBondContact O-N 3.03Å; N43-K50 WeakPolarHBondContact OD1-CE 3.49Å; N43-K50 PolarHBondContact OD1-NZ 3.45Å
44T93.4Very high95.7Very high29 Ų2946 Ų4618%0.17823%0.227CC..THydrogen-bonded Turntrans-76.5-32.2-174.266.10000111.8Y42 Q135Y42-T44 VanDerWaalsContact C-N 3.27Å; Y42-T44 PolarHBondContact O-N 3.25Å; T44-Q135 VanDerWaalsContact N-OE1 3.16Å; T44-Q135 PolarHBondContact OG1-NE2 3.1Å; T44-Q135 VanDerWaalsContact OG1-NE2 3.1Å; T44-Q135 PolarHBondContact OG1-OE1 3.41Å
45I95.7Very high95.6Very high0 Ų041.4 Ų41.40%022%0.218CC..THydrogen-bonded Turntrans-86-15.3179.366.8170000113.2Y42 S118 L119 S122 Y132 Q135 V136 L139Y42-I45 HydrophobicContact CD1-CD1 4.24Å; Y42-I45 HydrophobicContact CG-CD1 4.46Å; Y42-I45 WeakPolarHBondContact O-CG1 3.29Å; Y42-I45 PolarHBondContact O-N 3.48Å; I45-S118 CarbonylContact O-C 3.29Å; I45-S118 VanDerWaalsContact O-CB 3.3Å; I45-S118 WeakPolarHBondContact O-CB 3.42Å; I45-L119 HydrophobicContact CB-CD2 4.37Å; I45-L119 HydrophobicContact CD1-CD2 3.8Å; I45-L119 HydrophobicContact CG1-CD2 4.17Å; I45-S122 WeakPolarHBondContact CA-OG 3.37Å; I45-S122 VanDerWaalsContact CB-OG 3.3Å; I45-S122 WeakPolarHBondContact CB-OG 3.28Å; I45-S122 PolarHBondContact O-OG 3.1Å; I45-S122 VanDerWaalsContact O-OG 3.09Å; I45-Y132 HydrophobicContact CG2-CD1 3.86Å; I45-Y132 HydrophobicContact CG2-CG 4.39Å; I45-Q135 HydrophobicContact CD1-CB 3.99Å; I45-Q135 HydrophobicContact CG1-CB 4.19Å; I45-Q135 HydrophobicContact CG2-CB 3.72Å; I45-V136 HydrophobicContact CD1-CG2 4.23Å; I45-V136 HydrophobicContact CG2-CG2 4.07Å; I45-L139 HydrophobicContact CD1-CB 4.35Å; I45-L139 HydrophobicContact CD1-CD2 3.92Å
46L94.7Very high95.7Very high4 Ų442.9 Ų42.92%0.02123%0.227CC..THydrogen-bonded Turntrans-104.213.3175.1-62.4176.2000113L39 Y42 Y48 F49 A115 L119 L180L39-L46 HydrophobicContact CG-CD1 4.33Å; Y42-L46 WeakPolarHBondContact O-CB 3.49Å; Y42-L46 WeakPolarHBondContact O-CG 3.28Å; Y42-L46 PolarHBondContact O-N 3.37Å; L46-Y48 PolarHBondContact O-N 3.2Å; L46-Y48 VanDerWaalsContact O-N 3.07Å; L46-F49 VanDerWaalsContact O-CB 3.28Å; L46-F49 WeakPolarHBondContact O-CB 3.39Å; L46-F49 PolarHBondContact O-N 3.22Å; L46-A115 HydrophobicContact CD2-CB 4.22Å; L46-L119 HydrophobicContact CD2-CD2 4.25Å; L46-L119 HydrophobicContact CD2-CG 4.15Å; L46-L180 HydrophobicContact CD1-CD2 3.71Å; L46-L180 HydrophobicContact CD2-CD2 3.71Å; L46-L180 HydrophobicContact CG-CD2 4.3Å
47D93Very high95.7Very high83 Ų8341.2 Ų41.244%0.44422%0.219SC..THydrogen-bonded Turntrans4936.7-176.5-59.4-43000113.2N43 F49 S118N43-D47 PolarHBondContact O-N 2.72Å; D47-F49 PolarHBondContact O-N 3.47Å; D47-S118 VanDerWaalsContact OD2-CB 3.22Å; D47-S118 WeakPolarHBondContact OD2-CB 3.45Å; D47-S118 PolarHBondContact OD2-OG 3.35Å
48Y92.3Very high95.8Very high147 Ų14737.3 Ų37.358%0.57620%0.197SC*.THydrogen-bonded Turntrans57.913.4-177-60.4-99.9000114.6N43 L46 K50N43-Y48 HydrophobicContact CB-CD1 3.63Å; N43-Y48 HydrophobicContact CB-CE1 3.62Å; N43-Y48 HydrophobicContact CB-CG 4.23Å; N43-Y48 PolarHBondContact O-N 3.03Å; L46-Y48 PolarHBondContact O-N 3.2Å; L46-Y48 VanDerWaalsContact O-N 3.07Å; Y48-K50 PolarHBondContact O-N 3.24Å
49F93.1Very high95.9Very high56 Ų5642 Ų4225%0.24622%0.216CC..  trans-69.3127.1-178.6-178.9-100.7000111.6L46 D47 Q110 F111 V114L46-F49 VanDerWaalsContact O-CB 3.28Å; L46-F49 WeakPolarHBondContact O-CB 3.39Å; L46-F49 PolarHBondContact O-N 3.22Å; D47-F49 PolarHBondContact O-N 3.47Å; F49-Q110 HydrophobicContact CZ-CG 4.45Å; F49-F111 AromaticContact CD1-CD2 3.9Å; F49-F111 HydrophobicContact CD1-CD2 3.9Å; F49-F111 HydrophobicContact CD1-CE2 4.25Å; F49-F111 HydrophobicContact CE1-CB 4.44Å; F49-F111 AromaticContact CE1-CD2 3.72Å; F49-F111 HydrophobicContact CE1-CD2 3.72Å; F49-V114 HydrophobicContact CB-CG1 3.7Å; F49-V114 HydrophobicContact CD1-CB 3.82Å; F49-V114 HydrophobicContact CD1-CG1 3.61Å; F49-V114 HydrophobicContact CD1-CG2 4.36Å; F49-V114 HydrophobicContact CD2-CB 4.45Å; F49-V114 HydrophobicContact CD2-CG1 3.86Å; F49-V114 HydrophobicContact CD2-CG2 4.35Å; F49-V114 HydrophobicContact CE1-CB 3.91Å; F49-V114 HydrophobicContact CE1-CG1 4.17Å; F49-V114 HydrophobicContact CE1-CG2 4.08Å; F49-V114 HydrophobicContact CE2-CG1 4.4Å; F49-V114 HydrophobicContact CE2-CG2 4.08Å; F49-V114 HydrophobicContact CG-CB 4.1Å; F49-V114 HydrophobicContact CG-CG1 3.43Å; F49-V114 VanDerWaalsContact CG-CG1 3.43Å; F49-V114 HydrophobicContact CG-CG2 4.49Å; F49-V114 HydrophobicContact CZ-CB 4.28Å; F49-V114 HydrophobicContact CZ-CG2 3.94Å
50K93.7Very high95.9Very high75 Ų7541.9 Ų41.933%0.32622%0.216SC..  trans-130.2136176.7-76.3154.1179.2156.50110.1L36 L39 N43 Y48 V52L36-K50 HydrophobicContact CD2-CB 4.03Å; L36-K50 HydrophobicContact CD2-CD 3.78Å; L36-K50 HydrophobicContact CD2-CG 3.78Å; L39-K50 HydrophobicContact CD2-CG 4.13Å; N43-K50 WeakPolarHBondContact OD1-CE 3.49Å; N43-K50 PolarHBondContact OD1-NZ 3.45Å; Y48-K50 PolarHBondContact O-N 3.24Å; K50-V52 PolarHBondContact O-N 2.94Å
51P95.6Very high96Very high12 Ų1240.2 Ų40.28%0.07820%0.202CC..  trans-54.5128.1171.8-27.535.3000112I53 F54 P55 F111 I184 I188P51-I53 HydrophobicContact CB-CG2 4.03Å; P51-I53 PolarHBondContact O-N 3.34Å; P51-I53 VanDerWaalsContact O-N 3.09Å; P51-F54 HydrophobicContact CB-CD2 3.88Å; P51-F54 HydrophobicContact CB-CE2 3.74Å; P51-F54 HydrophobicContact CB-CZ 4.41Å; P51-F54 HydrophobicContact CG-CD2 4.05Å; P51-F54 HydrophobicContact CG-CE2 3.53Å; P51-F54 HydrophobicContact CG-CZ 4.31Å; P51-F54 PolarHBondContact O-N 3.47Å; P51-P55 WeakPolarHBondContact O-CD 3.06Å; P51-F111 HydrophobicContact CG-CB 4.42Å; P51-F111 HydrophobicContact CG-CD2 3.59Å; P51-F111 HydrophobicContact CG-CE2 4.21Å; P51-F111 HydrophobicContact CG-CG 4.21Å; P51-I184 HydrophobicContact CG-CG2 3.87Å; P51-I188 HydrophobicContact CB-CD1 3.98Å; P51-I188 HydrophobicContact CG-CD1 4.13Å
52V95.6Very high96.1Very high64 Ų6439.9 Ų39.939%0.38820%0.199SC..THydrogen-bonded Turntrans-62.7-19.4-175.968.30000114K50 F54 P55 V56 I100K50-V52 PolarHBondContact O-N 2.94Å; V52-F54 VanDerWaalsContact C-N 3.29Å; V52-F54 PolarHBondContact O-N 2.96Å; V52-P55 WeakPolarHBondContact O-CD 3.3Å; V52-P55 WeakPolarHBondContact O-CG 3.38Å; V52-V56 HydrophobicContact CG2-CG2 4.17Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.31Å; V52-V56 PolarHBondContact O-N 3.35Å; V52-I100 HydrophobicContact CG1-CD1 3.99Å
53I97.6Very high96.2Very high1 Ų142 Ų421%0.00521%0.21CC..Hα-helixtrans-61.1-37.5175.7-173.7164.5000112.6P51 V56 V57 I100 S104 I188 I191 I192P51-I53 HydrophobicContact CB-CG2 4.03Å; P51-I53 PolarHBondContact O-N 3.34Å; P51-I53 VanDerWaalsContact O-N 3.09Å; I53-V56 PolarHBondContact O-N 2.89Å; I53-V57 HydrophobicContact CG1-CG2 3.74Å; I53-V57 WeakPolarHBondContact O-CB 3.26Å; I53-V57 VanDerWaalsContact O-CG2 3.25Å; I53-V57 WeakPolarHBondContact O-CG2 3.37Å; I53-V57 PolarHBondContact O-N 2.95Å; I53-I100 HydrophobicContact CB-CD1 4.47Å; I53-I100 HydrophobicContact CB-CG1 3.96Å; I53-I100 HydrophobicContact CG1-CG1 3.89Å; I53-I100 HydrophobicContact CG1-CG2 4.49Å; I53-S104 WeakPolarHBondContact CB-OG 3.32Å; I53-I188 HydrophobicContact CD1-CG2 4.32Å; I53-I188 HydrophobicContact CG2-CD1 4.08Å; I53-I188 HydrophobicContact CG2-CG1 3.87Å; I53-I191 HydrophobicContact CD1-CG2 4.24Å; I53-I191 HydrophobicContact CG1-CG2 4.49Å; I53-I192 HydrophobicContact CD1-CD1 4.4Å; I53-I192 HydrophobicContact CD1-CG1 3.92Å
54F98.1Very high96.4Very high0 Ų040.5 Ų40.50%020%0.202CC..Hα-helixtrans-63.5-57.1-175.9-57.4-45.8000113P32 T35 L36 P51 V52 V56 V57 I58 I184 I188 I191P32-F54 HydrophobicContact CB-CB 3.93Å; P32-F54 HydrophobicContact CB-CD1 3.92Å; P32-F54 HydrophobicContact CB-CG 4.33Å; T35-F54 HydrophobicContact CG2-CE1 3.97Å; T35-F54 HydrophobicContact CG2-CE2 3.77Å; T35-F54 HydrophobicContact CG2-CZ 3.43Å; T35-F54 VanDerWaalsContact CG2-CZ 3.43Å; L36-F54 HydrophobicContact CD1-CB 3.9Å; L36-F54 HydrophobicContact CD2-CB 3.84Å; L36-F54 HydrophobicContact CD2-CD2 3.81Å; L36-F54 HydrophobicContact CD2-CG 4.21Å; L36-F54 HydrophobicContact CG-CB 3.78Å; L36-F54 HydrophobicContact CG-CD2 4.3Å; L36-F54 HydrophobicContact CG-CG 4.29Å; P51-F54 HydrophobicContact CB-CD2 3.88Å; P51-F54 HydrophobicContact CB-CE2 3.74Å; P51-F54 HydrophobicContact CB-CZ 4.41Å; P51-F54 HydrophobicContact CG-CD2 4.05Å; P51-F54 HydrophobicContact CG-CE2 3.53Å; P51-F54 HydrophobicContact CG-CZ 4.31Å; P51-F54 PolarHBondContact O-N 3.47Å; V52-F54 VanDerWaalsContact C-N 3.29Å; V52-F54 PolarHBondContact O-N 2.96Å; F54-V56 VanDerWaalsContact C-N 3.28Å; F54-V56 PolarHBondContact O-N 2.72Å; F54-V57 PolarHBondContact O-N 3.38Å; F54-I58 VanDerWaalsContact O-CG1 3.27Å; F54-I58 WeakPolarHBondContact O-CG1 3.04Å; F54-I58 PolarHBondContact O-N 2.91Å; F54-I184 HydrophobicContact CE2-CD1 4.35Å; F54-I184 HydrophobicContact CE2-CG2 4.36Å; F54-I184 HydrophobicContact CZ-CD1 4.38Å; F54-I184 HydrophobicContact CZ-CG2 4.21Å; F54-I188 HydrophobicContact CE1-CG1 3.78Å; F54-I188 HydrophobicContact CZ-CD1 4.17Å; F54-I188 HydrophobicContact CZ-CG1 3.64Å; F54-I191 HydrophobicContact CD1-CD1 3.83Å; F54-I191 HydrophobicContact CE1-CD1 3.7Å
55P97.8Very high96.6Very high66 Ų6640.5 Ų40.543%0.42920%0.201SC..Hα-helixtrans-63.7-33.1178.925-34.8000113P51 V52 F59P51-P55 WeakPolarHBondContact O-CD 3.06Å; V52-P55 WeakPolarHBondContact O-CD 3.3Å; V52-P55 WeakPolarHBondContact O-CG 3.38Å; P55-F59 WeakPolarHBondContact O-CB 3.44Å; P55-F59 PolarHBondContact O-N 3.21Å
56V98.3Very high96.7Very high37 Ų3745.2 Ų45.222%0.22423%0.226CC..Hα-helixtrans-68.2-44.5179172.80000111.4V52 I53 F54 I58 F59 T60 I96 I100V52-V56 HydrophobicContact CG2-CG2 4.17Å; V52-V56 VanDerWaalsContact O-CG2 3.23Å; V52-V56 WeakPolarHBondContact O-CG2 3.31Å; V52-V56 PolarHBondContact O-N 3.35Å; I53-V56 PolarHBondContact O-N 2.89Å; F54-V56 VanDerWaalsContact C-N 3.28Å; F54-V56 PolarHBondContact O-N 2.72Å; V56-I58 VanDerWaalsContact C-N 3.35Å; V56-F59 WeakPolarHBondContact O-CB 3.35Å; V56-F59 PolarHBondContact O-N 3.45Å; V56-T60 WeakPolarHBondContact O-CG2 3.49Å; V56-T60 PolarHBondContact O-N 2.97Å; V56-I96 HydrophobicContact CG1-CG2 3.57Å; V56-I100 HydrophobicContact CB-CD1 4.31Å; V56-I100 HydrophobicContact CB-CG1 4.02Å; V56-I100 HydrophobicContact CG1-CB 3.9Å; V56-I100 HydrophobicContact CG1-CD1 4.36Å; V56-I100 HydrophobicContact CG1-CG1 3.89Å; V56-I100 HydrophobicContact CG1-CG2 4.03Å; V56-I100 HydrophobicContact CG2-CD1 4.27Å
57V98.3Very high96.9Very high0 Ų045.3 Ų45.30%023%0.227CC..Hα-helixtrans-69.6-34.1178.9173.50000111.4L28 P32 I53 F54 F59 T60 G61 I100 I191L28-V57 HydrophobicContact CB-CG1 3.78Å; L28-V57 HydrophobicContact CD1-CG1 4.37Å; L28-V57 HydrophobicContact CD2-CG1 3.79Å; L28-V57 HydrophobicContact CG-CG1 4.18Å; L28-V57 WeakPolarHBondContact O-CG1 2.99Å; P32-V57 HydrophobicContact CG-CB 4.26Å; P32-V57 HydrophobicContact CG-CG1 3.99Å; I53-V57 HydrophobicContact CG1-CG2 3.74Å; I53-V57 WeakPolarHBondContact O-CB 3.26Å; I53-V57 VanDerWaalsContact O-CG2 3.25Å; I53-V57 WeakPolarHBondContact O-CG2 3.37Å; I53-V57 PolarHBondContact O-N 2.95Å; F54-V57 PolarHBondContact O-N 3.38Å; V57-F59 VanDerWaalsContact C-N 3.34Å; V57-T60 WeakPolarHBondContact CA-OG1 3.33Å; V57-T60 PolarHBondContact O-N 2.84Å; V57-T60 PolarHBondContact O-OG1 3.44Å; V57-G61 PolarHBondContact O-N 3.48Å; V57-I100 HydrophobicContact CG2-CG2 3.98Å; V57-I191 HydrophobicContact CB-CG2 4.42Å; V57-I191 HydrophobicContact CG1-CG2 3.99Å; V57-I191 HydrophobicContact CG2-CG2 3.99Å
58I98.6Very high97.1Very high28 Ų2841.3 Ų41.314%0.14421%0.206CC..Hα-helixtrans-59.8-48.5170.4-68.8166000110L29 P32 I33 L36 F54 V56 T60 G61 I62L29-I58 HydrophobicContact CD2-CB 4.42Å; L29-I58 HydrophobicContact CD2-CG2 3.9Å; L29-I58 WeakPolarHBondContact CD2-O 3.45Å; P32-I58 HydrophobicContact CB-CD1 3.9Å; P32-I58 HydrophobicContact CB-CG1 3.72Å; P32-I58 HydrophobicContact CG-CG1 4.22Å; I33-I58 HydrophobicContact CG1-CD1 3.65Å; I33-I58 HydrophobicContact CG1-CG1 4.02Å; L36-I58 HydrophobicContact CD1-CD1 3.57Å; F54-I58 VanDerWaalsContact O-CG1 3.27Å; F54-I58 WeakPolarHBondContact O-CG1 3.04Å; F54-I58 PolarHBondContact O-N 2.91Å; V56-I58 VanDerWaalsContact C-N 3.35Å; I58-T60 VanDerWaalsContact C-N 3.33Å; I58-T60 PolarHBondContact O-N 3.2Å; I58-G61 PolarHBondContact O-N 2.79Å; I58-I62 HydrophobicContact CG2-CD1 4.28Å; I58-I62 WeakPolarHBondContact O-CG1 3.25Å; I58-I62 PolarHBondContact O-N 3.08Å
59F98.3Very high97.3Very high118 Ų11839.9 Ų39.952%0.51820%0.203SC..Hα-helixtrans-58.5-44.4178.2172.9-99.7000112.1P55 V56 V57 I62 L63 I96P55-F59 WeakPolarHBondContact O-CB 3.44Å; P55-F59 PolarHBondContact O-N 3.21Å; V56-F59 WeakPolarHBondContact O-CB 3.35Å; V56-F59 PolarHBondContact O-N 3.45Å; V57-F59 VanDerWaalsContact C-N 3.34Å; F59-I62 PolarHBondContact O-N 3.33Å; F59-L63 HydrophobicContact CE1-CD2 4.36Å; F59-L63 WeakPolarHBondContact O-CB 3.43Å; F59-L63 PolarHBondContact O-N 3.31Å; F59-I96 HydrophobicContact CE1-CD1 4.34Å
60T97.6Very high97.5Very high0 Ų039.8 Ų39.80%020%0.204CC..Hα-helixtrans-68.5-34.3178.559.30000112.7V56 V57 I58 L63 G64 I96 E97V56-T60 WeakPolarHBondContact O-CG2 3.49Å; V56-T60 PolarHBondContact O-N 2.97Å; V57-T60 WeakPolarHBondContact CA-OG1 3.33Å; V57-T60 PolarHBondContact O-N 2.84Å; V57-T60 PolarHBondContact O-OG1 3.44Å; I58-T60 VanDerWaalsContact C-N 3.33Å; I58-T60 PolarHBondContact O-N 3.2Å; T60-L63 PolarHBondContact O-N 3.49Å; T60-G64 PolarHBondContact O-N 3.35Å; T60-I96 HydrophobicContact CG2-CB 3.67Å; T60-I96 HydrophobicContact CG2-CD1 4.38Å; T60-I96 HydrophobicContact CG2-CG2 3.39Å; T60-E97 HydrophobicContact CG2-CG 4.18Å; T60-E97 WeakPolarHBondContact OG1-CG 3.29Å
61G97.9Very high97.6Very high0 Ų036.2 Ų36.20%019%0.188CC..Hα-helixtrans-63-40.817300000112.7V57 I58 G64 L65V57-G61 PolarHBondContact O-N 3.48Å; I58-G61 PolarHBondContact O-N 2.79Å; G61-G64 PolarHBondContact O-N 3.43Å; G61-L65 WeakPolarHBondContact O-CG 3.24Å; G61-L65 PolarHBondContact O-N 3.38Å
62I98.5Very high97.6Very high86 Ų8638.3 Ų38.344%0.44120%0.196SC..Hα-helixtrans-64.7-48.3174.4-63.3174000110L29 I58 F59 G64 L65 L66L29-I62 HydrophobicContact CD2-CD1 4.44Å; L29-I62 HydrophobicContact CD2-CG1 3.58Å; I58-I62 HydrophobicContact CG2-CD1 4.28Å; I58-I62 WeakPolarHBondContact O-CG1 3.25Å; I58-I62 PolarHBondContact O-N 3.08Å; F59-I62 PolarHBondContact O-N 3.33Å; I62-G64 VanDerWaalsContact C-N 3.29Å; I62-G64 PolarHBondContact O-N 2.94Å; I62-L65 PolarHBondContact O-N 3.45Å; I62-L66 HydrophobicContact CG2-CD1 4.09Å; I62-L66 HydrophobicContact CG2-CG 4.48Å; I62-L66 WeakPolarHBondContact O-CG 3.48Å; I62-L66 PolarHBondContact O-N 2.84Å
63L98Very high97.6Very high44 Ų4439.1 Ų39.123%0.2320%0.198CC..Hα-helixtrans-59.8-40.3178.6-179.863.9000111.7F59 T60 S67 I92 A93F59-L63 HydrophobicContact CE1-CD2 4.36Å; F59-L63 WeakPolarHBondContact O-CB 3.43Å; F59-L63 PolarHBondContact O-N 3.31Å; T60-L63 PolarHBondContact O-N 3.49Å; L63-S67 WeakPolarHBondContact O-CB 3.42Å; L63-S67 PolarHBondContact O-N 3.03Å; L63-S67 PolarHBondContact O-OG 2.96Å; L63-I92 HydrophobicContact CD2-CG2 4.2Å; L63-A93 HydrophobicContact CD2-CB 4.1Å; L63-A93 HydrophobicContact CG-CB 4.41Å
64G97.9Very high97.4Very high0 Ų039.1 Ų39.10%020%0.198CC..Hα-helixtrans-61.2-51.917600000111.7D25 T60 G61 I62 L66 S67 V68D25-G64 VanDerWaalsContact OD2-C 3.27Å; T60-G64 PolarHBondContact O-N 3.35Å; G61-G64 PolarHBondContact O-N 3.43Å; I62-G64 VanDerWaalsContact C-N 3.29Å; I62-G64 PolarHBondContact O-N 2.94Å; G64-L66 PolarHBondContact O-N 3.4Å; G64-S67 WeakPolarHBondContact O-CB 3.4Å; G64-S67 PolarHBondContact O-N 3.32Å; G64-S67 VanDerWaalsContact O-N 3.12Å; G64-V68 WeakPolarHBondContact O-CG2 3.37Å; G64-V68 PolarHBondContact O-N 2.87Å
65L98.2Very high97.1Very high30 Ų3040.7 Ų40.716%0.15721%0.206CC..Hα-helixtrans-56.2-49.3175.8-75.2179.3000112.2I22 D25 I26 L29 G61 I62 S67 V68 F69I22-L65 HydrophobicContact CB-CD2 4.37Å; I22-L65 HydrophobicContact CG1-CD2 4.22Å; I22-L65 HydrophobicContact CG2-CD2 4.19Å; D25-L65 HydrophobicContact CB-CD2 3.79Å; D25-L65 HydrophobicContact CB-CG 3.75Å; D25-L65 PolarHBondContact OD2-N 3.31Å; I26-L65 HydrophobicContact CG1-CD1 4.49Å; I26-L65 HydrophobicContact CG1-CD2 4.32Å; L29-L65 HydrophobicContact CD1-CD1 3.46Å; L29-L65 VanDerWaalsContact CD1-CD1 3.46Å; L29-L65 HydrophobicContact CD1-CG 4.4Å; G61-L65 WeakPolarHBondContact O-CG 3.24Å; G61-L65 PolarHBondContact O-N 3.38Å; I62-L65 PolarHBondContact O-N 3.45Å; L65-S67 VanDerWaalsContact C-N 3.3Å; L65-S67 PolarHBondContact O-N 2.95Å; L65-V68 PolarHBondContact O-N 3.48Å; L65-F69 HydrophobicContact CB-CE2 4.35Å; L65-F69 WeakPolarHBondContact O-CD2 3.33Å; L65-F69 PolarHBondContact O-N 3.4Å
66L98.2Very high96.8Very high98 Ų9847.6 Ų47.651%0.51322%0.224SC..Hα-helixtrans-58.9-43.4177.5-70.6174.9000111.5I62 G64 V68 F69 I70I62-L66 HydrophobicContact CG2-CD1 4.09Å; I62-L66 HydrophobicContact CG2-CG 4.48Å; I62-L66 WeakPolarHBondContact O-CG 3.48Å; I62-L66 PolarHBondContact O-N 2.84Å; G64-L66 PolarHBondContact O-N 3.4Å; L66-V68 VanDerWaalsContact C-N 3.33Å; L66-V68 PolarHBondContact O-N 2.94Å; L66-F69 PolarHBondContact O-N 2.94Å; L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.33Å
67S97.7Very high96.6Very high6 Ų651.9 Ų51.94%0.04224%0.239CC..Hα-helixtrans-61.4-42177.2-58.90000111.5L63 G64 L65 I70 G71 H86 G89L63-S67 WeakPolarHBondContact O-CB 3.42Å; L63-S67 PolarHBondContact O-N 3.03Å; L63-S67 PolarHBondContact O-OG 2.96Å; G64-S67 WeakPolarHBondContact O-CB 3.4Å; G64-S67 PolarHBondContact O-N 3.32Å; G64-S67 VanDerWaalsContact O-N 3.12Å; L65-S67 VanDerWaalsContact C-N 3.3Å; L65-S67 PolarHBondContact O-N 2.95Å; S67-I70 PolarHBondContact O-N 2.79Å; S67-G71 PolarHBondContact O-N 3.22Å; S67-H86 PolarHBondContact O-ND1 2.99Å; S67-G89 WeakPolarHBondContact OG-CA 3.34Å
68V97.8Very high96.1Very high0 Ų060.8 Ų60.80%028%0.278CS..Hα-helixtrans-65.8-43.6176.9171.60000111.8N18 F21 I22 G64 L65 L66 I70 G71 F72 L90N18-V68 HydrophobicContact CB-CG1 3.89Å; N18-V68 WeakPolarHBondContact OD1-CG1 3.36Å; F21-V68 HydrophobicContact CB-CG2 3.75Å; F21-V68 HydrophobicContact CD2-CG2 4.23Å; I22-V68 HydrophobicContact CD1-CG1 3.88Å; I22-V68 HydrophobicContact CG1-CB 4.43Å; I22-V68 HydrophobicContact CG1-CG1 3.69Å; G64-V68 WeakPolarHBondContact O-CG2 3.37Å; G64-V68 PolarHBondContact O-N 2.87Å; L65-V68 PolarHBondContact O-N 3.48Å; L66-V68 VanDerWaalsContact C-N 3.33Å; L66-V68 PolarHBondContact O-N 2.94Å; V68-I70 VanDerWaalsContact C-N 3.34Å; V68-I70 PolarHBondContact O-N 3.21Å; V68-G71 CarbonylContact O-C 3.46Å; V68-G71 WeakPolarHBondContact O-CA 3.36Å; V68-G71 PolarHBondContact O-N 2.88Å; V68-F72 HydrophobicContact CG1-CD2 3.83Å; V68-F72 HydrophobicContact CG1-CE2 3.52Å; V68-F72 WeakPolarHBondContact O-CD2 3.39Å; V68-F72 PolarHBondContact O-N 2.81Å; V68-L90 HydrophobicContact CG2-CD2 4.28Å
69F97.2Very high95.7Very high117 Ų11765.6 Ų65.651%0.51330%0.298SS..Hα-helixtrans-59.5-44.1175.4-76.5-62.8000112.3L65 L66 G71 F72 I73L65-F69 HydrophobicContact CB-CE2 4.35Å; L65-F69 WeakPolarHBondContact O-CD2 3.33Å; L65-F69 PolarHBondContact O-N 3.4Å; L66-F69 PolarHBondContact O-N 2.94Å; F69-G71 PolarHBondContact O-N 3.48Å; F69-F72 PolarHBondContact O-N 2.98Å; F69-I73 WeakPolarHBondContact O-CG1 3.48Å; F69-I73 PolarHBondContact O-N 3.35Å
70I97.1Very high95.2Very high54 Ų5464.2 Ų64.228%0.27730%0.299SS..Hα-helixtrans-60.6-37.5173.7-65.8165.6000110.5L66 S67 V68 I73 G74 F82 V85L66-I70 VanDerWaalsContact O-CG1 3.29Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 3.33Å; S67-I70 PolarHBondContact O-N 2.79Å; V68-I70 VanDerWaalsContact C-N 3.34Å; V68-I70 PolarHBondContact O-N 3.21Å; I70-I73 PolarHBondContact O-N 3.44Å; I70-G74 PolarHBondContact O-N 2.78Å; I70-F82 HydrophobicContact CG2-CB 4.06Å; I70-F82 HydrophobicContact CG2-CD1 4.11Å; I70-F82 WeakPolarHBondContact CG2-O 3.45Å; I70-V85 HydrophobicContact CD1-CG1 4.17Å; I70-V85 HydrophobicContact CG2-CB 4.21Å; I70-V85 HydrophobicContact CG2-CG1 4.03Å
71G95.5Very high95Very high0 Ų069.2 Ų69.20%033%0.329CS..Hα-helixtrans-58.6-48.1173.700000113F14 S67 V68 F69 I73 G74 L75F14-G71 WeakPolarHBondContact CZ-O 3.26Å; S67-G71 PolarHBondContact O-N 3.22Å; V68-G71 CarbonylContact O-C 3.46Å; V68-G71 WeakPolarHBondContact O-CA 3.36Å; V68-G71 PolarHBondContact O-N 2.88Å; F69-G71 PolarHBondContact O-N 3.48Å; G71-I73 PolarHBondContact O-N 3.33Å; G71-G74 PolarHBondContact O-N 3.48Å; G71-L75 PolarHBondContact O-N 2.85Å
72F96.4Very high94.9Very high56 Ų5673.3 Ų73.325%0.24635%0.347CS..Hα-helixtrans-61.8-41.3175-77.6-63.5000112.6N18 L19 I22 V68 F69 G74 L75 W76N18-F72 HydrophobicContact CB-CE1 4.29Å; N18-F72 HydrophobicContact CB-CE2 3.92Å; N18-F72 HydrophobicContact CB-CZ 3.67Å; L19-F72 HydrophobicContact CD2-CZ 4.14Å; L19-F72 HydrophobicContact CG-CZ 4.33Å; I22-F72 HydrophobicContact CD1-CE2 3.77Å; V68-F72 HydrophobicContact CG1-CD2 3.83Å; V68-F72 HydrophobicContact CG1-CE2 3.52Å; V68-F72 WeakPolarHBondContact O-CD2 3.39Å; V68-F72 PolarHBondContact O-N 2.81Å; F69-F72 PolarHBondContact O-N 2.98Å; F72-G74 VanDerWaalsContact C-N 3.32Å; F72-G74 PolarHBondContact O-N 3.05Å; F72-L75 PolarHBondContact O-N 2.65Å; F72-W76 WeakPolarHBondContact O-CB 3.32Å; F72-W76 PolarHBondContact O-N 2.94Å
73I95.8Very high94.5Very high81 Ų8170.3 Ų70.342%0.41533%0.332SS..Hα-helixtrans-61.2-43.7174.4-65.6167.3000110.4F69 I70 G71 L75 W76 K77 F82F69-I73 WeakPolarHBondContact O-CG1 3.48Å; F69-I73 PolarHBondContact O-N 3.35Å; I70-I73 PolarHBondContact O-N 3.44Å; G71-I73 PolarHBondContact O-N 3.33Å; I73-L75 PolarHBondContact O-N 3.34Å; I73-W76 PolarHBondContact O-N 3.44Å; I73-K77 HydrophobicContact CG2-CG 4.19Å; I73-K77 WeakPolarHBondContact O-CB 3.31Å; I73-K77 WeakPolarHBondContact O-CG 3.39Å; I73-K77 PolarHBondContact O-N 3.38Å; I73-F82 HydrophobicContact CG2-CD2 4.1Å; I73-F82 HydrophobicContact CG2-CE2 4.28Å; I73-F82 HydrophobicContact CG2-CG 4.48Å
74G92.3Very high94.3Very high0 Ų073 Ų730%035%0.346CS..Hα-helixtrans-60.4-42.3176.900000113.1I70 G71 F72 K78 K79 F82I70-G74 PolarHBondContact O-N 2.78Å; G71-G74 PolarHBondContact O-N 3.48Å; F72-G74 VanDerWaalsContact C-N 3.32Å; F72-G74 PolarHBondContact O-N 3.05Å; G74-K78 WeakPolarHBondContact O-CA 3.37Å; G74-K78 PolarHBondContact O-N 2.72Å; G74-K79 PolarHBondContact O-N 3.46Å; G74-F82 VanDerWaalsContact CA-CB 3.48Å
75L91.8Very high94.2Very high33 Ų3376.3 Ų76.317%0.17337%0.366CS..Hα-helixtrans-65.6-48.6175.9-174.467.2000111.7W10 F14 I15 G71 F72 I73 K78W10-L75 HydrophobicContact CZ3-CD1 3.97Å; F14-L75 HydrophobicContact CD1-CB 4.44Å; F14-L75 HydrophobicContact CD1-CD2 3.84Å; F14-L75 HydrophobicContact CE1-CB 4.06Å; F14-L75 HydrophobicContact CE1-CD2 4.21Å; I15-L75 HydrophobicContact CD1-CD2 3.92Å; I15-L75 HydrophobicContact CG1-CD2 3.57Å; G71-L75 PolarHBondContact O-N 2.85Å; F72-L75 PolarHBondContact O-N 2.65Å; I73-L75 PolarHBondContact O-N 3.34Å; L75-K78 PolarHBondContact O-N 3.3Å
76W92.2Very high94Very high212 Ų21274.9 Ų74.980%0.80336%0.359SS*.Hα-helixtrans-66.2-46.1-177.8-174.65.9000111.9F72 I73 K78F72-W76 WeakPolarHBondContact O-CB 3.32Å; F72-W76 PolarHBondContact O-N 2.94Å; I73-W76 PolarHBondContact O-N 3.44Å; W76-K78 PolarHBondContact O-N 2.99Å
77K93.2Very high93.8Very high127 Ų12772.3 Ų72.355%0.55235%0.345SS*.Hα-helixtrans-78.8-4.8179.3-61-64.3-175.5-179.70113.1I73 K79I73-K77 HydrophobicContact CG2-CG 4.19Å; I73-K77 WeakPolarHBondContact O-CB 3.31Å; I73-K77 WeakPolarHBondContact O-CG 3.39Å; I73-K77 PolarHBondContact O-N 3.38Å; K77-K79 HydrophobicContact CB-CB 4.37Å; K77-K79 HydrophobicContact CB-CG 3.81Å; K77-K79 PolarHBondContact O-N 2.98Å
78K88.7Confident93.7Very high187 Ų18776 Ų7681%0.81337%0.367SS*.THydrogen-bonded Turntrans49.741.4-173.8-57.9179.2-179176.80111.8G74 L75 W76G74-K78 WeakPolarHBondContact O-CA 3.37Å; G74-K78 PolarHBondContact O-N 2.72Å; L75-K78 PolarHBondContact O-N 3.3Å; W76-K78 PolarHBondContact O-N 2.99Å
79K89.9Confident93.7Very high128 Ų12876.5 Ų76.556%0.55737%0.372SS*.  trans-108.4109.6-177.5-70.4-63.7-177.7177.70109.6G74 K77 V81 F82 I83G74-K79 PolarHBondContact O-N 3.46Å; K77-K79 HydrophobicContact CB-CB 4.37Å; K77-K79 HydrophobicContact CB-CG 3.81Å; K77-K79 PolarHBondContact O-N 2.98Å; K79-V81 PolarHBondContact O-N 3.37Å; K79-F82 HydrophobicContact CB-CD2 3.67Å; K79-F82 HydrophobicContact CB-CE2 4.21Å; K79-F82 HydrophobicContact CG-CD2 4.28Å; K79-F82 HydrophobicContact CG-CE2 4.37Å; K79-F82 PolarHBondContact O-N 3.46Å; K79-I83 PolarHBondContact O-N 2.97Å
80T88.5Confident93.6Very high89 Ų8970.9 Ų70.955%0.54635%0.348SS..Hα-helixtrans-57.9-34.7-177.9-46.90000113F82 I83 L84T80-F82 VanDerWaalsContact C-N 3.34Å; T80-F82 PolarHBondContact O-N 2.99Å; T80-I83 WeakPolarHBondContact O-CB 3.32Å; T80-I83 PolarHBondContact O-N 3.14Å; T80-I83 VanDerWaalsContact O-N 3.1Å; T80-L84 HydrophobicContact CG2-CD1 4.39Å; T80-L84 HydrophobicContact CG2-CG 4.35Å; T80-L84 WeakPolarHBondContact O-CG 3.21Å; T80-L84 PolarHBondContact O-N 2.97Å
81V93.5Very high93.5Very high105 Ų10570.7 Ų70.764%0.63635%0.349SS*.Hα-helixtrans-56.9-45.8178.6177.50000111.6K79 I83 L84 V85K79-V81 PolarHBondContact O-N 3.37Å; V81-I83 VanDerWaalsContact C-N 3.33Å; V81-I83 PolarHBondContact O-N 3.22Å; V81-L84 PolarHBondContact O-N 3.47Å; V81-V85 WeakPolarHBondContact O-CG2 3.39Å; V81-V85 PolarHBondContact O-N 2.95Å
82F94.3Very high93.6Very high86 Ų8674.6 Ų74.638%0.37737%0.369SS..Hα-helixtrans-67.3-34.6177.8-67.2-53.8000112.3I70 I73 G74 K79 T80 L84 V85 H86I70-F82 HydrophobicContact CG2-CB 4.06Å; I70-F82 HydrophobicContact CG2-CD1 4.11Å; I70-F82 WeakPolarHBondContact CG2-O 3.45Å; I73-F82 HydrophobicContact CG2-CD2 4.1Å; I73-F82 HydrophobicContact CG2-CE2 4.28Å; I73-F82 HydrophobicContact CG2-CG 4.48Å; G74-F82 VanDerWaalsContact CA-CB 3.48Å; K79-F82 HydrophobicContact CB-CD2 3.67Å; K79-F82 HydrophobicContact CB-CE2 4.21Å; K79-F82 HydrophobicContact CG-CD2 4.28Å; K79-F82 HydrophobicContact CG-CE2 4.37Å; K79-F82 PolarHBondContact O-N 3.46Å; T80-F82 VanDerWaalsContact C-N 3.34Å; T80-F82 PolarHBondContact O-N 2.99Å; F82-L84 VanDerWaalsContact C-N 3.34Å; F82-V85 PolarHBondContact O-N 3.27Å; F82-H86 WeakPolarHBondContact O-CB 3.49Å; F82-H86 PolarHBondContact O-N 3.01Å
83I91.7Very high93.6Very high24 Ų2471.9 Ų71.912%0.12336%0.357CS..Hα-helixtrans-64.9-40.1174.6-60.5170.6000110.7W10 F14 K79 T80 V81 H86 I87W10-I83 HydrophobicContact CH2-CD1 4.15Å; W10-I83 HydrophobicContact CH2-CG2 4.42Å; F14-I83 HydrophobicContact CE2-CG2 4.46Å; K79-I83 PolarHBondContact O-N 2.97Å; T80-I83 WeakPolarHBondContact O-CB 3.32Å; T80-I83 PolarHBondContact O-N 3.14Å; T80-I83 VanDerWaalsContact O-N 3.1Å; V81-I83 VanDerWaalsContact C-N 3.33Å; V81-I83 PolarHBondContact O-N 3.22Å; I83-H86 WeakPolarHBondContact O-CB 3.39Å; I83-H86 PolarHBondContact O-N 3.41Å; I83-I87 HydrophobicContact CG2-CD1 4.17Å; I83-I87 WeakPolarHBondContact O-CG1 3.48Å; I83-I87 PolarHBondContact O-N 2.94Å
84L91.9Very high93.6Very high99 Ų9968.7 Ų68.752%0.51834%0.341SS..Hα-helixtrans-65-45.3175.6-69.6173.6000111.7T80 V81 F82 H86 I87 V88T80-L84 HydrophobicContact CG2-CD1 4.39Å; T80-L84 HydrophobicContact CG2-CG 4.35Å; T80-L84 WeakPolarHBondContact O-CG 3.21Å; T80-L84 PolarHBondContact O-N 2.97Å; V81-L84 PolarHBondContact O-N 3.47Å; F82-L84 VanDerWaalsContact C-N 3.34Å; L84-H86 VanDerWaalsContact C-N 3.28Å; L84-H86 PolarHBondContact O-N 2.9Å; L84-I87 PolarHBondContact O-N 3.28Å; L84-V88 WeakPolarHBondContact O-CG2 3.06Å; L84-V88 PolarHBondContact O-N 3.12Å
85V95.6Very high93.9Very high71 Ų7173.4 Ų73.443%0.4337%0.365SS..Hα-helixtrans-59-42.5175.8172.80000110.9I70 V81 F82 V88 G89I70-V85 HydrophobicContact CD1-CG1 4.17Å; I70-V85 HydrophobicContact CG2-CB 4.21Å; I70-V85 HydrophobicContact CG2-CG1 4.03Å; V81-V85 WeakPolarHBondContact O-CG2 3.39Å; V81-V85 PolarHBondContact O-N 2.95Å; F82-V85 PolarHBondContact O-N 3.27Å; V85-V88 PolarHBondContact O-N 2.97Å; V85-G89 PolarHBondContact O-N 3.11Å
86H95.1Very high94.2Very high0 Ų074.2 Ų74.20%037%0.369CS..Hα-helixtrans-57.2-49.8173.4162.477.5000112.6N18 S67 F82 I83 L84 V88 G89 L90 Y205N18-H86 PolarHBondContact OD1-CE1 3.46Å; S67-H86 PolarHBondContact O-ND1 2.99Å; F82-H86 WeakPolarHBondContact O-CB 3.49Å; F82-H86 PolarHBondContact O-N 3.01Å; I83-H86 WeakPolarHBondContact O-CB 3.39Å; I83-H86 PolarHBondContact O-N 3.41Å; L84-H86 VanDerWaalsContact C-N 3.28Å; L84-H86 PolarHBondContact O-N 2.9Å; H86-V88 PolarHBondContact O-N 3.27Å; H86-G89 PolarHBondContact O-N 3.22Å; H86-L90 WeakPolarHBondContact CE1-CD1 3.44Å; H86-L90 WeakPolarHBondContact NE2-CD1 3.41Å; H86-L90 WeakPolarHBondContact O-CG 3.19Å; H86-L90 PolarHBondContact O-N 3.43Å; H86-Y205 PolarHBondContact CD2-OH 3.1Å; H86-Y205 AromaticContact NE2-CE1 3.58Å; H86-Y205 AromaticContact NE2-CZ 3.56Å; H86-Y205 PolarHBondContact NE2-OH 3.3Å
87I94.5Very high94.4Very high44 Ų4464.1 Ų64.123%0.22633%0.331CS..Hα-helixtrans-60.8-45.9179.2-74169.4000111.3I83 L84 T91 L206I83-I87 HydrophobicContact CG2-CD1 4.17Å; I83-I87 WeakPolarHBondContact O-CG1 3.48Å; I83-I87 PolarHBondContact O-N 2.94Å; L84-I87 PolarHBondContact O-N 3.28Å; I87-T91 WeakPolarHBondContact O-CB 3.4Å; I87-T91 PolarHBondContact O-N 3.02Å; I87-T91 PolarHBondContact O-OG1 3.04Å; I87-L206 HydrophobicContact CB-CD2 4.46Å; I87-L206 HydrophobicContact CG1-CD2 4.46Å; I87-L206 HydrophobicContact CG2-CD2 3.75Å
88V95.6Very high94.6Very high83 Ų8361.8 Ų61.850%0.50332%0.324SS..Hα-helixtrans-63.5-46.6179.1171.60000110.6L84 V85 H86 T91 I92L84-V88 WeakPolarHBondContact O-CG2 3.06Å; L84-V88 PolarHBondContact O-N 3.12Å; V85-V88 PolarHBondContact O-N 2.97Å; H86-V88 PolarHBondContact O-N 3.27Å; V88-T91 WeakPolarHBondContact O-CB 3.39Å; V88-T91 PolarHBondContact O-N 3.4Å; V88-I92 HydrophobicContact CG1-CD1 3.8Å; V88-I92 HydrophobicContact CG1-CG1 4.46Å; V88-I92 WeakPolarHBondContact O-CG1 3.31Å; V88-I92 PolarHBondContact O-N 3.42Å
89G96.4Very high95Very high10 Ų1056 Ų5610%0.10331%0.307CS..Hα-helixtrans-59.8-47.3178.800000112.9S67 V85 H86 T91 I92 A93S67-G89 WeakPolarHBondContact OG-CA 3.34Å; V85-G89 PolarHBondContact O-N 3.11Å; H86-G89 PolarHBondContact O-N 3.22Å; G89-T91 VanDerWaalsContact C-N 3.32Å; G89-T91 PolarHBondContact O-N 3.42Å; G89-I92 PolarHBondContact O-N 2.95Å; G89-A93 PolarHBondContact O-N 3.45Å
90L95.9Very high95.4Very high0 Ų050.4 Ų50.40%028%0.283CS..Hα-helixtrans-61.1-40.3174.7-74.3-173.8000112.3F21 V68 H86 A93 T94 Y205F21-L90 HydrophobicContact CD2-CD1 3.79Å; F21-L90 HydrophobicContact CD2-CD2 4.49Å; F21-L90 HydrophobicContact CE2-CD1 3.6Å; V68-L90 HydrophobicContact CG2-CD2 4.28Å; H86-L90 WeakPolarHBondContact CE1-CD1 3.44Å; H86-L90 WeakPolarHBondContact NE2-CD1 3.41Å; H86-L90 WeakPolarHBondContact O-CG 3.19Å; H86-L90 PolarHBondContact O-N 3.43Å; L90-A93 PolarHBondContact O-N 3.11Å; L90-T94 WeakPolarHBondContact O-CB 3.44Å; L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 3.43Å; L90-Y205 HydrophobicContact CD1-CD1 4.33Å; L90-Y205 HydrophobicContact CD1-CE1 3.93Å
91T95.5Very high95.8Very high49 Ų4946.4 Ų46.430%0.30126%0.259SS..Hα-helixtrans-63-46.6178.9-57.90000110.8I87 V88 G89 T94 I95I87-T91 WeakPolarHBondContact O-CB 3.4Å; I87-T91 PolarHBondContact O-N 3.02Å; I87-T91 PolarHBondContact O-OG1 3.04Å; V88-T91 WeakPolarHBondContact O-CB 3.39Å; V88-T91 PolarHBondContact O-N 3.4Å; G89-T91 VanDerWaalsContact C-N 3.32Å; G89-T91 PolarHBondContact O-N 3.42Å; T91-T94 PolarHBondContact O-N 2.98Å; T91-I95 HydrophobicContact CG2-CD1 4.03Å; T91-I95 WeakPolarHBondContact O-CG1 3.32Å; T91-I95 PolarHBondContact O-N 3.29Å
92I97.5Very high95.9Very high82 Ų8245.9 Ų45.942%0.42125%0.251SS..Hα-helixtrans-60.7-49.2177-68168.3000110.6L63 V88 G89 T94 I95 I96L63-I92 HydrophobicContact CD2-CG2 4.2Å; V88-I92 HydrophobicContact CG1-CD1 3.8Å; V88-I92 HydrophobicContact CG1-CG1 4.46Å; V88-I92 WeakPolarHBondContact O-CG1 3.31Å; V88-I92 PolarHBondContact O-N 3.42Å; G89-I92 PolarHBondContact O-N 2.95Å; I92-T94 VanDerWaalsContact C-N 3.29Å; I92-T94 PolarHBondContact O-N 3.05Å; I92-I95 PolarHBondContact O-N 2.86Å; I92-I96 HydrophobicContact CG2-CD1 3.9Å; I92-I96 WeakPolarHBondContact O-CG1 3.3Å; I92-I96 PolarHBondContact O-N 2.8Å; I92-I96 VanDerWaalsContact O-N 3.12Å
93A96.6Very high96Very high0 Ų047 Ų470%025%0.253CS..Hα-helixtrans-56.6-44.3177.900000111.6L63 G89 L90 I95 I96 E97L63-A93 HydrophobicContact CD2-CB 4.1Å; L63-A93 HydrophobicContact CG-CB 4.41Å; G89-A93 PolarHBondContact O-N 3.45Å; L90-A93 PolarHBondContact O-N 3.11Å; A93-I95 PolarHBondContact O-N 3.47Å; A93-I96 PolarHBondContact O-N 3.17Å; A93-E97 WeakPolarHBondContact O-CG 3.45Å; A93-E97 PolarHBondContact O-N 3.43Å
94T95.5Very high96.2Very high14 Ų1446.6 Ų46.69%0.08625%0.253CS..Hα-helixtrans-62.1-43.5179-51.30000112.4L90 T91 I92 I96 E97 I98 A199 K202L90-T94 WeakPolarHBondContact O-CB 3.44Å; L90-T94 PolarHBondContact O-N 3.26Å; L90-T94 PolarHBondContact O-OG1 3.43Å; T91-T94 PolarHBondContact O-N 2.98Å; I92-T94 VanDerWaalsContact C-N 3.29Å; I92-T94 PolarHBondContact O-N 3.05Å; T94-I96 VanDerWaalsContact C-N 3.31Å; T94-I96 PolarHBondContact O-N 3.46Å; T94-E97 PolarHBondContact O-N 3.23Å; T94-I98 HydrophobicContact CG2-CD1 3.93Å; T94-I98 HydrophobicContact CG2-CG1 4.47Å; T94-I98 VanDerWaalsContact O-CG1 3.31Å; T94-I98 WeakPolarHBondContact O-CG1 3.25Å; T94-I98 PolarHBondContact O-N 3.26Å; T94-A199 HydrophobicContact CG2-CB 3.86Å; T94-K202 HydrophobicContact CG2-CD 4.39Å; T94-K202 WeakPolarHBondContact OG1-CD 3.42Å
95I97.5Very high96.2Very high98 Ų9844.1 Ų44.150%0.50324%0.244SC..Hα-helixtrans-62.5-41.8178.8-69.1165.9000110.4T91 I92 A93 S99T91-I95 HydrophobicContact CG2-CD1 4.03Å; T91-I95 WeakPolarHBondContact O-CG1 3.32Å; T91-I95 PolarHBondContact O-N 3.29Å; I92-I95 PolarHBondContact O-N 2.86Å; A93-I95 PolarHBondContact O-N 3.47Å; I95-S99 WeakPolarHBondContact O-CB 3.46Å; I95-S99 PolarHBondContact O-N 3.03Å; I95-S99 PolarHBondContact O-OG 3.37Å
96I98.1Very high96.1Very high50 Ų5047.6 Ų47.626%0.25626%0.259SS..Hα-helixtrans-65.2-46.4177.8-62.9167.6000110.5V56 F59 T60 I92 A93 T94 I98 S99 I100V56-I96 HydrophobicContact CG1-CG2 3.57Å; F59-I96 HydrophobicContact CE1-CD1 4.34Å; T60-I96 HydrophobicContact CG2-CB 3.67Å; T60-I96 HydrophobicContact CG2-CD1 4.38Å; T60-I96 HydrophobicContact CG2-CG2 3.39Å; I92-I96 HydrophobicContact CG2-CD1 3.9Å; I92-I96 WeakPolarHBondContact O-CG1 3.3Å; I92-I96 PolarHBondContact O-N 2.8Å; I92-I96 VanDerWaalsContact O-N 3.12Å; A93-I96 PolarHBondContact O-N 3.17Å; T94-I96 VanDerWaalsContact C-N 3.31Å; T94-I96 PolarHBondContact O-N 3.46Å; I96-I98 PolarHBondContact O-N 3.01Å; I96-S99 PolarHBondContact O-N 3.31Å; I96-I100 WeakPolarHBondContact O-CG2 3.29Å; I96-I100 PolarHBondContact O-N 2.94Å
97E97.3Very high95.9Very high0 Ų052.9 Ų52.90%028%0.279CS..Hα-helixtrans-57.8-45.7177.8-75.9166-176.700112.3T60 A93 T94 I100 S101 C195 K202T60-E97 HydrophobicContact CG2-CG 4.18Å; T60-E97 WeakPolarHBondContact OG1-CG 3.29Å; A93-E97 WeakPolarHBondContact O-CG 3.45Å; A93-E97 PolarHBondContact O-N 3.43Å; T94-E97 PolarHBondContact O-N 3.23Å; E97-I100 VanDerWaalsContact O-CG2 3.31Å; E97-I100 WeakPolarHBondContact O-CG2 3.05Å; E97-S101 VanDerWaalsContact O-CB 3.24Å; E97-S101 WeakPolarHBondContact O-CB 3.49Å; E97-S101 PolarHBondContact O-N 2.72Å; E97-S101 PolarHBondContact O-OG 3.12Å; E97-C195 HydrophobicContact CB-CB 4.49Å; E97-K202 VanDerWaalsContact CD-NZ 3.29Å; E97-K202 IonicContact OE1-NZ 3.05Å; E97-K202 PolarHBondContact OE1-NZ 3.44Å; E97-K202 IonicContact OE2-NZ 2.78Å; E97-K202 PolarHBondContact OE2-NZ 2.88Å
98I97Very high95.5Very high78 Ų7855.1 Ų55.140%0.429%0.287SS..Hα-helixtrans-62.9-48176.1-68.7169.4000110T94 I96 I100 S101 I102 A199T94-I98 HydrophobicContact CG2-CD1 3.93Å; T94-I98 HydrophobicContact CG2-CG1 4.47Å; T94-I98 VanDerWaalsContact O-CG1 3.31Å; T94-I98 WeakPolarHBondContact O-CG1 3.25Å; T94-I98 PolarHBondContact O-N 3.26Å; I96-I98 PolarHBondContact O-N 3.01Å; I98-I100 PolarHBondContact O-N 3.34Å; I98-S101 PolarHBondContact O-N 3Å; I98-I102 HydrophobicContact CG2-CD1 3.66Å; I98-I102 HydrophobicContact CG2-CG1 4.39Å; I98-I102 VanDerWaalsContact O-CG1 3.3Å; I98-I102 WeakPolarHBondContact O-CG1 3.45Å; I98-I102 PolarHBondContact O-N 3.4Å; I98-A199 HydrophobicContact CD1-CB 4.08Å; I98-A199 HydrophobicContact CG1-CB 3.98Å
99S97.6Very high95.2Very high67 Ų6755.7 Ų55.747%0.46929%0.287SS..Hα-helixtrans-60.5-44.8-177.5-60.60000112I95 I96 R103I95-S99 WeakPolarHBondContact O-CB 3.46Å; I95-S99 PolarHBondContact O-N 3.03Å; I95-S99 PolarHBondContact O-OG 3.37Å; I96-S99 PolarHBondContact O-N 3.31Å; S99-R103 VanDerWaalsContact O-CB 3.26Å; S99-R103 WeakPolarHBondContact O-CB 3.44Å; S99-R103 PolarHBondContact O-N 2.77Å
100I97.7Very high95Very high9 Ų959 Ų595%0.04630%0.3CS..Hα-helixtrans-71.7-34.5179.6-165.661.8000112.1V52 I53 V56 V57 I96 E97 I98 R103 S104V52-I100 HydrophobicContact CG1-CD1 3.99Å; I53-I100 HydrophobicContact CB-CD1 4.47Å; I53-I100 HydrophobicContact CB-CG1 3.96Å; I53-I100 HydrophobicContact CG1-CG1 3.89Å; I53-I100 HydrophobicContact CG1-CG2 4.49Å; V56-I100 HydrophobicContact CB-CD1 4.31Å; V56-I100 HydrophobicContact CB-CG1 4.02Å; V56-I100 HydrophobicContact CG1-CB 3.9Å; V56-I100 HydrophobicContact CG1-CD1 4.36Å; V56-I100 HydrophobicContact CG1-CG1 3.89Å; V56-I100 HydrophobicContact CG1-CG2 4.03Å; V56-I100 HydrophobicContact CG2-CD1 4.27Å; V57-I100 HydrophobicContact CG2-CG2 3.98Å; I96-I100 WeakPolarHBondContact O-CG2 3.29Å; I96-I100 PolarHBondContact O-N 2.94Å; E97-I100 VanDerWaalsContact O-CG2 3.31Å; E97-I100 WeakPolarHBondContact O-CG2 3.05Å; I98-I100 PolarHBondContact O-N 3.34Å; I100-R103 PolarHBondContact O-N 3.34Å; I100-S104 VanDerWaalsContact O-CB 3.29Å; I100-S104 WeakPolarHBondContact O-CB 3.39Å; I100-S104 PolarHBondContact O-N 2.94Å; I100-S104 PolarHBondContact O-OG 3.19Å
101S96.5Very high94.7Very high5 Ų559.3 Ų59.34%0.03530%0.301CS..Hα-helixtrans-65.1-45.1175.9-63.10000111.6E97 I98 S104 S105 C195E97-S101 VanDerWaalsContact O-CB 3.24Å; E97-S101 WeakPolarHBondContact O-CB 3.49Å; E97-S101 PolarHBondContact O-N 2.72Å; E97-S101 PolarHBondContact O-OG 3.12Å; I98-S101 PolarHBondContact O-N 3Å; S101-S104 PolarHBondContact O-N 3.35Å; S101-S105 WeakPolarHBondContact O-CB 3.23Å; S101-S105 PolarHBondContact O-N 2.89Å; S101-S105 PolarHBondContact O-OG 3.39Å; S101-C195 WeakPolarHBondContact OG-CB 3.44Å
102I96.5Very high94.7Very high94 Ų9459.9 Ų59.948%0.48230%0.3SS..Hα-helixtrans-61.9-52174.3-66.2167.7000109.8I98 S104 S105 L106I98-I102 HydrophobicContact CG2-CD1 3.66Å; I98-I102 HydrophobicContact CG2-CG1 4.39Å; I98-I102 VanDerWaalsContact O-CG1 3.3Å; I98-I102 WeakPolarHBondContact O-CG1 3.45Å; I98-I102 PolarHBondContact O-N 3.4Å; I102-S104 PolarHBondContact O-N 3.44Å; I102-S105 WeakPolarHBondContact O-CB 3.4Å; I102-S105 PolarHBondContact O-N 3.4Å; I102-S105 VanDerWaalsContact O-N 3.14Å; I102-L106 HydrophobicContact CG2-CD1 3.98Å; I102-L106 HydrophobicContact CG2-CG 4.42Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 2.93Å
103R95.9Very high94.6Very high110 Ų11063.1 Ų63.142%0.41531%0.311SS..Hα-helixtrans-55.6-40.3-179.4176.8177.7167.8154.46.5112.4S99 I100 R107S99-R103 VanDerWaalsContact O-CB 3.26Å; S99-R103 WeakPolarHBondContact O-CB 3.44Å; S99-R103 PolarHBondContact O-N 2.77Å; I100-R103 PolarHBondContact O-N 3.34Å; R103-R107 VanDerWaalsContact NE-CZ 3.32Å; R103-R107 PolarHBondContact O-N 3Å
104S95.5Very high94.4Very high16 Ų1665.2 Ų65.211%0.11232%0.323CS..Hα-helixtrans-74.7-38-179.3-560000111.7I53 I100 S101 I102 L106 R107 K108I53-S104 WeakPolarHBondContact CB-OG 3.32Å; I100-S104 VanDerWaalsContact O-CB 3.29Å; I100-S104 WeakPolarHBondContact O-CB 3.39Å; I100-S104 PolarHBondContact O-N 2.94Å; I100-S104 PolarHBondContact O-OG 3.19Å; S101-S104 PolarHBondContact O-N 3.35Å; I102-S104 PolarHBondContact O-N 3.44Å; S104-L106 VanDerWaalsContact C-N 3.27Å; S104-L106 PolarHBondContact O-N 3.02Å; S104-R107 CarbonylContact O-C 3.59Å; S104-R107 PolarHBondContact O-N 3.45Å; S104-R107 VanDerWaalsContact O-N 3.11Å; S104-K108 PolarHBondContact O-N 2.93Å
105S93.1Very high94.3Very high47 Ų4764.6 Ų64.633%0.32932%0.32SS..Hα-helixtrans-62.1-33.6173.5-61.60000112.7S101 I102 K108S101-S105 WeakPolarHBondContact O-CB 3.23Å; S101-S105 PolarHBondContact O-N 2.89Å; S101-S105 PolarHBondContact O-OG 3.39Å; I102-S105 WeakPolarHBondContact O-CB 3.4Å; I102-S105 PolarHBondContact O-N 3.4Å; I102-S105 VanDerWaalsContact O-N 3.14Å; S105-K108 VanDerWaalsContact O-CE 3.3Å; S105-K108 WeakPolarHBondContact O-CE 3.23Å; S105-K108 WeakPolarHBondContact O-CG 3.38Å
106L93.9Very high94.2Very high143 Ų14360.7 Ų60.775%0.74930%0.3SS*.Hα-helixtrans-77.8-18.8176-64.8175.3000113.4I102 S104I102-L106 HydrophobicContact CG2-CD1 3.98Å; I102-L106 HydrophobicContact CG2-CG 4.42Å; I102-L106 WeakPolarHBondContact O-CG 3.46Å; I102-L106 PolarHBondContact O-N 2.93Å; S104-L106 VanDerWaalsContact C-N 3.27Å; S104-L106 PolarHBondContact O-N 3.02Å
107R90.9Very high94.1Very high111 Ų11163.7 Ų63.742%0.41931%0.313SS..THydrogen-bonded Turntrans-122.334.8-173-72.1-166.9-92-171.2-32.2114.2R103 S104 N109 Q110R103-R107 VanDerWaalsContact NE-CZ 3.32Å; R103-R107 PolarHBondContact O-N 3Å; S104-R107 CarbonylContact O-C 3.59Å; S104-R107 PolarHBondContact O-N 3.45Å; S104-R107 VanDerWaalsContact O-N 3.11Å; R107-N109 VanDerWaalsContact C-N 3.29Å; R107-N109 PolarHBondContact O-N 3.33Å; R107-Q110 HydrophobicContact CB-CB 4.28Å; R107-Q110 VanDerWaalsContact O-CB 3.32Å; R107-Q110 WeakPolarHBondContact O-CB 3.4Å; R107-Q110 PolarHBondContact O-N 3.11Å
108K84.6Confident94.1Very high91 Ų9163.9 Ų63.940%0.39631%0.314SS..THydrogen-bonded Turntrans-49.1-47.1-177.8-61.4-177-176.6-175.20113S104 S105 Q110 Q185S104-K108 PolarHBondContact O-N 2.93Å; S105-K108 VanDerWaalsContact O-CE 3.3Å; S105-K108 WeakPolarHBondContact O-CE 3.23Å; S105-K108 WeakPolarHBondContact O-CG 3.38Å; K108-Q110 VanDerWaalsContact C-N 3.28Å; K108-Q110 PolarHBondContact O-N 2.72Å; K108-Q185 PolarHBondContact O-NE2 2.74Å
109N89.7Confident94Very high95 Ų9560.4 Ų60.451%0.50830%0.296SS..THydrogen-bonded Turntrans-80.5-0.4-175.1-60.6-12.5000114.4R107 F111 F112 K113 Y181R107-N109 VanDerWaalsContact C-N 3.29Å; R107-N109 PolarHBondContact O-N 3.33Å; N109-F111 PolarHBondContact O-N 2.98Å; N109-F112 PolarHBondContact O-N 3.24Å; N109-K113 WeakPolarHBondContact O-CG 3.41Å; N109-K113 PolarHBondContact O-N 2.91Å; N109-K113 VanDerWaalsContact O-N 3.12Å; N109-Y181 PolarHBondContact OD1-OH 3.03Å
110Q91.4Very high93.9Very high80 Ų8061.1 Ų61.137%0.37429%0.289SS..Hα-helixtrans-63-43.9-179.3-176.3178.9-11.900111F49 R107 K108 K113 V114F49-Q110 HydrophobicContact CZ-CG 4.45Å; R107-Q110 HydrophobicContact CB-CB 4.28Å; R107-Q110 VanDerWaalsContact O-CB 3.32Å; R107-Q110 WeakPolarHBondContact O-CB 3.4Å; R107-Q110 PolarHBondContact O-N 3.11Å; K108-Q110 VanDerWaalsContact C-N 3.28Å; K108-Q110 PolarHBondContact O-N 2.72Å; Q110-K113 PolarHBondContact O-N 3.01Å; Q110-V114 WeakPolarHBondContact O-CG2 3.36Å; Q110-V114 PolarHBondContact O-N 3.37Å
111F91.5Very high93.7Very high7 Ų763.6 Ų63.63%0.03130%0.302CS..Hα-helixtrans-63.8-45178.7179.9-97.2000111.7L39 F49 P51 N109 K113 V114 A115 L180 Y181 I184L39-F111 HydrophobicContact CD2-CE2 4.15Å; F49-F111 AromaticContact CD1-CD2 3.9Å; F49-F111 HydrophobicContact CD1-CD2 3.9Å; F49-F111 HydrophobicContact CD1-CE2 4.25Å; F49-F111 HydrophobicContact CE1-CB 4.44Å; F49-F111 AromaticContact CE1-CD2 3.72Å; F49-F111 HydrophobicContact CE1-CD2 3.72Å; P51-F111 HydrophobicContact CG-CB 4.42Å; P51-F111 HydrophobicContact CG-CD2 3.59Å; P51-F111 HydrophobicContact CG-CE2 4.21Å; P51-F111 HydrophobicContact CG-CG 4.21Å; N109-F111 PolarHBondContact O-N 2.98Å; F111-K113 VanDerWaalsContact C-N 3.32Å; F111-K113 PolarHBondContact O-N 3.18Å; F111-V114 PolarHBondContact O-N 3.4Å; F111-A115 HydrophobicContact CD1-CB 4.43Å; F111-A115 HydrophobicContact CE1-CB 4.08Å; F111-A115 HydrophobicContact CZ-CB 4.22Å; F111-A115 VanDerWaalsContact O-CB 3.27Å; F111-A115 WeakPolarHBondContact O-CB 3.24Å; F111-A115 PolarHBondContact O-N 3.36Å; F111-L180 HydrophobicContact CE1-CD2 4.3Å; F111-L180 HydrophobicContact CE1-CG 4.01Å; F111-L180 HydrophobicContact CZ-CD2 3.95Å; F111-L180 HydrophobicContact CZ-CG 4Å; F111-Y181 HydrophobicContact CD1-CD2 4.37Å; F111-I184 HydrophobicContact CD1-CB 3.99Å; F111-I184 HydrophobicContact CD1-CG1 4.4Å; F111-I184 HydrophobicContact CD1-CG2 3.86Å; F111-I184 HydrophobicContact CD2-CG2 4.21Å; F111-I184 HydrophobicContact CE1-CB 3.78Å; F111-I184 HydrophobicContact CE1-CG1 3.72Å; F111-I184 HydrophobicContact CE1-CG2 4.01Å; F111-I184 HydrophobicContact CE2-CG1 4.43Å; F111-I184 HydrophobicContact CE2-CG2 4.37Å; F111-I184 HydrophobicContact CG-CG2 3.97Å; F111-I184 HydrophobicContact CZ-CB 4.23Å; F111-I184 HydrophobicContact CZ-CG1 3.74Å; F111-I184 HydrophobicContact CZ-CG2 4.28Å
112F93.8Very high93.6Very high61 Ų6163.4 Ų63.427%0.26830%0.301SS..Hα-helixtrans-56.3-45.8177.1-177.8-108.2000112.2N109 V114 A115 N116 A177 E178 Y181N109-F112 PolarHBondContact O-N 3.24Å; F112-V114 PolarHBondContact O-N 3.25Å; F112-A115 PolarHBondContact O-N 2.99Å; F112-N116 WeakPolarHBondContact O-CB 3.43Å; F112-N116 PolarHBondContact O-N 3.34Å; F112-A177 HydrophobicContact CD2-CB 4.5Å; F112-A177 HydrophobicContact CE2-CB 4.02Å; F112-E178 HydrophobicContact CE2-CB 4.25Å; F112-Y181 HydrophobicContact CB-CD2 3.51Å; F112-Y181 HydrophobicContact CB-CE2 3.91Å; F112-Y181 HydrophobicContact CB-CG 3.92Å; F112-Y181 HydrophobicContact CD2-CD1 4.38Å; F112-Y181 HydrophobicContact CD2-CD2 4.42Å; F112-Y181 AromaticContact CD2-CG 3.94Å; F112-Y181 HydrophobicContact CD2-CG 3.94Å; F112-Y181 HydrophobicContact CG-CD2 4.38Å; F112-Y181 HydrophobicContact CG-CG 4.33Å
113K95.1Very high93.4Very high150 Ų15059.6 Ų59.665%0.65228%0.281SS*.Hα-helixtrans-60.2-46.4-180-72.8179.4-179.2-173.60112N109 Q110 F111 Q117N109-K113 WeakPolarHBondContact O-CG 3.41Å; N109-K113 PolarHBondContact O-N 2.91Å; N109-K113 VanDerWaalsContact O-N 3.12Å; Q110-K113 PolarHBondContact O-N 3.01Å; F111-K113 VanDerWaalsContact C-N 3.32Å; F111-K113 PolarHBondContact O-N 3.18Å; K113-Q117 PolarHBondContact O-N 3.43Å; K113-Q117 VanDerWaalsContact O-N 3.14Å
114V92.6Very high93.1Very high43 Ų4358.9 Ų58.926%0.26128%0.283SS..Hα-helixtrans-69.2-48.1180-179.60000110.7F49 Q110 F111 F112 N116 Q117 S118F49-V114 HydrophobicContact CB-CG1 3.7Å; F49-V114 HydrophobicContact CD1-CB 3.82Å; F49-V114 HydrophobicContact CD1-CG1 3.61Å; F49-V114 HydrophobicContact CD1-CG2 4.36Å; F49-V114 HydrophobicContact CD2-CB 4.45Å; F49-V114 HydrophobicContact CD2-CG1 3.86Å; F49-V114 HydrophobicContact CD2-CG2 4.35Å; F49-V114 HydrophobicContact CE1-CB 3.91Å; F49-V114 HydrophobicContact CE1-CG1 4.17Å; F49-V114 HydrophobicContact CE1-CG2 4.08Å; F49-V114 HydrophobicContact CE2-CG1 4.4Å; F49-V114 HydrophobicContact CE2-CG2 4.08Å; F49-V114 HydrophobicContact CG-CB 4.1Å; F49-V114 HydrophobicContact CG-CG1 3.43Å; F49-V114 VanDerWaalsContact CG-CG1 3.43Å; F49-V114 HydrophobicContact CG-CG2 4.49Å; F49-V114 HydrophobicContact CZ-CB 4.28Å; F49-V114 HydrophobicContact CZ-CG2 3.94Å; Q110-V114 WeakPolarHBondContact O-CG2 3.36Å; Q110-V114 PolarHBondContact O-N 3.37Å; F111-V114 PolarHBondContact O-N 3.4Å; F112-V114 PolarHBondContact O-N 3.25Å; V114-N116 VanDerWaalsContact C-N 3.32Å; V114-N116 PolarHBondContact O-N 3.11Å; V114-Q117 PolarHBondContact O-N 3.17Å; V114-Q117 VanDerWaalsContact O-N 3.13Å; V114-S118 PolarHBondContact O-N 3.33Å; V114-S118 PolarHBondContact O-OG 3.3Å
115A93.9Very high92.8Very high2 Ų263.6 Ų63.62%0.01730%0.299CS..Hα-helixtrans-58-43.317800000112L46 F111 F112 Q117 S118 L119L46-A115 HydrophobicContact CD2-CB 4.22Å; F111-A115 HydrophobicContact CD1-CB 4.43Å; F111-A115 HydrophobicContact CE1-CB 4.08Å; F111-A115 HydrophobicContact CZ-CB 4.22Å; F111-A115 VanDerWaalsContact O-CB 3.27Å; F111-A115 WeakPolarHBondContact O-CB 3.24Å; F111-A115 PolarHBondContact O-N 3.36Å; F112-A115 PolarHBondContact O-N 2.99Å; A115-Q117 PolarHBondContact O-N 3.05Å; A115-S118 PolarHBondContact O-N 3.47Å; A115-L119 WeakPolarHBondContact O-CB 3.43Å; A115-L119 WeakPolarHBondContact O-CG 3.32Å; A115-L119 PolarHBondContact O-N 2.85Å
116N96.4Very high92.7Very high16 Ų1662.1 Ų62.19%0.08629%0.286CS..Hα-helixtrans-60.9-45.5176.5-165.8-19.9000111.2F112 V114 W120 V148 R149 A177F112-N116 WeakPolarHBondContact O-CB 3.43Å; F112-N116 PolarHBondContact O-N 3.34Å; V114-N116 VanDerWaalsContact C-N 3.32Å; V114-N116 PolarHBondContact O-N 3.11Å; N116-W120 VanDerWaalsContact O-CB 3.28Å; N116-W120 WeakPolarHBondContact O-CB 3.49Å; N116-W120 PolarHBondContact O-N 3.24Å; N116-V148 WeakPolarHBondContact O-CG1 3.27Å; N116-V148 VanDerWaalsContact OD1-CG1 3.28Å; N116-V148 WeakPolarHBondContact OD1-CG1 3.28Å; N116-R149 PolarHBondContact ND2-NE 3.36Å; N116-R149 PolarHBondContact OD1-NE 3.35Å; N116-A177 HydrophobicContact CB-CB 3.96Å
117Q96Very high92.3Very high113 Ų11362.1 Ų62.153%0.52828%0.282SS..Hα-helixtrans-65.8-46.7178.5-175.761.147.600112.6K113 V114 A115 W120 N121K113-Q117 PolarHBondContact O-N 3.43Å; K113-Q117 VanDerWaalsContact O-N 3.14Å; V114-Q117 PolarHBondContact O-N 3.17Å; V114-Q117 VanDerWaalsContact O-N 3.13Å; A115-Q117 PolarHBondContact O-N 3.05Å; Q117-W120 WeakPolarHBondContact O-CB 3.1Å; Q117-W120 PolarHBondContact O-N 2.93Å; Q117-N121 PolarHBondContact O-N 3.48Å
118S95.5Very high92.3Very high4 Ų464.3 Ų64.33%0.02830%0.295CS..Hα-helixtrans-65.9-47.1-179.2-62.40000111.3I45 D47 V114 A115 W120 N121 S122I45-S118 CarbonylContact O-C 3.29Å; I45-S118 VanDerWaalsContact O-CB 3.3Å; I45-S118 WeakPolarHBondContact O-CB 3.42Å; D47-S118 VanDerWaalsContact OD2-CB 3.22Å; D47-S118 WeakPolarHBondContact OD2-CB 3.45Å; D47-S118 PolarHBondContact OD2-OG 3.35Å; V114-S118 PolarHBondContact O-N 3.33Å; V114-S118 PolarHBondContact O-OG 3.3Å; A115-S118 PolarHBondContact O-N 3.47Å; S118-W120 VanDerWaalsContact C-N 3.26Å; S118-W120 PolarHBondContact O-N 3.44Å; S118-N121 WeakPolarHBondContact O-CB 3.22Å; S118-N121 PolarHBondContact O-N 2.93Å; S118-N121 VanDerWaalsContact O-N 3.1Å; S118-S122 PolarHBondContact O-N 3.45Å; S118-S122 PolarHBondContact O-OG 2.89Å; S118-S122 VanDerWaalsContact O-OG 3.04Å
119L96.4Very high92.7Very high4 Ų464.1 Ų64.12%0.02130%0.295CS..Hα-helixtrans-62.3-34.5176.1-70.9173.5000112.2I45 L46 A115 N121 S122 I123 L139 V148 C176 A177I45-L119 HydrophobicContact CB-CD2 4.37Å; I45-L119 HydrophobicContact CD1-CD2 3.8Å; I45-L119 HydrophobicContact CG1-CD2 4.17Å; L46-L119 HydrophobicContact CD2-CD2 4.25Å; L46-L119 HydrophobicContact CD2-CG 4.15Å; A115-L119 WeakPolarHBondContact O-CB 3.43Å; A115-L119 WeakPolarHBondContact O-CG 3.32Å; A115-L119 PolarHBondContact O-N 2.85Å; L119-N121 VanDerWaalsContact C-N 3.34Å; L119-N121 PolarHBondContact O-N 3.44Å; L119-S122 PolarHBondContact O-N 3.49Å; L119-I123 WeakPolarHBondContact O-CG1 3.48Å; L119-I123 PolarHBondContact O-N 3.07Å; L119-L139 HydrophobicContact CD1-CD2 4.33Å; L119-L139 HydrophobicContact CD2-CD2 3.75Å; L119-V148 HydrophobicContact CB-CG1 3.99Å; L119-V148 HydrophobicContact CB-CG2 4.25Å; L119-C176 HydrophobicContact CD1-CB 4.18Å; L119-A177 HydrophobicContact CD1-CB 4.05Å
120W95.8Very high92.8Very high82 Ų8264.3 Ų64.331%0.31130%0.301SS..Hα-helixtrans-58.3-47.9173.4-166.4-90.8000111.7N116 Q117 S118 I123 Q124 V148 D153N116-W120 VanDerWaalsContact O-CB 3.28Å; N116-W120 WeakPolarHBondContact O-CB 3.49Å; N116-W120 PolarHBondContact O-N 3.24Å; Q117-W120 WeakPolarHBondContact O-CB 3.1Å; Q117-W120 PolarHBondContact O-N 2.93Å; S118-W120 VanDerWaalsContact C-N 3.26Å; S118-W120 PolarHBondContact O-N 3.44Å; W120-I123 PolarHBondContact O-N 3.42Å; W120-Q124 WeakPolarHBondContact O-CG 3.36Å; W120-Q124 PolarHBondContact O-N 2.98Å; W120-V148 HydrophobicContact CB-CG2 4.37Å; W120-V148 HydrophobicContact CE3-CB 3.95Å; W120-V148 HydrophobicContact CE3-CG1 4.22Å; W120-V148 HydrophobicContact CE3-CG2 3.78Å; W120-V148 HydrophobicContact CZ3-CB 4.45Å; W120-V148 HydrophobicContact CZ3-CG2 4.46Å; W120-D153 HydrophobicContact CZ3-CB 4.17Å
121N93.3Very high92.8Very high62 Ų6265.9 Ų65.933%0.33231%0.312SS..Hα-helixtrans-60.7-47.2174.9-65.4-19.8000110.7Q117 S118 L119 I123 Q124 Y125Q117-N121 PolarHBondContact O-N 3.48Å; S118-N121 WeakPolarHBondContact O-CB 3.22Å; S118-N121 PolarHBondContact O-N 2.93Å; S118-N121 VanDerWaalsContact O-N 3.1Å; L119-N121 VanDerWaalsContact C-N 3.34Å; L119-N121 PolarHBondContact O-N 3.44Å; N121-I123 VanDerWaalsContact C-N 3.32Å; N121-I123 PolarHBondContact O-N 3.32Å; N121-Q124 PolarHBondContact O-N 3.29Å; N121-Q124 VanDerWaalsContact O-N 3.15Å; N121-Y125 WeakPolarHBondContact O-CD2 3.44Å; N121-Y125 PolarHBondContact O-N 3.31Å
122S93.2Very high92.9Very high0 Ų068.2 Ų68.20%032%0.321CS..Hα-helixtrans-60.2-38.7-179.1-500000113.4I45 S118 L119 Y125 Y126I45-S122 WeakPolarHBondContact CA-OG 3.37Å; I45-S122 VanDerWaalsContact CB-OG 3.3Å; I45-S122 WeakPolarHBondContact CB-OG 3.28Å; I45-S122 PolarHBondContact O-OG 3.1Å; I45-S122 VanDerWaalsContact O-OG 3.09Å; S118-S122 PolarHBondContact O-N 3.45Å; S118-S122 PolarHBondContact O-OG 2.89Å; S118-S122 VanDerWaalsContact O-OG 3.04Å; L119-S122 PolarHBondContact O-N 3.49Å; S122-Y125 CarbonylContact O-C 3.56Å; S122-Y125 PolarHBondContact O-N 3.22Å; S122-Y126 WeakPolarHBondContact O-CA 3.27Å; S122-Y126 PolarHBondContact O-N 3.37Å
123I92.4Very high92.9Very high14 Ų1469.3 Ų69.37%0.07233%0.328CS..Hα-helixtrans-68.4-38176.9-70.5-71.8000111.7L119 W120 N121 Y125 Y126 V136 V148 Y154L119-I123 WeakPolarHBondContact O-CG1 3.48Å; L119-I123 PolarHBondContact O-N 3.07Å; W120-I123 PolarHBondContact O-N 3.42Å; N121-I123 VanDerWaalsContact C-N 3.32Å; N121-I123 PolarHBondContact O-N 3.32Å; I123-Y125 PolarHBondContact O-N 3.03Å; I123-Y126 VanDerWaalsContact O-CB 3.25Å; I123-Y126 WeakPolarHBondContact O-CB 3.14Å; I123-Y126 PolarHBondContact O-N 2.92Å; I123-V136 HydrophobicContact CD1-CG1 3.67Å; I123-V136 HydrophobicContact CD1-CG2 4.36Å; I123-V148 HydrophobicContact CB-CG2 4.13Å; I123-V148 HydrophobicContact CG1-CG2 3.72Å; I123-Y154 HydrophobicContact CD1-CE1 4.14Å; I123-Y154 HydrophobicContact CD1-CE2 4.11Å; I123-Y154 VanDerWaalsContact CD1-OH 3.31Å; I123-Y154 WeakPolarHBondContact CD1-OH 3.28Å; I123-Y154 HydrophobicContact CG2-CD1 4.47Å; I123-Y154 HydrophobicContact CG2-CE1 4.37Å
124Q89.9Confident93Very high96 Ų9666.3 Ų66.345%0.44932%0.319SS..Hα-helixtrans-63.6-29.3176.2-65.6-49.3-70.100112.8W120 N121W120-Q124 WeakPolarHBondContact O-CG 3.36Å; W120-Q124 PolarHBondContact O-N 2.98Å; N121-Q124 PolarHBondContact O-N 3.29Å; N121-Q124 VanDerWaalsContact O-N 3.15Å
125Y90Very high93.2Very high115 Ų11565.8 Ų65.845%0.45131%0.313SS..THydrogen-bonded Turntrans-104.87.9-178-71.3-70000113.1N121 S122 I123 E127 K128 H129 Y132N121-Y125 WeakPolarHBondContact O-CD2 3.44Å; N121-Y125 PolarHBondContact O-N 3.31Å; S122-Y125 CarbonylContact O-C 3.56Å; S122-Y125 PolarHBondContact O-N 3.22Å; I123-Y125 PolarHBondContact O-N 3.03Å; Y125-E127 PolarHBondContact O-N 3.25Å; Y125-K128 HydrophobicContact CD1-CD 4.32Å; Y125-K128 PolarHBondContact O-N 3.17Å; Y125-K128 VanDerWaalsContact O-N 3.07Å; Y125-H129 PolarHBondContact O-N 3.41Å; Y125-H129 VanDerWaalsContact O-N 3.15Å; Y125-Y132 HydrophobicContact CG-CE2 4.47Å
126Y89.8Confident93.3Very high15 Ų1565.9 Ų65.96%0.05931%0.314CS..G310 helixtrans-53.6-52-173.2173.2-94.2000112.4S122 I123 K128 E133 V136 D137 Y154 P162S122-Y126 WeakPolarHBondContact O-CA 3.27Å; S122-Y126 PolarHBondContact O-N 3.37Å; I123-Y126 VanDerWaalsContact O-CB 3.25Å; I123-Y126 WeakPolarHBondContact O-CB 3.14Å; I123-Y126 PolarHBondContact O-N 2.92Å; Y126-K128 VanDerWaalsContact C-N 3.26Å; Y126-K128 PolarHBondContact O-N 3.04Å; Y126-E133 HydrophobicContact CD2-CB 4.45Å; Y126-E133 HydrophobicContact CE1-CG 4.18Å; Y126-E133 HydrophobicContact CE2-CB 4.24Å; Y126-E133 HydrophobicContact CE2-CG 3.94Å; Y126-V136 HydrophobicContact CD2-CB 3.8Å; Y126-V136 HydrophobicContact CD2-CG1 3.78Å; Y126-V136 HydrophobicContact CD2-CG2 4.19Å; Y126-V136 HydrophobicContact CE2-CB 3.86Å; Y126-V136 HydrophobicContact CE2-CG1 3.73Å; Y126-D137 PolarHBondContact OH-OD1 3.32Å; Y126-Y154 HydrophobicContact CD1-CE1 4.05Å; Y126-Y154 HydrophobicContact CE1-CE1 4.33Å; Y126-Y154 HydrophobicContact CG-CE1 4.24Å; Y126-P162 HydrophobicContact CE1-CG 4.34Å
127E86.6Confident93.4Very high144 Ų14466.1 Ų66.167%0.67332%0.315SS*.G310 helixtrans-76-13-177.4-57.6-175.1159.600113.5Y125 R156Y125-E127 PolarHBondContact O-N 3.25Å; E127-R156 IonicContact OE1-CZ 3.08Å; E127-R156 IonicContact OE1-NH1 3.91Å; E127-R156 PolarHBondContact OE1-NH1 3Å
128K90.9Very high93.4Very high156 Ų15663.6 Ų63.668%0.67831%0.305SS*.G310 helixtrans-96.2-20.9-175.9-67.7-179.7-179.9177.20112.9Y125 Y126Y125-K128 HydrophobicContact CD1-CD 4.32Å; Y125-K128 PolarHBondContact O-N 3.17Å; Y125-K128 VanDerWaalsContact O-N 3.07Å; Y126-K128 VanDerWaalsContact C-N 3.26Å; Y126-K128 PolarHBondContact O-N 3.04Å
129H91.8Very high93.5Very high88 Ų8863.5 Ų63.541%0.40730%0.304SS..  trans-128.9107.3-173.1-68-87.4000110.3Y125 N131 Y132 E133Y125-H129 PolarHBondContact O-N 3.41Å; Y125-H129 VanDerWaalsContact O-N 3.15Å; H129-N131 PolarHBondContact O-N 3.46Å; H129-Y132 HydrophobicContact CB-CD2 3.77Å; H129-Y132 HydrophobicContact CB-CE2 4.41Å; H129-Y132 HydrophobicContact CB-CG 3.93Å; H129-Y132 WeakPolarHBondContact O-CB 3.47Å; H129-Y132 PolarHBondContact O-N 3.01Å; H129-E133 PolarHBondContact O-N 3.49Å
130P92Very high93.6Very high98 Ų9863.4 Ų63.464%0.63630%0.304SS*.Hα-helixtrans-54.8-31.6-179.7-28.334.7000114.1N134P130-N134 WeakPolarHBondContact O-CB 3.41Å; P130-N134 PolarHBondContact O-N 3.12Å
131N92.4Very high93.6Very high113 Ų11364.9 Ų64.960%0.60431%0.309SS*.Hα-helixtrans-68.5-37.9176.4-71.1-21000112.6H129 Q135H129-N131 PolarHBondContact O-N 3.46Å; N131-Q135 WeakPolarHBondContact O-CG 3.37Å; N131-Q135 PolarHBondContact O-N 3.44Å
132Y93.8Very high93.7Very high56 Ų5666.6 Ų66.622%0.2232%0.315CS..Hα-helixtrans-70.8-44.2174.8-69.2-11.2000110.4I45 Y125 H129 N134 Q135 V136I45-Y132 HydrophobicContact CG2-CD1 3.86Å; I45-Y132 HydrophobicContact CG2-CG 4.39Å; Y125-Y132 HydrophobicContact CG-CE2 4.47Å; H129-Y132 HydrophobicContact CB-CD2 3.77Å; H129-Y132 HydrophobicContact CB-CE2 4.41Å; H129-Y132 HydrophobicContact CB-CG 3.93Å; H129-Y132 WeakPolarHBondContact O-CB 3.47Å; H129-Y132 PolarHBondContact O-N 3.01Å; Y132-N134 PolarHBondContact O-N 3.05Å; Y132-Q135 PolarHBondContact O-N 3.09Å; Y132-V136 VanDerWaalsContact O-CB 3.27Å; Y132-V136 WeakPolarHBondContact O-CB 3.38Å; Y132-V136 VanDerWaalsContact O-CG2 3.25Å; Y132-V136 WeakPolarHBondContact O-CG2 3.46Å; Y132-V136 PolarHBondContact O-N 3.22Å
133E94.1Very high93.9Very high85 Ų8568.1 Ų68.140%0.39732%0.322SS..Hα-helixtrans-51.2-56.5174.9-172.2-177169.700110.9Y126 H129 Q135 V136 D137Y126-E133 HydrophobicContact CD2-CB 4.45Å; Y126-E133 HydrophobicContact CE1-CG 4.18Å; Y126-E133 HydrophobicContact CE2-CB 4.24Å; Y126-E133 HydrophobicContact CE2-CG 3.94Å; H129-E133 PolarHBondContact O-N 3.49Å; E133-Q135 PolarHBondContact O-N 3.3Å; E133-V136 PolarHBondContact O-N 2.87Å; E133-D137 WeakPolarHBondContact O-CB 3.47Å; E133-D137 PolarHBondContact O-N 3.16Å
134N95.9Very high94.2Very high87 Ų8773.6 Ų73.647%0.46535%0.346SS..Hα-helixtrans-60.7-46.6-177.7-175.117.2000112.9P130 Y132 D137 N138P130-N134 WeakPolarHBondContact O-CB 3.41Å; P130-N134 PolarHBondContact O-N 3.12Å; Y132-N134 PolarHBondContact O-N 3.05Å; N134-D137 PolarHBondContact O-N 2.9Å; N134-N138 WeakPolarHBondContact O-CB 3.43Å; N134-N138 PolarHBondContact O-N 3.24Å; N134-N138 PolarHBondContact O-ND2 3.1Å; N134-N138 PolarHBondContact OD1-ND2 3.35Å
135Q96.8Very high94.5Very high32 Ų3269 Ų6915%0.1532%0.324CS..Hα-helixtrans-70.8-39.9-178.2-71.3-170.418.600112.7N41 T44 I45 N131 Y132 E133 D137 N138 L139N41-Q135 WeakPolarHBondContact O-CG 3.27Å; N41-Q135 PolarHBondContact O-OE1 3.41Å; T44-Q135 VanDerWaalsContact N-OE1 3.16Å; T44-Q135 PolarHBondContact OG1-NE2 3.1Å; T44-Q135 VanDerWaalsContact OG1-NE2 3.1Å; T44-Q135 PolarHBondContact OG1-OE1 3.41Å; I45-Q135 HydrophobicContact CD1-CB 3.99Å; I45-Q135 HydrophobicContact CG1-CB 4.19Å; I45-Q135 HydrophobicContact CG2-CB 3.72Å; N131-Q135 WeakPolarHBondContact O-CG 3.37Å; N131-Q135 PolarHBondContact O-N 3.44Å; Y132-Q135 PolarHBondContact O-N 3.09Å; E133-Q135 PolarHBondContact O-N 3.3Å; Q135-D137 VanDerWaalsContact C-N 3.33Å; Q135-N138 PolarHBondContact O-N 3.4Å; Q135-L139 WeakPolarHBondContact O-CB 3.49Å; Q135-L139 PolarHBondContact O-N 3.26Å
136V96.9Very high94.9Very high3 Ų363.6 Ų63.62%0.01830%0.303CS..Hα-helixtrans-62.9-44.2173.8168.70000109.9I45 I123 Y126 Y132 E133 N138 L139 Q140I45-V136 HydrophobicContact CD1-CG2 4.23Å; I45-V136 HydrophobicContact CG2-CG2 4.07Å; I123-V136 HydrophobicContact CD1-CG1 3.67Å; I123-V136 HydrophobicContact CD1-CG2 4.36Å; Y126-V136 HydrophobicContact CD2-CB 3.8Å; Y126-V136 HydrophobicContact CD2-CG1 3.78Å; Y126-V136 HydrophobicContact CD2-CG2 4.19Å; Y126-V136 HydrophobicContact CE2-CB 3.86Å; Y126-V136 HydrophobicContact CE2-CG1 3.73Å; Y132-V136 VanDerWaalsContact O-CB 3.27Å; Y132-V136 WeakPolarHBondContact O-CB 3.38Å; Y132-V136 VanDerWaalsContact O-CG2 3.25Å; Y132-V136 WeakPolarHBondContact O-CG2 3.46Å; Y132-V136 PolarHBondContact O-N 3.22Å; E133-V136 PolarHBondContact O-N 2.87Å; V136-N138 PolarHBondContact O-N 2.97Å; V136-L139 PolarHBondContact O-N 3.49Å; V136-Q140 HydrophobicContact CG1-CG 4.22Å; V136-Q140 WeakPolarHBondContact O-CB 3.3Å; V136-Q140 VanDerWaalsContact O-CG 3.25Å; V136-Q140 WeakPolarHBondContact O-CG 3.43Å; V136-Q140 PolarHBondContact O-N 3.48Å
137D97.1Very high95.2Very high22 Ų2262.9 Ų62.912%0.11830%0.3CS..Hα-helixtrans-60.9-43.2178.4-101.227.3000112.8Y126 E133 N134 Q135 Q140 R141 S164Y126-D137 PolarHBondContact OH-OD1 3.32Å; E133-D137 WeakPolarHBondContact O-CB 3.47Å; E133-D137 PolarHBondContact O-N 3.16Å; N134-D137 PolarHBondContact O-N 2.9Å; Q135-D137 VanDerWaalsContact C-N 3.33Å; D137-Q140 PolarHBondContact O-N 3.19Å; D137-R141 WeakPolarHBondContact O-CG 3.49Å; D137-R141 PolarHBondContact O-N 3.13Å; D137-R141 VanDerWaalsContact O-N 3.09Å; D137-R141 PolarHBondContact O-NE 3.48Å; D137-R141 IonicContact OD2-CZ 2.9Å; D137-R141 IonicContact OD2-NH1 3.96Å; D137-R141 PolarHBondContact OD2-NH1 3.46Å; D137-R141 VanDerWaalsContact OD2-NH1 3.08Å; D137-S164 VanDerWaalsContact CG-CB 3.49Å; D137-S164 WeakPolarHBondContact O-CB 3.34Å; D137-S164 WeakPolarHBondContact OD1-CB 3.18Å; D137-S164 PolarHBondContact OD1-OG 3.21Å
138N96.9Very high95.7Very high60 Ų6056.1 Ų56.132%0.32127%0.269SS..Hα-helixtrans-65.8-43.8175.9-69.1-23.6000111.3Y42 N134 Q135 V136 Q140 R141 E142Y42-N138 HydrophobicContact CE1-CB 4.41Å; N134-N138 WeakPolarHBondContact O-CB 3.43Å; N134-N138 PolarHBondContact O-N 3.24Å; N134-N138 PolarHBondContact O-ND2 3.1Å; N134-N138 PolarHBondContact OD1-ND2 3.35Å; Q135-N138 PolarHBondContact O-N 3.4Å; V136-N138 PolarHBondContact O-N 2.97Å; N138-Q140 VanDerWaalsContact C-N 3.34Å; N138-Q140 PolarHBondContact O-N 3.4Å; N138-R141 PolarHBondContact O-N 3.45Å; N138-R141 PolarHBondContact OD1-NH2 3.21Å; N138-E142 VanDerWaalsContact O-CB 3.24Å; N138-E142 WeakPolarHBondContact O-CB 3.39Å; N138-E142 PolarHBondContact O-N 3.5Å
139L97.6Very high96Very high2 Ų256.3 Ų56.31%0.0127%0.265CS..Hα-helixtrans-58.6-46176.3-175.373.3000111.3Y42 I45 L119 Q135 V136 R141 E142 F143 C176 L180Y42-L139 HydrophobicContact CD1-CB 4.05Å; Y42-L139 HydrophobicContact CD1-CD1 4.12Å; Y42-L139 HydrophobicContact CD2-CD1 3.99Å; Y42-L139 HydrophobicContact CE1-CB 3.83Å; Y42-L139 HydrophobicContact CE1-CD1 3.96Å; Y42-L139 HydrophobicContact CE2-CD1 3.8Å; Y42-L139 HydrophobicContact CG-CD1 4.13Å; I45-L139 HydrophobicContact CD1-CB 4.35Å; I45-L139 HydrophobicContact CD1-CD2 3.92Å; L119-L139 HydrophobicContact CD1-CD2 4.33Å; L119-L139 HydrophobicContact CD2-CD2 3.75Å; Q135-L139 WeakPolarHBondContact O-CB 3.49Å; Q135-L139 PolarHBondContact O-N 3.26Å; V136-L139 PolarHBondContact O-N 3.49Å; L139-R141 PolarHBondContact O-N 2.97Å; L139-E142 PolarHBondContact O-N 2.84Å; L139-F143 HydrophobicContact CD1-CD2 3.56Å; L139-F143 HydrophobicContact CD1-CE2 3.95Å; L139-F143 HydrophobicContact CD1-CG 4.35Å; L139-F143 HydrophobicContact CG-CD2 4.42Å; L139-F143 WeakPolarHBondContact O-CB 3.26Å; L139-F143 PolarHBondContact O-N 2.79Å; L139-C176 HydrophobicContact CD2-CB 3.74Å; L139-C176 HydrophobicContact CG-CB 4.34Å; L139-L180 HydrophobicContact CD1-CD1 4.2Å; L139-L180 HydrophobicContact CD1-CD2 4.39Å
140Q97.8Very high96.2Very high1 Ų153.6 Ų53.61%0.00526%0.256CS..Hα-helixtrans-62.9-42.5-179.6-73.5-177.6166.700112.4V136 D137 N138 F144 C145 G147 Y154 S164 C165 C176V136-Q140 HydrophobicContact CG1-CG 4.22Å; V136-Q140 WeakPolarHBondContact O-CB 3.3Å; V136-Q140 VanDerWaalsContact O-CG 3.25Å; V136-Q140 WeakPolarHBondContact O-CG 3.43Å; V136-Q140 PolarHBondContact O-N 3.48Å; D137-Q140 PolarHBondContact O-N 3.19Å; N138-Q140 VanDerWaalsContact C-N 3.34Å; N138-Q140 PolarHBondContact O-N 3.4Å; Q140-F144 WeakPolarHBondContact O-CA 3.37Å; Q140-F144 PolarHBondContact O-N 2.98Å; Q140-F144 VanDerWaalsContact O-N 3.07Å; Q140-C145 WeakPolarHBondContact CA-O 3.34Å; Q140-C145 VanDerWaalsContact CB-O 3.24Å; Q140-C145 WeakPolarHBondContact CB-O 3.46Å; Q140-C145 VanDerWaalsContact CG-O 3.31Å; Q140-C145 WeakPolarHBondContact CG-O 3.27Å; Q140-C145 PolarHBondContact O-N 2.83Å; Q140-C145 VanDerWaalsContact O-N 3.14Å; Q140-G147 VanDerWaalsContact OE1-N 3.12Å; Q140-Y154 PolarHBondContact OE1-OH 3.24Å; Q140-S164 WeakPolarHBondContact CB-O 3.45Å; Q140-S164 PolarHBondContact NE2-OG 3.46Å; Q140-C165 PolarHBondContact NE2-SG 3.16Å; Q140-C165 PolarHBondContact OE1-SG 2.71Å; Q140-C176 VanDerWaalsContact CG-SG 3.51Å
141R96.8Very high96.3Very high113 Ų11353.3 Ų53.343%0.42624%0.243SC..Hα-helixtrans-68-44.4176.1-72.9-174.7-73.1-101.14.6112.6D137 N138 L139D137-R141 WeakPolarHBondContact O-CG 3.49Å; D137-R141 PolarHBondContact O-N 3.13Å; D137-R141 VanDerWaalsContact O-N 3.09Å; D137-R141 PolarHBondContact O-NE 3.48Å; D137-R141 IonicContact OD2-CZ 2.9Å; D137-R141 IonicContact OD2-NH1 3.96Å; D137-R141 PolarHBondContact OD2-NH1 3.46Å; D137-R141 VanDerWaalsContact OD2-NH1 3.08Å; N138-R141 PolarHBondContact O-N 3.45Å; N138-R141 PolarHBondContact OD1-NH2 3.21Å; L139-R141 PolarHBondContact O-N 2.97Å
142E96.3Very high96.3Very high99 Ų9951.7 Ų51.746%0.46324%0.237SC..Hα-helixtrans-74.5-39-173.8-171.9170163.700112.3Y42 N138 L139Y42-E142 PolarHBondContact OH-OE2 2.9Å; N138-E142 VanDerWaalsContact O-CB 3.24Å; N138-E142 WeakPolarHBondContact O-CB 3.39Å; N138-E142 PolarHBondContact O-N 3.5Å; L139-E142 PolarHBondContact O-N 2.84Å
143F97Very high96.3Very high32 Ų3249.9 Ų49.914%0.1423%0.231CC..Hα-helixtrans-1017.4-177.6-72-87.9000114V38 Y42 L139 C145 A179 L180 Y183V38-F143 HydrophobicContact CG1-CZ 4.29Å; Y42-F143 AromaticContact CE2-CE2 3.84Å; Y42-F143 HydrophobicContact CE2-CE2 3.84Å; Y42-F143 AromaticContact CZ-CE2 3.99Å; Y42-F143 WeakPolarHBondContact OH-CE2 3.12Å; L139-F143 HydrophobicContact CD1-CD2 3.56Å; L139-F143 HydrophobicContact CD1-CE2 3.95Å; L139-F143 HydrophobicContact CD1-CG 4.35Å; L139-F143 HydrophobicContact CG-CD2 4.42Å; L139-F143 WeakPolarHBondContact O-CB 3.26Å; L139-F143 PolarHBondContact O-N 2.79Å; F143-C145 VanDerWaalsContact C-N 3.25Å; F143-C145 PolarHBondContact O-N 3.22Å; F143-A179 HydrophobicContact CB-CB 4.09Å; F143-L180 HydrophobicContact CE1-CD1 4.42Å; F143-L180 HydrophobicContact CE2-CD1 4.29Å; F143-L180 HydrophobicContact CZ-CD1 4.07Å; F143-Y183 AromaticContact CE1-CD1 3.95Å; F143-Y183 HydrophobicContact CE1-CD1 3.95Å; F143-Y183 AromaticContact CE1-CD2 3.92Å; F143-Y183 HydrophobicContact CE1-CD2 3.92Å; F143-Y183 AromaticContact CE1-CG 3.54Å; F143-Y183 HydrophobicContact CE1-CG 3.54Å; F143-Y183 HydrophobicContact CZ-CD1 4.01Å; F143-Y183 HydrophobicContact CZ-CD2 4.46Å; F143-Y183 HydrophobicContact CZ-CE1 4.42Å; F143-Y183 HydrophobicContact CZ-CG 4.06Å
144F97.2Very high96.2Very high129 Ų12947.1 Ų47.157%0.56622%0.217SC*.THydrogen-bonded Turntrans48.650.6179.4-62.5-97.5000111.4Q140 H172Q140-F144 WeakPolarHBondContact O-CA 3.37Å; Q140-F144 PolarHBondContact O-N 2.98Å; Q140-F144 VanDerWaalsContact O-N 3.07Å; F144-H172 WeakPolarHBondContact CA-ND1 3.38Å; F144-H172 AromaticContact CD1-CE1 3.41Å; F144-H172 VanDerWaalsContact CD1-CE1 3.41Å; F144-H172 WeakPolarHBondContact CD1-CE1 3.17Å; F144-H172 AromaticContact CD1-ND1 3.81Å; F144-H172 WeakPolarHBondContact O-CB 3.47Å
145C98Very high95.9Very high0 Ų051.1 Ų51.10%023%0.231CC..BIsolated β-bridgetrans-127.7163.6-175.566.90000111.2Q140 F143 K174 C176 A179Q140-C145 WeakPolarHBondContact CA-O 3.34Å; Q140-C145 VanDerWaalsContact CB-O 3.24Å; Q140-C145 WeakPolarHBondContact CB-O 3.46Å; Q140-C145 VanDerWaalsContact CG-O 3.31Å; Q140-C145 WeakPolarHBondContact CG-O 3.27Å; Q140-C145 PolarHBondContact O-N 2.83Å; Q140-C145 VanDerWaalsContact O-N 3.14Å; F143-C145 VanDerWaalsContact C-N 3.25Å; F143-C145 PolarHBondContact O-N 3.22Å; C145-K174 CarbonylContact C-O 3.48Å; C145-K174 WeakPolarHBondContact CA-O 3.31Å; C145-K174 WeakPolarHBondContact CB-O 3.38Å; C145-C176 VanDerWaalsContact C-SG 3.57Å; C145-C176 HydrophobicContact CB-CB 3.91Å; C145-C176 WeakPolarHBondContact CB-SG 3.15Å; C145-C176 WeakPolarHBondContact SG-CA 3.08Å; C145-C176 WeakPolarHBondContact SG-CB 3.38Å; C145-C176 CovalentContact SG-SG 2.04Å; C145-C176 PolarHBondContact SG-SG 2.86Å; C145-A179 HydrophobicContact CB-CB 3.83Å
146C97.4Very high95.5Very high0 Ų052.5 Ų52.50%023%0.234CC..  trans-146.4132.3176.4-176.70000111.7S150 Y151 C165 I171 H172 K174C146-S150 CarbonylContact O-C 3.48Å; C146-Y151 PolarHBondContact O-N 2.83Å; C146-Y151 VanDerWaalsContact SG-CA 3.59Å; C146-Y151 WeakPolarHBondContact SG-CB 3.47Å; C146-C165 VanDerWaalsContact CA-SG 3.57Å; C146-C165 HydrophobicContact CB-CB 3.74Å; C146-C165 WeakPolarHBondContact CB-SG 3.13Å; C146-C165 WeakPolarHBondContact SG-CB 3.3Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 3.49Å; C146-I171 HydrophobicContact CB-CG2 4.47Å; C146-H172 HydrophobicContact CB-CB 4.17Å; C146-K174 PolarHBondContact N-O 2.89Å
147G96.2Very high95.1Very high1 Ų156.6 Ų56.61%0.0126%0.261CS..SBendtrans64.5-165-174.700000112.2Q140 C176Q140-G147 VanDerWaalsContact OE1-N 3.12Å; G147-C176 VanDerWaalsContact O-CB 3.23Å; G147-C176 WeakPolarHBondContact O-CB 3.4Å; G147-C176 PolarHBondContact O-N 2.95Å; G147-C176 PolarHBondContact O-SG 3.49Å; G147-C176 VanDerWaalsContact O-SG 3.4Å
148V97Very high94.6Very high1 Ų158.8 Ų58.81%0.00628%0.275CS..SBendtrans-85.1-56.6-175.5-172.80000110.1N116 L119 W120 I123 D153 G175 C176 A177N116-V148 WeakPolarHBondContact O-CG1 3.27Å; N116-V148 VanDerWaalsContact OD1-CG1 3.28Å; N116-V148 WeakPolarHBondContact OD1-CG1 3.28Å; L119-V148 HydrophobicContact CB-CG1 3.99Å; L119-V148 HydrophobicContact CB-CG2 4.25Å; W120-V148 HydrophobicContact CB-CG2 4.37Å; W120-V148 HydrophobicContact CE3-CB 3.95Å; W120-V148 HydrophobicContact CE3-CG1 4.22Å; W120-V148 HydrophobicContact CE3-CG2 3.78Å; W120-V148 HydrophobicContact CZ3-CB 4.45Å; W120-V148 HydrophobicContact CZ3-CG2 4.46Å; I123-V148 HydrophobicContact CB-CG2 4.13Å; I123-V148 HydrophobicContact CG1-CG2 3.72Å; V148-D153 WeakPolarHBondContact CA-OD2 3.32Å; V148-D153 WeakPolarHBondContact CB-OD2 3.48Å; V148-D153 PolarHBondContact N-OD2 3.41Å; V148-G175 CarbonylContact O-C 3.1Å; V148-G175 VanDerWaalsContact O-C 3.29Å; V148-G175 WeakPolarHBondContact O-CA 3.3Å; V148-C176 PolarHBondContact O-N 3.1Å; V148-C176 VanDerWaalsContact O-N 3.1Å; V148-A177 HydrophobicContact CG1-CB 3.98Å; V148-A177 VanDerWaalsContact O-CB 3.27Å; V148-A177 WeakPolarHBondContact O-CB 3.38Å; V148-A177 PolarHBondContact O-N 3.29Å
149R96.5Very high94.2Very high161 Ų16163 Ų6361%0.60830%0.296SS*.SBendtrans-107.3-32.3176.7-59.3-179.2-175.9-169.8-1.2110.9N116 D153 G175N116-R149 PolarHBondContact ND2-NE 3.36Å; N116-R149 PolarHBondContact OD1-NE 3.35Å; R149-D153 PolarHBondContact N-OD2 3.46Å; R149-G175 VanDerWaalsContact C-CA 3.46Å; R149-G175 VanDerWaalsContact O-CA 3.3Å; R149-G175 WeakPolarHBondContact O-CA 3.02Å; R149-G175 PolarHBondContact O-N 2.65Å
150S95.6Very high93.9Very high30 Ų3066.4 Ų66.421%0.2132%0.317CS..SBendtrans-162.6164.7177.2130.90000110.8C146 T152 D153C146-S150 CarbonylContact O-C 3.48Å; S150-T152 PolarHBondContact O-N 3.13Å; S150-T152 WeakPolarHBondContact OG-CB 3.27Å; S150-T152 WeakPolarHBondContact OG-CG2 3.37Å; S150-T152 PolarHBondContact OG-N 3.14Å; S150-T152 PolarHBondContact OG-OG1 3.22Å; S150-D153 PolarHBondContact N-OD2 3.4Å; S150-D153 VanDerWaalsContact N-OD2 3.14Å; S150-D153 WeakPolarHBondContact O-CB 3.2Å; S150-D153 PolarHBondContact O-N 3.4Å; S150-D153 VanDerWaalsContact O-OD2 3.13Å
151Y94.3Very high93.7Very high93 Ų9366.7 Ų66.737%0.36532%0.319SS..G310 helixtrans-54.4-24.8173.572.6-93.4000113.6C146 D153 Y154 V158 L161 I171C146-Y151 PolarHBondContact O-N 2.83Å; C146-Y151 VanDerWaalsContact SG-CA 3.59Å; C146-Y151 WeakPolarHBondContact SG-CB 3.47Å; Y151-D153 PolarHBondContact O-N 3.26Å; Y151-Y154 PolarHBondContact O-N 3.49Å; Y151-V158 HydrophobicContact CE2-CG2 4.25Å; Y151-L161 HydrophobicContact CD2-CD1 4.04Å; Y151-L161 HydrophobicContact CG-CD1 4.36Å; Y151-I171 HydrophobicContact CD1-CG2 4.2Å; Y151-I171 HydrophobicContact CG-CG2 4.12Å
152T93.6Very high93.5Very high78 Ų7861.8 Ų61.848%0.47930%0.301SS..G310 helixtrans-62.9-19.1177.757.60000113.3S150 Y154 K155S150-T152 PolarHBondContact O-N 3.13Å; S150-T152 WeakPolarHBondContact OG-CB 3.27Å; S150-T152 WeakPolarHBondContact OG-CG2 3.37Å; S150-T152 PolarHBondContact OG-N 3.14Å; S150-T152 PolarHBondContact OG-OG1 3.22Å; T152-Y154 PolarHBondContact O-N 3.38Å; T152-K155 PolarHBondContact O-N 3.34Å
153D93.4Very high93.4Very high18 Ų1864.2 Ų64.210%0.09632%0.317CS..G310 helixtrans-65.1-24.3-179-63.9-26.9000112.8W120 V148 R149 S150 Y151 K155W120-D153 HydrophobicContact CZ3-CB 4.17Å; V148-D153 WeakPolarHBondContact CA-OD2 3.32Å; V148-D153 WeakPolarHBondContact CB-OD2 3.48Å; V148-D153 PolarHBondContact N-OD2 3.41Å; R149-D153 PolarHBondContact N-OD2 3.46Å; S150-D153 PolarHBondContact N-OD2 3.4Å; S150-D153 VanDerWaalsContact N-OD2 3.14Å; S150-D153 WeakPolarHBondContact O-CB 3.2Å; S150-D153 PolarHBondContact O-N 3.4Å; S150-D153 VanDerWaalsContact O-OD2 3.13Å; Y151-D153 PolarHBondContact O-N 3.26Å; D153-K155 PolarHBondContact O-N 2.86Å
154Y91.9Very high93.3Very high28 Ų2862.8 Ų62.811%0.1131%0.31CS..G310 helixtrans-69.9-14171.6-79.2-78.5000113.4I123 Y126 Q140 Y151 T152 R156 L161 P162I123-Y154 HydrophobicContact CD1-CE1 4.14Å; I123-Y154 HydrophobicContact CD1-CE2 4.11Å; I123-Y154 VanDerWaalsContact CD1-OH 3.31Å; I123-Y154 WeakPolarHBondContact CD1-OH 3.28Å; I123-Y154 HydrophobicContact CG2-CD1 4.47Å; I123-Y154 HydrophobicContact CG2-CE1 4.37Å; Y126-Y154 HydrophobicContact CD1-CE1 4.05Å; Y126-Y154 HydrophobicContact CE1-CE1 4.33Å; Y126-Y154 HydrophobicContact CG-CE1 4.24Å; Q140-Y154 PolarHBondContact OE1-OH 3.24Å; Y151-Y154 PolarHBondContact O-N 3.49Å; T152-Y154 PolarHBondContact O-N 3.38Å; Y154-R156 PolarHBondContact O-N 3.48Å; Y154-R156 VanDerWaalsContact O-N 3.1Å; Y154-L161 HydrophobicContact CD2-CD2 3.84Å; Y154-L161 HydrophobicContact CG-CD2 4.03Å; Y154-P162 HydrophobicContact CE1-CG 3.94Å; Y154-P162 HydrophobicContact CE2-CG 3.91Å; Y154-P162 WeakPolarHBondContact OH-CG 3.46Å
155K89.8Confident93.3Very high171 Ų17156.6 Ų56.674%0.74328%0.283SS*.  trans49.637-179.9-59.8178.3-178.31760113.7T152 D153T152-K155 PolarHBondContact O-N 3.34Å; D153-K155 PolarHBondContact O-N 2.86Å
156R88.2Confident93.1Very high61 Ų6158.7 Ų58.723%0.2329%0.292CS..SBendtrans-135.3160-17971.1-169.5175173.6-1.3112E127 Y154 T160 L161 P162E127-R156 IonicContact OE1-CZ 3.08Å; E127-R156 IonicContact OE1-NH1 3.91Å; E127-R156 PolarHBondContact OE1-NH1 3Å; Y154-R156 PolarHBondContact O-N 3.48Å; Y154-R156 VanDerWaalsContact O-N 3.1Å; R156-T160 WeakPolarHBondContact CG-OG1 3.28Å; R156-T160 PolarHBondContact NE-O 3.01Å; R156-T160 VanDerWaalsContact NE-O 3.09Å; R156-T160 PolarHBondContact NH1-O 3.06Å; R156-T160 PolarHBondContact NH2-O 3.4Å; R156-L161 HydrophobicContact CG-CD2 4.02Å; R156-P162 VanDerWaalsContact NH2-CG 3.25Å
157P88.9Confident93Very high88 Ų8862.5 Ų62.557%0.57132%0.316SS*.  trans-56.3148.7176.6-25.435.1000112.6I159 T160 L161P157-I159 HydrophobicContact CB-CG2 4.28Å; P157-I159 PolarHBondContact O-N 3.14Å; P157-I159 VanDerWaalsContact O-N 3.12Å; P157-T160 PolarHBondContact O-N 3.36Å; P157-T160 PolarHBondContact O-OG1 3.25Å; P157-L161 PolarHBondContact O-N 3.47Å
158V87.1Confident92.6Very high68 Ų6865.6 Ų65.641%0.41235%0.348SS..G310 helixtrans-53.3-37.3179.7166.10000112.6Y151 T160 L161 K166 I171Y151-V158 HydrophobicContact CE2-CG2 4.25Å; V158-T160 PolarHBondContact O-N 3.4Å; V158-L161 HydrophobicContact CB-CD1 4.49Å; V158-L161 HydrophobicContact CG2-CD1 4.49Å; V158-L161 WeakPolarHBondContact O-CB 3.17Å; V158-L161 PolarHBondContact O-N 3.14Å; V158-K166 VanDerWaalsContact O-CE 3.31Å; V158-K166 WeakPolarHBondContact O-CE 3.37Å; V158-K166 PolarHBondContact O-NZ 3.36Å; V158-I171 HydrophobicContact CB-CD1 4.2Å; V158-I171 HydrophobicContact CG1-CD1 3.46Å; V158-I171 VanDerWaalsContact CG1-CD1 3.46Å; V158-I171 HydrophobicContact CG1-CG1 4.14Å; V158-I171 HydrophobicContact CG2-CD1 3.73Å
159I87.7Confident92.2Very high148 Ų14873.5 Ų73.576%0.75939%0.39SS*.G310 helixtrans-65.7-26.9-177.5-162.3165.5000113P157P157-I159 HydrophobicContact CB-CG2 4.28Å; P157-I159 PolarHBondContact O-N 3.14Å; P157-I159 VanDerWaalsContact O-N 3.12Å
160T90.9Very high92Very high74 Ų7469.5 Ų69.545%0.45439%0.387SS..G310 helixtrans-98.64-179.461.50000113.6R156 P157 V158R156-T160 WeakPolarHBondContact CG-OG1 3.28Å; R156-T160 PolarHBondContact NE-O 3.01Å; R156-T160 VanDerWaalsContact NE-O 3.09Å; R156-T160 PolarHBondContact NH1-O 3.06Å; R156-T160 PolarHBondContact NH2-O 3.4Å; P157-T160 PolarHBondContact O-N 3.36Å; P157-T160 PolarHBondContact O-OG1 3.25Å; V158-T160 PolarHBondContact O-N 3.4Å
161L93Very high92Very high8 Ų870.2 Ų70.24%0.04239%0.388CS..SBendtrans-61.4153.7171.6-70.4175.4000111.6Y151 Y154 R156 P157 V158 I171Y151-L161 HydrophobicContact CD2-CD1 4.04Å; Y151-L161 HydrophobicContact CG-CD1 4.36Å; Y154-L161 HydrophobicContact CD2-CD2 3.84Å; Y154-L161 HydrophobicContact CG-CD2 4.03Å; R156-L161 HydrophobicContact CG-CD2 4.02Å; P157-L161 PolarHBondContact O-N 3.47Å; V158-L161 HydrophobicContact CB-CD1 4.49Å; V158-L161 HydrophobicContact CG2-CD1 4.49Å; V158-L161 WeakPolarHBondContact O-CB 3.17Å; V158-L161 PolarHBondContact O-N 3.14Å; L161-I171 HydrophobicContact CD1-CD1 4.14Å; L161-I171 HydrophobicContact CD1-CG2 4.39Å
162P93.3Very high92.1Very high9 Ų966.4 Ų66.46%0.05837%0.373CS..  trans-56.2147.9177.2-17.330.6000111.1Y126 Y154 R156 S164 C165Y126-P162 HydrophobicContact CE1-CG 4.34Å; Y154-P162 HydrophobicContact CE1-CG 3.94Å; Y154-P162 HydrophobicContact CE2-CG 3.91Å; Y154-P162 WeakPolarHBondContact OH-CG 3.46Å; R156-P162 VanDerWaalsContact NH2-CG 3.25Å; P162-S164 VanDerWaalsContact CB-OG 3.3Å; P162-S164 WeakPolarHBondContact CB-OG 3.42Å; P162-S164 PolarHBondContact O-N 3.38Å; P162-C165 WeakPolarHBondContact O-CB 3.22Å; P162-C165 PolarHBondContact O-N 3.48Å
163L94.3Very high92.1Very high151 Ų15168.2 Ų68.279%0.79139%0.386SS*.G310 helixtrans-62.8-30.3173.9-66.9174.6000111.6C165 K166L163-C165 PolarHBondContact O-N 3.36Å; L163-K166 PolarHBondContact O-N 2.89Å; L163-K166 VanDerWaalsContact O-N 3.16Å
164S96Very high92.2Very high1 Ų171.6 Ų71.61%0.00740%0.4CS..G310 helixtrans-62.2-19173.657.80000114.3D137 Q140 P162 K166D137-S164 VanDerWaalsContact CG-CB 3.49Å; D137-S164 WeakPolarHBondContact O-CB 3.34Å; D137-S164 WeakPolarHBondContact OD1-CB 3.18Å; D137-S164 PolarHBondContact OD1-OG 3.21Å; Q140-S164 WeakPolarHBondContact CB-O 3.45Å; Q140-S164 PolarHBondContact NE2-OG 3.46Å; P162-S164 VanDerWaalsContact CB-OG 3.3Å; P162-S164 WeakPolarHBondContact CB-OG 3.42Å; P162-S164 PolarHBondContact O-N 3.38Å; S164-K166 VanDerWaalsContact C-N 3.29Å; S164-K166 PolarHBondContact O-N 3.11Å
165C96.2Very high92.5Very high0 Ų070.3 Ų70.30%040%0.395CS..G310 helixtrans-82.2-0.7176.4-88.90000113.9Q140 C146 P162 L163 I171 H172Q140-C165 PolarHBondContact NE2-SG 3.16Å; Q140-C165 PolarHBondContact OE1-SG 2.71Å; C146-C165 VanDerWaalsContact CA-SG 3.57Å; C146-C165 HydrophobicContact CB-CB 3.74Å; C146-C165 WeakPolarHBondContact CB-SG 3.13Å; C146-C165 WeakPolarHBondContact SG-CB 3.3Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 3.49Å; P162-C165 WeakPolarHBondContact O-CB 3.22Å; P162-C165 PolarHBondContact O-N 3.48Å; L163-C165 PolarHBondContact O-N 3.36Å; C165-I171 WeakPolarHBondContact O-CA 3.34Å; C165-H172 PolarHBondContact O-CD2 2.91Å; C165-H172 PolarHBondContact O-N 3.36Å
166K94.7Very high92.8Very high43 Ų4362.3 Ų62.319%0.18736%0.361CS..EExtended strand (participates in β ladder)trans-135.4146.2-171.7-58.2172.9-173.1163.90111.9V158 L163 S164 S170 I171V158-K166 VanDerWaalsContact O-CE 3.31Å; V158-K166 WeakPolarHBondContact O-CE 3.37Å; V158-K166 PolarHBondContact O-NZ 3.36Å; L163-K166 PolarHBondContact O-N 2.89Å; L163-K166 VanDerWaalsContact O-N 3.16Å; S164-K166 VanDerWaalsContact C-N 3.29Å; S164-K166 PolarHBondContact O-N 3.11Å; K166-S170 CarbonylContact C-O 3.35Å; K166-S170 WeakPolarHBondContact CA-O 3.44Å; K166-I171 HydrophobicContact CG-CG1 4.37Å
167T93.6Very high93.2Very high80 Ų8059.4 Ų59.449%0.49135%0.35SS..EExtended strand (participates in β ladder)trans-108.1106.8159.2-58.80000107.7N169 S170 H172T167-N169 PolarHBondContact O-N 3.39Å; T167-S170 PolarHBondContact N-O 3.39Å; T167-S170 PolarHBondContact O-N 2.92Å; T167-S170 VanDerWaalsContact O-N 3.14Å; T167-S170 PolarHBondContact O-OG 2.99Å; T167-H172 PolarHBondContact OG1-CE1 3.31Å; T167-H172 VanDerWaalsContact OG1-CE1 3.23Å
168G89.5Confident93.6Very high67 Ų6759.6 Ų59.669%0.69134%0.344SS*.THydrogen-bonded Turntrans58.9-120.3-167.400000111
169N87.7Confident94.1Very high166 Ų16656.8 Ų56.889%0.88833%0.327SS*.THydrogen-bonded Turntrans-94.7-8.4179.2-68.2-20.2000113.9T167T167-N169 PolarHBondContact O-N 3.39Å
170S92.6Very high94.5Very high77 Ų7749.8 Ų49.854%0.53829%0.291SS..EExtended strand (participates in β ladder)trans-86.4127.2179.247.80000111.7K166 T167K166-S170 CarbonylContact C-O 3.35Å; K166-S170 WeakPolarHBondContact CA-O 3.44Å; T167-S170 PolarHBondContact N-O 3.39Å; T167-S170 PolarHBondContact O-N 2.92Å; T167-S170 VanDerWaalsContact O-N 3.14Å; T167-S170 PolarHBondContact O-OG 2.99Å
171I95.4Very high94.7Very high45 Ų4548.3 Ų48.323%0.23128%0.278CS..EExtended strand (participates in β ladder)trans-79.5139.8175.3-50.7170000109C146 Y151 V158 L161 C165 K166C146-I171 HydrophobicContact CB-CG2 4.47Å; Y151-I171 HydrophobicContact CD1-CG2 4.2Å; Y151-I171 HydrophobicContact CG-CG2 4.12Å; V158-I171 HydrophobicContact CB-CD1 4.2Å; V158-I171 HydrophobicContact CG1-CD1 3.46Å; V158-I171 VanDerWaalsContact CG1-CD1 3.46Å; V158-I171 HydrophobicContact CG1-CG1 4.14Å; V158-I171 HydrophobicContact CG2-CD1 3.73Å; L161-I171 HydrophobicContact CD1-CD1 4.14Å; L161-I171 HydrophobicContact CD1-CG2 4.39Å; C165-I171 WeakPolarHBondContact O-CA 3.34Å; K166-I171 HydrophobicContact CG-CG1 4.37Å
172H96.1Very high94.9Very high13 Ų1350.8 Ų50.86%0.0629%0.291CS..PPolyproline II helixtrans-61.7124.2170.7-67.2-59000111.2F144 C146 C165 T167F144-H172 WeakPolarHBondContact CA-ND1 3.38Å; F144-H172 AromaticContact CD1-CE1 3.41Å; F144-H172 VanDerWaalsContact CD1-CE1 3.41Å; F144-H172 WeakPolarHBondContact CD1-CE1 3.17Å; F144-H172 AromaticContact CD1-ND1 3.81Å; F144-H172 WeakPolarHBondContact O-CB 3.47Å; C146-H172 HydrophobicContact CB-CB 4.17Å; C165-H172 PolarHBondContact O-CD2 2.91Å; C165-H172 PolarHBondContact O-N 3.36Å; T167-H172 PolarHBondContact OG1-CE1 3.31Å; T167-H172 VanDerWaalsContact OG1-CE1 3.23Å
173P93.4Very high95Very high116 Ų11653 Ų5375%0.75330%0.298SS*.  trans-80-24.3-171.730.2-35.3000113.8
174K96.2Very high95.1Very high89 Ų8945.8 Ų45.839%0.38726%0.261SS..BIsolated β-bridgetrans-87.4145.6-177.4-74.7-166.5170.2-165.10111.9C145 C146 D182C145-K174 CarbonylContact C-O 3.48Å; C145-K174 WeakPolarHBondContact CA-O 3.31Å; C145-K174 WeakPolarHBondContact CB-O 3.38Å; C146-K174 PolarHBondContact N-O 2.89Å; K174-D182 IonicContact NZ-OD2 2.79Å; K174-D182 PolarHBondContact NZ-OD2 3.1Å
175G97.3Very high95.1Very high1 Ų146.6 Ų46.61%0.0127%0.265CS..  trans-75.3147.5165.800000112.2V148 R149 A177 E178 A179V148-G175 CarbonylContact O-C 3.1Å; V148-G175 VanDerWaalsContact O-C 3.29Å; V148-G175 WeakPolarHBondContact O-CA 3.3Å; R149-G175 VanDerWaalsContact C-CA 3.46Å; R149-G175 VanDerWaalsContact O-CA 3.3Å; R149-G175 WeakPolarHBondContact O-CA 3.02Å; R149-G175 PolarHBondContact O-N 2.65Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 3.04Å; G175-E178 PolarHBondContact O-N 2.91Å; G175-A179 PolarHBondContact O-N 2.89Å
176C97.7Very high95.1Very high3 Ų352.4 Ų52.42%0.0229%0.291CS..Hα-helixtrans-69.6-27.2-176.4-66.40000114.3L119 L139 Q140 C145 G147 V148 E178 L180L119-C176 HydrophobicContact CD1-CB 4.18Å; L139-C176 HydrophobicContact CD2-CB 3.74Å; L139-C176 HydrophobicContact CG-CB 4.34Å; Q140-C176 VanDerWaalsContact CG-SG 3.51Å; C145-C176 VanDerWaalsContact C-SG 3.57Å; C145-C176 HydrophobicContact CB-CB 3.91Å; C145-C176 WeakPolarHBondContact CB-SG 3.15Å; C145-C176 WeakPolarHBondContact SG-CA 3.08Å; C145-C176 WeakPolarHBondContact SG-CB 3.38Å; C145-C176 CovalentContact SG-SG 2.04Å; C145-C176 PolarHBondContact SG-SG 2.86Å; G147-C176 VanDerWaalsContact O-CB 3.23Å; G147-C176 WeakPolarHBondContact O-CB 3.4Å; G147-C176 PolarHBondContact O-N 2.95Å; G147-C176 PolarHBondContact O-SG 3.49Å; G147-C176 VanDerWaalsContact O-SG 3.4Å; V148-C176 PolarHBondContact O-N 3.1Å; V148-C176 VanDerWaalsContact O-N 3.1Å; C176-E178 VanDerWaalsContact C-N 3.3Å; C176-E178 PolarHBondContact O-N 3.07Å; C176-L180 WeakPolarHBondContact O-CB 3.45Å; C176-L180 PolarHBondContact O-N 3.21Å
177A96.8Very high95.3Very high0 Ų051.1 Ų51.10%029%0.288CS..Hα-helixtrans-63.9-39.4173.900000111.5F112 N116 L119 V148 G175 Y181F112-A177 HydrophobicContact CD2-CB 4.5Å; F112-A177 HydrophobicContact CE2-CB 4.02Å; N116-A177 HydrophobicContact CB-CB 3.96Å; L119-A177 HydrophobicContact CD1-CB 4.05Å; V148-A177 HydrophobicContact CG1-CB 3.98Å; V148-A177 VanDerWaalsContact O-CB 3.27Å; V148-A177 WeakPolarHBondContact O-CB 3.38Å; V148-A177 PolarHBondContact O-N 3.29Å; G175-A177 VanDerWaalsContact C-N 3.33Å; G175-A177 PolarHBondContact O-N 3.04Å; A177-Y181 WeakPolarHBondContact O-CB 3.49Å; A177-Y181 PolarHBondContact O-N 3.07Å; A177-Y181 VanDerWaalsContact O-N 3.14Å
178E96.3Very high95.5Very high93 Ų9347.7 Ų47.744%0.43527%0.266SS..Hα-helixtrans-74.8-47.7178-173.8178.3179.600111.3F112 G175 C176 L180 Y181 D182F112-E178 HydrophobicContact CE2-CB 4.25Å; G175-E178 PolarHBondContact O-N 2.91Å; C176-E178 VanDerWaalsContact C-N 3.3Å; C176-E178 PolarHBondContact O-N 3.07Å; E178-L180 VanDerWaalsContact C-N 3.34Å; E178-L180 PolarHBondContact O-N 3.01Å; E178-Y181 WeakPolarHBondContact O-CB 3.42Å; E178-Y181 PolarHBondContact O-N 2.79Å; E178-Y181 VanDerWaalsContact O-N 3.14Å; E178-D182 PolarHBondContact O-N 3.36Å
179A97.2Very high95.8Very high9 Ų946.6 Ų46.67%0.07424%0.244CC..Hα-helixtrans-59.1-43.8179.900000112.5F143 C145 G175 D182 Y183F143-A179 HydrophobicContact CB-CB 4.09Å; C145-A179 HydrophobicContact CB-CB 3.83Å; G175-A179 PolarHBondContact O-N 2.89Å; A179-D182 PolarHBondContact O-N 2.86Å; A179-Y183 PolarHBondContact O-N 2.04Å
180L96.5Very high96.3Very high0 Ų041.9 Ų41.90%022%0.218CC..Hα-helixtrans-69.7-37.2176.6-174.963.8000112L39 L46 F111 L139 F143 C176 E178 Y183 I184L39-L180 HydrophobicContact CD1-CD1 4.47Å; L46-L180 HydrophobicContact CD1-CD2 3.71Å; L46-L180 HydrophobicContact CD2-CD2 3.71Å; L46-L180 HydrophobicContact CG-CD2 4.3Å; F111-L180 HydrophobicContact CE1-CD2 4.3Å; F111-L180 HydrophobicContact CE1-CG 4.01Å; F111-L180 HydrophobicContact CZ-CD2 3.95Å; F111-L180 HydrophobicContact CZ-CG 4Å; L139-L180 HydrophobicContact CD1-CD1 4.2Å; L139-L180 HydrophobicContact CD1-CD2 4.39Å; F143-L180 HydrophobicContact CE1-CD1 4.42Å; F143-L180 HydrophobicContact CE2-CD1 4.29Å; F143-L180 HydrophobicContact CZ-CD1 4.07Å; C176-L180 WeakPolarHBondContact O-CB 3.45Å; C176-L180 PolarHBondContact O-N 3.21Å; E178-L180 VanDerWaalsContact C-N 3.34Å; E178-L180 PolarHBondContact O-N 3.01Å; L180-Y183 PolarHBondContact O-N 3.14Å; L180-I184 HydrophobicContact CD1-CG1 4.39Å; L180-I184 WeakPolarHBondContact O-CB 3.46Å; L180-I184 WeakPolarHBondContact O-CG1 3.47Å; L180-I184 PolarHBondContact O-N 3.28Å
181Y95.5Very high96.6Very high44 Ų4438.3 Ų38.317%0.17319%0.193CC..Hα-helixtrans-62.1-45.8174.2164.6-99.1000112.1N109 F111 F112 A177 E178 Y183 I184 Q185N109-Y181 PolarHBondContact OD1-OH 3.03Å; F111-Y181 HydrophobicContact CD1-CD2 4.37Å; F112-Y181 HydrophobicContact CB-CD2 3.51Å; F112-Y181 HydrophobicContact CB-CE2 3.91Å; F112-Y181 HydrophobicContact CB-CG 3.92Å; F112-Y181 HydrophobicContact CD2-CD1 4.38Å; F112-Y181 HydrophobicContact CD2-CD2 4.42Å; F112-Y181 AromaticContact CD2-CG 3.94Å; F112-Y181 HydrophobicContact CD2-CG 3.94Å; F112-Y181 HydrophobicContact CG-CD2 4.38Å; F112-Y181 HydrophobicContact CG-CG 4.33Å; A177-Y181 WeakPolarHBondContact O-CB 3.49Å; A177-Y181 PolarHBondContact O-N 3.07Å; A177-Y181 VanDerWaalsContact O-N 3.14Å; E178-Y181 WeakPolarHBondContact O-CB 3.42Å; E178-Y181 PolarHBondContact O-N 2.79Å; E178-Y181 VanDerWaalsContact O-N 3.14Å; Y181-Y183 VanDerWaalsContact C-N 3.3Å; Y181-Y183 PolarHBondContact O-N 2.65Å; Y181-I184 PolarHBondContact O-N 3.27Å; Y181-Q185 HydrophobicContact CD1-CG 4.27Å; Y181-Q185 HydrophobicContact CD2-CG 3.53Å; Y181-Q185 HydrophobicContact CE1-CG 3.89Å; Y181-Q185 HydrophobicContact CE2-CG 3.1Å; Y181-Q185 HydrophobicContact CG-CG 4.12Å; Y181-Q185 WeakPolarHBondContact O-CB 3.38Å; Y181-Q185 WeakPolarHBondContact O-CG 3.42Å; Y181-Q185 PolarHBondContact O-N 2.92Å
182D96Very high96.7Very high60 Ų6036.4 Ų36.432%0.32118%0.183SC..Hα-helixtrans-56.3-47.6178.2-75.5-12.9000110.4K174 E178 A179 H186K174-D182 IonicContact NZ-OD2 2.79Å; K174-D182 PolarHBondContact NZ-OD2 3.1Å; E178-D182 PolarHBondContact O-N 3.36Å; A179-D182 PolarHBondContact O-N 2.86Å; D182-H186 VanDerWaalsContact O-CB 3.3Å; D182-H186 WeakPolarHBondContact O-CB 3.29Å; D182-H186 PolarHBondContact O-N 2.97Å
183Y96.5Very high96.7Very high54 Ų5442.9 Ų42.921%0.21221%0.208CC..Hα-helixtrans-59.8-50.4176.3176.1-101.6000112.2T35 V38 F143 A179 L180 Y181 H186 C187T35-Y183 HydrophobicContact CG2-CE1 4.44Å; V38-Y183 HydrophobicContact CB-CE1 4.39Å; V38-Y183 HydrophobicContact CG1-CE1 3.89Å; F143-Y183 AromaticContact CE1-CD1 3.95Å; F143-Y183 HydrophobicContact CE1-CD1 3.95Å; F143-Y183 AromaticContact CE1-CD2 3.92Å; F143-Y183 HydrophobicContact CE1-CD2 3.92Å; F143-Y183 AromaticContact CE1-CG 3.54Å; F143-Y183 HydrophobicContact CE1-CG 3.54Å; F143-Y183 HydrophobicContact CZ-CD1 4.01Å; F143-Y183 HydrophobicContact CZ-CD2 4.46Å; F143-Y183 HydrophobicContact CZ-CE1 4.42Å; F143-Y183 HydrophobicContact CZ-CG 4.06Å; A179-Y183 PolarHBondContact O-N 2.04Å; L180-Y183 PolarHBondContact O-N 3.14Å; Y181-Y183 VanDerWaalsContact C-N 3.3Å; Y181-Y183 PolarHBondContact O-N 2.65Å; Y183-H186 WeakPolarHBondContact O-CB 3.37Å; Y183-H186 PolarHBondContact O-N 3.02Å; Y183-C187 PolarHBondContact O-N 3.14Å; Y183-C187 VanDerWaalsContact O-N 3.1Å; Y183-C187 PolarHBondContact O-SG 3.3Å
184I96.6Very high97Very high0 Ų039 Ų390%018%0.181CC..Hα-helixtrans-68.4-40.7-176.3-70.5-65.5000112.3T35 L39 P51 F54 F111 L180 Y181 H186 C187 I188T35-I184 HydrophobicContact CG2-CD1 3.38Å; L39-I184 HydrophobicContact CD1-CD1 3.13Å; L39-I184 HydrophobicContact CD1-CG1 3.86Å; L39-I184 HydrophobicContact CD2-CD1 4.03Å; L39-I184 HydrophobicContact CG-CD1 4.22Å; P51-I184 HydrophobicContact CG-CG2 3.87Å; F54-I184 HydrophobicContact CE2-CD1 4.35Å; F54-I184 HydrophobicContact CE2-CG2 4.36Å; F54-I184 HydrophobicContact CZ-CD1 4.38Å; F54-I184 HydrophobicContact CZ-CG2 4.21Å; F111-I184 HydrophobicContact CD1-CB 3.99Å; F111-I184 HydrophobicContact CD1-CG1 4.4Å; F111-I184 HydrophobicContact CD1-CG2 3.86Å; F111-I184 HydrophobicContact CD2-CG2 4.21Å; F111-I184 HydrophobicContact CE1-CB 3.78Å; F111-I184 HydrophobicContact CE1-CG1 3.72Å; F111-I184 HydrophobicContact CE1-CG2 4.01Å; F111-I184 HydrophobicContact CE2-CG1 4.43Å; F111-I184 HydrophobicContact CE2-CG2 4.37Å; F111-I184 HydrophobicContact CG-CG2 3.97Å; F111-I184 HydrophobicContact CZ-CB 4.23Å; F111-I184 HydrophobicContact CZ-CG1 3.74Å; F111-I184 HydrophobicContact CZ-CG2 4.28Å; L180-I184 HydrophobicContact CD1-CG1 4.39Å; L180-I184 WeakPolarHBondContact O-CB 3.46Å; L180-I184 WeakPolarHBondContact O-CG1 3.47Å; L180-I184 PolarHBondContact O-N 3.28Å; Y181-I184 PolarHBondContact O-N 3.27Å; I184-H186 VanDerWaalsContact C-N 3.31Å; I184-H186 PolarHBondContact O-N 3.04Å; I184-C187 PolarHBondContact O-N 2.94Å; I184-I188 HydrophobicContact CG2-CD1 3.78Å; I184-I188 HydrophobicContact CG2-CG1 4.37Å; I184-I188 WeakPolarHBondContact O-CB 3.23Å; I184-I188 VanDerWaalsContact O-CG1 3.28Å; I184-I188 WeakPolarHBondContact O-CG1 3.33Å; I184-I188 PolarHBondContact O-N 3.25Å
185Q95.6Very high97Very high18 Ų1834.9 Ų34.98%0.08416%0.163CC..Hα-helixtrans-62.5-41173.8-75-55.8-61.100111.6K108 Y181 C187 I188 M189K108-Q185 PolarHBondContact O-NE2 2.74Å; Y181-Q185 HydrophobicContact CD1-CG 4.27Å; Y181-Q185 HydrophobicContact CD2-CG 3.53Å; Y181-Q185 HydrophobicContact CE1-CG 3.89Å; Y181-Q185 HydrophobicContact CE2-CG 3.1Å; Y181-Q185 HydrophobicContact CG-CG 4.12Å; Y181-Q185 WeakPolarHBondContact O-CB 3.38Å; Y181-Q185 WeakPolarHBondContact O-CG 3.42Å; Y181-Q185 PolarHBondContact O-N 2.92Å; Q185-C187 VanDerWaalsContact C-N 3.34Å; Q185-C187 PolarHBondContact O-N 3.04Å; Q185-I188 PolarHBondContact O-N 3.03Å; Q185-M189 WeakPolarHBondContact O-CB 3.35Å; Q185-M189 VanDerWaalsContact O-CG 3.24Å; Q185-M189 WeakPolarHBondContact O-CG 3.35Å; Q185-M189 PolarHBondContact O-N 3.2Å
186H96.5Very high97Very high122 Ų12239 Ų3957%0.56518%0.183SC*.Hα-helixtrans-58-47.8176.7-173.472000111.2D182 Y183 I184 I188 M189 I190D182-H186 VanDerWaalsContact O-CB 3.3Å; D182-H186 WeakPolarHBondContact O-CB 3.29Å; D182-H186 PolarHBondContact O-N 2.97Å; Y183-H186 WeakPolarHBondContact O-CB 3.37Å; Y183-H186 PolarHBondContact O-N 3.02Å; I184-H186 VanDerWaalsContact C-N 3.31Å; I184-H186 PolarHBondContact O-N 3.04Å; H186-I188 PolarHBondContact O-N 3.4Å; H186-M189 PolarHBondContact O-N 2.97Å; H186-I190 WeakPolarHBondContact O-CG1 3.16Å; H186-I190 PolarHBondContact O-N 2.89Å; H186-I190 VanDerWaalsContact O-N 3.11Å
187C97.8Very high97Very high16 Ų1640.7 Ų40.711%0.10820%0.198CC..Hα-helixtrans-60.4-45.7174.8-65.60000112.7T35 Y183 I184 Q185 M189 I190 I191T35-C187 HydrophobicContact CG2-CB 4.06Å; Y183-C187 PolarHBondContact O-N 3.14Å; Y183-C187 VanDerWaalsContact O-N 3.1Å; Y183-C187 PolarHBondContact O-SG 3.3Å; I184-C187 PolarHBondContact O-N 2.94Å; Q185-C187 VanDerWaalsContact C-N 3.34Å; Q185-C187 PolarHBondContact O-N 3.04Å; C187-M189 VanDerWaalsContact C-N 3.33Å; C187-M189 PolarHBondContact O-N 3.37Å; C187-I190 PolarHBondContact O-N 3.32Å; C187-I191 WeakPolarHBondContact O-CD1 3.39Å; C187-I191 WeakPolarHBondContact O-CG1 3.33Å; C187-I191 PolarHBondContact O-N 3.5Å; C187-I191 VanDerWaalsContact O-N 3.1Å
188I97.4Very high97Very high9 Ų940.7 Ų40.75%0.04620%0.198CC..Hα-helixtrans-59.7-43.7178.2-73.1174.3000111.1P51 I53 F54 I184 Q185 H186 I191 I192P51-I188 HydrophobicContact CB-CD1 3.98Å; P51-I188 HydrophobicContact CG-CD1 4.13Å; I53-I188 HydrophobicContact CD1-CG2 4.32Å; I53-I188 HydrophobicContact CG2-CD1 4.08Å; I53-I188 HydrophobicContact CG2-CG1 3.87Å; F54-I188 HydrophobicContact CE1-CG1 3.78Å; F54-I188 HydrophobicContact CZ-CD1 4.17Å; F54-I188 HydrophobicContact CZ-CG1 3.64Å; I184-I188 HydrophobicContact CG2-CD1 3.78Å; I184-I188 HydrophobicContact CG2-CG1 4.37Å; I184-I188 WeakPolarHBondContact O-CB 3.23Å; I184-I188 VanDerWaalsContact O-CG1 3.28Å; I184-I188 WeakPolarHBondContact O-CG1 3.33Å; I184-I188 PolarHBondContact O-N 3.25Å; Q185-I188 PolarHBondContact O-N 3.03Å; H186-I188 PolarHBondContact O-N 3.4Å; I188-I191 PolarHBondContact O-N 3.26Å; I188-I192 HydrophobicContact CG2-CD1 3.69Å; I188-I192 HydrophobicContact CG2-CG1 4.39Å; I188-I192 VanDerWaalsContact O-CG1 3.31Å; I188-I192 WeakPolarHBondContact O-CG1 3.22Å; I188-I192 PolarHBondContact O-N 2.87Å
189M97.1Very high97Very high44 Ų4436.8 Ų36.822%0.21718%0.181CC..Hα-helixtrans-65.1-42.4-179.7-71-59.7-58.800111.8Q185 H186 C187 I191 I192 Y193Q185-M189 WeakPolarHBondContact O-CB 3.35Å; Q185-M189 VanDerWaalsContact O-CG 3.24Å; Q185-M189 WeakPolarHBondContact O-CG 3.35Å; Q185-M189 PolarHBondContact O-N 3.2Å; H186-M189 PolarHBondContact O-N 2.97Å; C187-M189 VanDerWaalsContact C-N 3.33Å; C187-M189 PolarHBondContact O-N 3.37Å; M189-I191 VanDerWaalsContact C-N 3.33Å; M189-I191 PolarHBondContact O-N 2.93Å; M189-I192 PolarHBondContact O-N 3.26Å; M189-I192 HydrophobicContact SD-CD1 4.46Å; M189-Y193 HydrophobicContact CB-CE2 4.26Å; M189-Y193 HydrophobicContact CE-CE1 4.4Å; M189-Y193 HydrophobicContact CE-CE2 4Å; M189-Y193 WeakPolarHBondContact CE-OH 3.41Å; M189-Y193 WeakPolarHBondContact O-CD2 3.48Å; M189-Y193 PolarHBondContact O-N 3.33Å
190I98.1Very high97Very high67 Ų6741 Ų4134%0.34420%0.202SC..Hα-helixtrans-57.2-48.4174-67.2171.7000110.4L31 H186 C187 I192 Y193 I194L31-I190 HydrophobicContact CD1-CG2 4.17Å; H186-I190 WeakPolarHBondContact O-CG1 3.16Å; H186-I190 PolarHBondContact O-N 2.89Å; H186-I190 VanDerWaalsContact O-N 3.11Å; C187-I190 PolarHBondContact O-N 3.32Å; I190-I192 VanDerWaalsContact C-N 3.34Å; I190-I192 PolarHBondContact O-N 3.43Å; I190-Y193 PolarHBondContact O-N 3.01Å; I190-I194 HydrophobicContact CG2-CD1 3.89Å; I190-I194 WeakPolarHBondContact O-CG1 3.3Å; I190-I194 PolarHBondContact O-N 3.2Å
191I98.1Very high97Very high1 Ų143.2 Ų43.21%0.00521%0.213CC..Hα-helixtrans-59.4-45.5178.7-70.1159.1000110.9L28 L31 P32 I53 F54 V57 C187 I188 M189 Y193 I194 C195L28-I191 HydrophobicContact CD2-CG2 4.43Å; L31-I191 HydrophobicContact CB-CG1 4.26Å; P32-I191 HydrophobicContact CB-CD1 4.39Å; P32-I191 HydrophobicContact CG-CD1 3.8Å; P32-I191 HydrophobicContact CG-CG1 4.38Å; I53-I191 HydrophobicContact CD1-CG2 4.24Å; I53-I191 HydrophobicContact CG1-CG2 4.49Å; F54-I191 HydrophobicContact CD1-CD1 3.83Å; F54-I191 HydrophobicContact CE1-CD1 3.7Å; V57-I191 HydrophobicContact CB-CG2 4.42Å; V57-I191 HydrophobicContact CG1-CG2 3.99Å; V57-I191 HydrophobicContact CG2-CG2 3.99Å; C187-I191 WeakPolarHBondContact O-CD1 3.39Å; C187-I191 WeakPolarHBondContact O-CG1 3.33Å; C187-I191 PolarHBondContact O-N 3.5Å; C187-I191 VanDerWaalsContact O-N 3.1Å; I188-I191 PolarHBondContact O-N 3.26Å; M189-I191 VanDerWaalsContact C-N 3.33Å; M189-I191 PolarHBondContact O-N 2.93Å; I191-Y193 VanDerWaalsContact C-N 3.35Å; I191-Y193 PolarHBondContact O-N 3.27Å; I191-I194 PolarHBondContact O-N 3.15Å; I191-C195 PolarHBondContact O-N 3.23Å; I191-C195 PolarHBondContact O-SG 3.09Å; I191-C195 VanDerWaalsContact O-SG 3.34Å
192I97.5Very high97Very high5 Ų541.1 Ų41.13%0.02621%0.205CC..Hα-helixtrans-59.7-44.7178.5-72.2168.2000111.2I53 I188 M189 I190 I194 C195 I196I53-I192 HydrophobicContact CD1-CD1 4.4Å; I53-I192 HydrophobicContact CD1-CG1 3.92Å; I188-I192 HydrophobicContact CG2-CD1 3.69Å; I188-I192 HydrophobicContact CG2-CG1 4.39Å; I188-I192 VanDerWaalsContact O-CG1 3.31Å; I188-I192 WeakPolarHBondContact O-CG1 3.22Å; I188-I192 PolarHBondContact O-N 2.87Å; M189-I192 PolarHBondContact O-N 3.26Å; M189-I192 HydrophobicContact SD-CD1 4.46Å; I190-I192 VanDerWaalsContact C-N 3.34Å; I190-I192 PolarHBondContact O-N 3.43Å; I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 PolarHBondContact O-N 3.18Å; I192-C195 PolarHBondContact O-N 2.95Å; I192-I196 HydrophobicContact CG2-CD1 3.76Å; I192-I196 HydrophobicContact CG2-CG1 4.43Å; I192-I196 VanDerWaalsContact O-CG1 3.31Å; I192-I196 WeakPolarHBondContact O-CG1 3.32Å; I192-I196 PolarHBondContact O-N 3.23Å
193Y97.5Very high96.8Very high149 Ų14940.9 Ų40.958%0.58421%0.211SC*.Hα-helixtrans-62.3-41.5177.9-68.2-49.4000112.2M189 I190 I191 I196 A197M189-Y193 HydrophobicContact CB-CE2 4.26Å; M189-Y193 HydrophobicContact CE-CE1 4.4Å; M189-Y193 HydrophobicContact CE-CE2 4Å; M189-Y193 WeakPolarHBondContact CE-OH 3.41Å; M189-Y193 WeakPolarHBondContact O-CD2 3.48Å; M189-Y193 PolarHBondContact O-N 3.33Å; I190-Y193 PolarHBondContact O-N 3.01Å; I191-Y193 VanDerWaalsContact C-N 3.35Å; I191-Y193 PolarHBondContact O-N 3.27Å; Y193-I196 PolarHBondContact O-N 3.12Å; Y193-A197 WeakPolarHBondContact O-CB 3.05Å; Y193-A197 PolarHBondContact O-N 2.88Å
194I97.9Very high96.7Very high36 Ų3643.3 Ų43.319%0.18523%0.227CC..Hα-helixtrans-63.6-46.5175.2-65.2170.2000110.4F24 L28 L31 I190 I191 I192 I196 A197 F198F24-I194 HydrophobicContact CD1-CG2 3.77Å; F24-I194 HydrophobicContact CE1-CG2 4.13Å; L28-I194 HydrophobicContact CD2-CB 4.18Å; L28-I194 HydrophobicContact CD2-CG2 3.64Å; L28-I194 HydrophobicContact CG-CG2 4.18Å; L31-I194 HydrophobicContact CD1-CD1 3.38Å; I190-I194 HydrophobicContact CG2-CD1 3.89Å; I190-I194 WeakPolarHBondContact O-CG1 3.3Å; I190-I194 PolarHBondContact O-N 3.2Å; I191-I194 PolarHBondContact O-N 3.15Å; I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 PolarHBondContact O-N 3.18Å; I194-I196 VanDerWaalsContact C-N 3.33Å; I194-I196 PolarHBondContact O-N 3.42Å; I194-A197 PolarHBondContact O-N 3.49Å; I194-F198 WeakPolarHBondContact O-CB 3.24Å; I194-F198 PolarHBondContact O-N 3.09Å
195C97.9Very high96.6Very high2 Ų243.5 Ų43.51%0.01423%0.228CC..Hα-helixtrans-59.1-42.1177.7-71.60000112.3E97 S101 I191 I192 F198 A199E97-C195 HydrophobicContact CB-CB 4.49Å; S101-C195 WeakPolarHBondContact OG-CB 3.44Å; I191-C195 PolarHBondContact O-N 3.23Å; I191-C195 PolarHBondContact O-SG 3.09Å; I191-C195 VanDerWaalsContact O-SG 3.34Å; I192-C195 PolarHBondContact O-N 2.95Å; C195-F198 PolarHBondContact O-N 3.35Å; C195-A199 VanDerWaalsContact O-CB 3.26Å; C195-A199 WeakPolarHBondContact O-CB 3.38Å; C195-A199 PolarHBondContact O-N 2.87Å
196I96.7Very high96.3Very high86 Ų8643.9 Ų43.944%0.44123%0.23SC..Hα-helixtrans-64.5-50177.8-69.1167000110.7I192 Y193 I194 F198 A199 I200I192-I196 HydrophobicContact CG2-CD1 3.76Å; I192-I196 HydrophobicContact CG2-CG1 4.43Å; I192-I196 VanDerWaalsContact O-CG1 3.31Å; I192-I196 WeakPolarHBondContact O-CG1 3.32Å; I192-I196 PolarHBondContact O-N 3.23Å; Y193-I196 PolarHBondContact O-N 3.12Å; I194-I196 VanDerWaalsContact C-N 3.33Å; I194-I196 PolarHBondContact O-N 3.42Å; I196-F198 VanDerWaalsContact C-N 3.28Å; I196-F198 PolarHBondContact O-N 3.49Å; I196-A199 PolarHBondContact O-N 3.43Å; I196-I200 HydrophobicContact CG2-CD1 4.08Å; I196-I200 WeakPolarHBondContact O-CG1 3.37Å; I196-I200 PolarHBondContact O-N 3.47Å; I196-I200 VanDerWaalsContact O-N 3.09Å
197A97Very high96Very high40 Ų4040.4 Ų40.433%0.33122%0.223SC..Hα-helixtrans-58.5-44.4177.700000110.9F24 Y193 I194 I200 I201F24-A197 HydrophobicContact CE1-CB 4.4Å; Y193-A197 WeakPolarHBondContact O-CB 3.05Å; Y193-A197 PolarHBondContact O-N 2.88Å; I194-A197 PolarHBondContact O-N 3.49Å; A197-I200 PolarHBondContact O-N 3.37Å; A197-I201 VanDerWaalsContact O-CG1 3.28Å; A197-I201 WeakPolarHBondContact O-CG1 3.38Å; A197-I201 PolarHBondContact O-N 3.16Å; A197-I201 VanDerWaalsContact O-N 3.08Å
198F97.5Very high95.5Very high0 Ų041.8 Ų41.80%023%0.231CC..Hα-helixtrans-65.2-42.3-179.6-165.5-162.4000112.3F21 F24 D25 L28 I194 C195 I196 I200 I201 K202F21-F198 HydrophobicContact CB-CE2 4.05Å; F21-F198 HydrophobicContact CB-CZ 4.12Å; F21-F198 HydrophobicContact CD1-CD2 4.35Å; F21-F198 AromaticContact CD1-CE2 3.51Å; F21-F198 HydrophobicContact CD1-CE2 3.51Å; F21-F198 HydrophobicContact CD1-CZ 4.39Å; F21-F198 HydrophobicContact CE1-CE2 4.18Å; F21-F198 AromaticContact CG-CE2 3.99Å; F21-F198 HydrophobicContact CG-CE2 3.99Å; F21-F198 HydrophobicContact CG-CZ 4.46Å; F24-F198 HydrophobicContact CB-CD1 3.74Å; F24-F198 HydrophobicContact CB-CD2 3.59Å; F24-F198 HydrophobicContact CB-CE1 3.56Å; F24-F198 HydrophobicContact CB-CE2 3.45Å; F24-F198 VanDerWaalsContact CB-CE2 3.45Å; F24-F198 HydrophobicContact CB-CG 3.73Å; F24-F198 HydrophobicContact CB-CZ 3.41Å; F24-F198 VanDerWaalsContact CB-CZ 3.41Å; F24-F198 HydrophobicContact CD1-CB 3.62Å; F24-F198 HydrophobicContact CD1-CD1 4.28Å; F24-F198 AromaticContact CD1-CD2 3.93Å; F24-F198 HydrophobicContact CD1-CD2 3.93Å; F24-F198 AromaticContact CD1-CG 3.72Å; F24-F198 HydrophobicContact CD1-CG 3.72Å; F24-F198 HydrophobicContact CD2-CD2 4.17Å; F24-F198 HydrophobicContact CD2-CE2 4.38Å; F24-F198 HydrophobicContact CE1-CB 4.06Å; F24-F198 HydrophobicContact CG-CB 4.25Å; F24-F198 HydrophobicContact CG-CD1 4.32Å; F24-F198 AromaticContact CG-CD2 3.64Å; F24-F198 HydrophobicContact CG-CD2 3.64Å; F24-F198 AromaticContact CG-CE2 3.95Å; F24-F198 HydrophobicContact CG-CE2 3.95Å; F24-F198 AromaticContact CG-CG 3.84Å; F24-F198 HydrophobicContact CG-CG 3.84Å; F24-F198 HydrophobicContact CG-CZ 4.37Å; D25-F198 WeakPolarHBondContact OD1-CE1 3.31Å; D25-F198 WeakPolarHBondContact OD1-CZ 3.4Å; L28-F198 HydrophobicContact CD1-CD1 3.67Å; L28-F198 HydrophobicContact CD1-CE1 4.01Å; I194-F198 WeakPolarHBondContact O-CB 3.24Å; I194-F198 PolarHBondContact O-N 3.09Å; C195-F198 PolarHBondContact O-N 3.35Å; I196-F198 VanDerWaalsContact C-N 3.28Å; I196-F198 PolarHBondContact O-N 3.49Å; F198-I200 VanDerWaalsContact C-N 3.31Å; F198-I200 PolarHBondContact O-N 3.19Å; F198-I201 PolarHBondContact O-N 3.18Å; F198-K202 VanDerWaalsContact CD1-CE 3.41Å; F198-K202 HydrophobicContact CD2-CD 4.25Å; F198-K202 HydrophobicContact CD2-CG 4.02Å; F198-K202 HydrophobicContact CE2-CD 4.17Å; F198-K202 HydrophobicContact CE2-CG 3.99Å; F198-K202 HydrophobicContact CG-CD 4.46Å; F198-K202 HydrophobicContact CZ-CD 4.37Å; F198-K202 WeakPolarHBondContact O-CG 3.47Å; F198-K202 PolarHBondContact O-N 3.44Å
199A96.3Very high94.9Very high10 Ų1041.9 Ų41.98%0.08323%0.232CC..Hα-helixtrans-60.4-40.1175.800000112.1T94 I98 C195 I196 K202 A203T94-A199 HydrophobicContact CG2-CB 3.86Å; I98-A199 HydrophobicContact CD1-CB 4.08Å; I98-A199 HydrophobicContact CG1-CB 3.98Å; C195-A199 VanDerWaalsContact O-CB 3.26Å; C195-A199 WeakPolarHBondContact O-CB 3.38Å; C195-A199 PolarHBondContact O-N 2.87Å; I196-A199 PolarHBondContact O-N 3.43Å; A199-K202 PolarHBondContact O-N 3.27Å; A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.41Å; A199-A203 PolarHBondContact O-N 2.93Å
200I96.3Very high94.2Very high97 Ų9744.2 Ų44.250%0.49724%0.244SC..Hα-helixtrans-62.9-46.7175.3-66.7165.3000110.4I196 A197 F198 A203 I204I196-I200 HydrophobicContact CG2-CD1 4.08Å; I196-I200 WeakPolarHBondContact O-CG1 3.37Å; I196-I200 PolarHBondContact O-N 3.47Å; I196-I200 VanDerWaalsContact O-N 3.09Å; A197-I200 PolarHBondContact O-N 3.37Å; F198-I200 VanDerWaalsContact C-N 3.31Å; F198-I200 PolarHBondContact O-N 3.19Å; I200-A203 PolarHBondContact O-N 2.03Å; I200-I204 HydrophobicContact CG2-CD1 4.01Å; I200-I204 WeakPolarHBondContact O-CG1 3.42Å; I200-I204 PolarHBondContact O-N 3.47Å
201I96.2Very high93.5Very high47 Ų4746.4 Ų46.424%0.24126%0.256CS..Hα-helixtrans-63.1-45.1179.2-60164000110.4L20 F21 F24 A197 F198 A203 I204 Y205L20-I201 HydrophobicContact CD2-CD1 4.24Å; L20-I201 HydrophobicContact CD2-CG2 3.94Å; F21-I201 HydrophobicContact CE1-CG2 3.78Å; F24-I201 HydrophobicContact CE1-CD1 4.38Å; F24-I201 HydrophobicContact CE2-CD1 3.68Å; F24-I201 HydrophobicContact CZ-CD1 3.55Å; A197-I201 VanDerWaalsContact O-CG1 3.28Å; A197-I201 WeakPolarHBondContact O-CG1 3.38Å; A197-I201 PolarHBondContact O-N 3.16Å; A197-I201 VanDerWaalsContact O-N 3.08Å; F198-I201 PolarHBondContact O-N 3.18Å; I201-A203 VanDerWaalsContact C-N 3.33Å; I201-A203 PolarHBondContact O-N 2.81Å; I201-I204 PolarHBondContact O-N 2.88Å; I201-Y205 PolarHBondContact O-N 3.1Å
202K95.6Very high92.6Very high1 Ų148.3 Ų48.30%0.00427%0.266CS..Hα-helixtrans-60.2-41.8175.3-70.8178.9-168.61690111.3F21 T94 E97 F198 A199 I204 Y205 L206F21-K202 HydrophobicContact CE1-CG 4.12Å; F21-K202 HydrophobicContact CZ-CG 4.18Å; T94-K202 HydrophobicContact CG2-CD 4.39Å; T94-K202 WeakPolarHBondContact OG1-CD 3.42Å; E97-K202 VanDerWaalsContact CD-NZ 3.29Å; E97-K202 IonicContact OE1-NZ 3.05Å; E97-K202 PolarHBondContact OE1-NZ 3.44Å; E97-K202 IonicContact OE2-NZ 2.78Å; E97-K202 PolarHBondContact OE2-NZ 2.88Å; F198-K202 VanDerWaalsContact CD1-CE 3.41Å; F198-K202 HydrophobicContact CD2-CD 4.25Å; F198-K202 HydrophobicContact CD2-CG 4.02Å; F198-K202 HydrophobicContact CE2-CD 4.17Å; F198-K202 HydrophobicContact CE2-CG 3.99Å; F198-K202 HydrophobicContact CG-CD 4.46Å; F198-K202 HydrophobicContact CZ-CD 4.37Å; F198-K202 WeakPolarHBondContact O-CG 3.47Å; F198-K202 PolarHBondContact O-N 3.44Å; A199-K202 PolarHBondContact O-N 3.27Å; K202-I204 PolarHBondContact O-N 3.18Å; K202-Y205 WeakPolarHBondContact O-CB 3.25Å; K202-Y205 PolarHBondContact O-N 3.43Å; K202-L206 WeakPolarHBondContact O-CB 3.25Å; K202-L206 VanDerWaalsContact O-CG 3.26Å; K202-L206 WeakPolarHBondContact O-CG 3.24Å; K202-L206 PolarHBondContact O-N 2.95Å
203A93.5Very high91.6Very high55 Ų5555.7 Ų55.746%0.45530%0.295SS..Hα-helixtrans-62.5-42.6177.500000112.3A199 I200 I201 L206 A207A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.41Å; A199-A203 PolarHBondContact O-N 2.93Å; I200-A203 PolarHBondContact O-N 2.03Å; I201-A203 VanDerWaalsContact C-N 3.33Å; I201-A203 PolarHBondContact O-N 2.81Å; A203-L206 PolarHBondContact O-N 3.43Å; A203-A207 VanDerWaalsContact O-CB 3.32Å; A203-A207 WeakPolarHBondContact O-CB 3.25Å; A203-A207 PolarHBondContact O-N 3.46Å
204I93.7Very high90.7Very high104 Ų10456.3 Ų56.353%0.53330%0.296SS..Hα-helixtrans-62.8-44.2175.3-66.3165.8000110.6I200 I201 K202 A207 T208I200-I204 HydrophobicContact CG2-CD1 4.01Å; I200-I204 WeakPolarHBondContact O-CG1 3.42Å; I200-I204 PolarHBondContact O-N 3.47Å; I201-I204 PolarHBondContact O-N 2.88Å; K202-I204 PolarHBondContact O-N 3.18Å; I204-A207 PolarHBondContact O-N 3.45Å; I204-T208 HydrophobicContact CG2-CG2 4.47Å; I204-T208 WeakPolarHBondContact O-CB 3.43Å; I204-T208 WeakPolarHBondContact O-CG2 3.31Å; I204-T208 PolarHBondContact O-N 3.39Å; I204-T208 PolarHBondContact O-OG1 3.38Å
205Y94.4Very high89.7Confident5 Ų559.1 Ų59.12%0.0231%0.307CS..Hα-helixtrans-61.7-43.5176.5168.1-103.5000112.9F14 F21 H86 L90 I201 K202 T208 S209F14-Y205 HydrophobicContact CD2-CE2 4.16Å; F14-Y205 WeakPolarHBondContact CD2-OH 3.24Å; F14-Y205 WeakPolarHBondContact CE2-OH 3.38Å; F21-Y205 AromaticContact CE2-CD1 3.66Å; F21-Y205 HydrophobicContact CE2-CD1 3.66Å; F21-Y205 HydrophobicContact CE2-CD2 4.4Å; F21-Y205 AromaticContact CE2-CE1 3.94Å; F21-Y205 HydrophobicContact CE2-CE1 3.94Å; F21-Y205 AromaticContact CE2-CG 3.89Å; F21-Y205 HydrophobicContact CE2-CG 3.89Å; F21-Y205 AromaticContact CZ-CD1 3.79Å; F21-Y205 HydrophobicContact CZ-CD1 3.79Å; F21-Y205 HydrophobicContact CZ-CD2 4.35Å; F21-Y205 AromaticContact CZ-CG 3.67Å; F21-Y205 HydrophobicContact CZ-CG 3.67Å; H86-Y205 PolarHBondContact CD2-OH 3.1Å; H86-Y205 AromaticContact NE2-CE1 3.58Å; H86-Y205 AromaticContact NE2-CZ 3.56Å; H86-Y205 PolarHBondContact NE2-OH 3.3Å; L90-Y205 HydrophobicContact CD1-CD1 4.33Å; L90-Y205 HydrophobicContact CD1-CE1 3.93Å; I201-Y205 PolarHBondContact O-N 3.1Å; K202-Y205 WeakPolarHBondContact O-CB 3.25Å; K202-Y205 PolarHBondContact O-N 3.43Å; Y205-T208 WeakPolarHBondContact CA-OG1 3.41Å; Y205-T208 PolarHBondContact O-OG1 3.35Å; Y205-S209 VanDerWaalsContact O-CB 3.32Å; Y205-S209 WeakPolarHBondContact O-CB 3.27Å; Y205-S209 PolarHBondContact O-N 3.15Å; Y205-S209 PolarHBondContact O-OG 2.9Å
206L89.7Confident88.6Confident26 Ų2661.6 Ų61.614%0.13632%0.324CS..Hα-helixtrans-66.4-44.4177.3-70.4173.2000111.3I87 K202 A203 T208 S209 I210I87-L206 HydrophobicContact CB-CD2 4.46Å; I87-L206 HydrophobicContact CG1-CD2 4.46Å; I87-L206 HydrophobicContact CG2-CD2 3.75Å; K202-L206 WeakPolarHBondContact O-CB 3.25Å; K202-L206 VanDerWaalsContact O-CG 3.26Å; K202-L206 WeakPolarHBondContact O-CG 3.24Å; K202-L206 PolarHBondContact O-N 2.95Å; A203-L206 PolarHBondContact O-N 3.43Å; L206-T208 PolarHBondContact O-N 3.29Å; L206-S209 PolarHBondContact O-N 3.07Å; L206-I210 VanDerWaalsContact O-CG1 3.28Å; L206-I210 WeakPolarHBondContact O-CG1 3.21Å; L206-I210 PolarHBondContact O-N 2.76Å
207A89.9Confident87.5Confident49 Ų4962.4 Ų62.441%0.40533%0.326SS..Hα-helixtrans-60.5-47.6177.400000111.6A203 I204 S209 I210 L211A203-A207 VanDerWaalsContact O-CB 3.32Å; A203-A207 WeakPolarHBondContact O-CB 3.25Å; A203-A207 PolarHBondContact O-N 3.46Å; I204-A207 PolarHBondContact O-N 3.45Å; A207-S209 VanDerWaalsContact C-N 3.33Å; A207-S209 PolarHBondContact O-N 3.37Å; A207-I210 PolarHBondContact O-N 2.94Å; A207-L211 WeakPolarHBondContact O-CB 3.31Å; A207-L211 VanDerWaalsContact O-CG 3.24Å; A207-L211 WeakPolarHBondContact O-CG 3.34Å; A207-L211 PolarHBondContact O-N 2.93Å
208T87.4Confident86.3Confident45 Ų4568 Ų6828%0.27634%0.343SS..Hα-helixtrans-63.1-39177.250.80000112I204 Y205 L206 L211 L212I204-T208 HydrophobicContact CG2-CG2 4.47Å; I204-T208 WeakPolarHBondContact O-CB 3.43Å; I204-T208 WeakPolarHBondContact O-CG2 3.31Å; I204-T208 PolarHBondContact O-N 3.39Å; I204-T208 PolarHBondContact O-OG1 3.38Å; Y205-T208 WeakPolarHBondContact CA-OG1 3.41Å; Y205-T208 PolarHBondContact O-OG1 3.35Å; L206-T208 PolarHBondContact O-N 3.29Å; T208-L211 PolarHBondContact O-N 3.14Å; T208-L212 WeakPolarHBondContact O-CB 3.45Å; T208-L212 WeakPolarHBondContact O-CD1 2.98Å; T208-L212 VanDerWaalsContact O-CG 3.25Å; T208-L212 WeakPolarHBondContact O-CG 3.49Å; T208-L212 PolarHBondContact O-N 3.21Å
209S84.3Confident84.9Confident11 Ų1170 Ų708%0.07735%0.354CS..Hα-helixtrans-62.6-44.6175.5-63.80000112.5Y205 L206 A207 L212 Y213Y205-S209 VanDerWaalsContact O-CB 3.32Å; Y205-S209 WeakPolarHBondContact O-CB 3.27Å; Y205-S209 PolarHBondContact O-N 3.15Å; Y205-S209 PolarHBondContact O-OG 2.9Å; L206-S209 PolarHBondContact O-N 3.07Å; A207-S209 VanDerWaalsContact C-N 3.33Å; A207-S209 PolarHBondContact O-N 3.37Å; S209-L212 PolarHBondContact O-N 3.49Å; S209-Y213 WeakPolarHBondContact O-CB 3.41Å; S209-Y213 PolarHBondContact O-N 3.21Å
210I81.9Confident83.4Confident93 Ų9374.8 Ų74.848%0.47738%0.378SS..Hα-helixtrans-66-44.9177.9-66.9164.5000111.1L206 A207 L212 Y213 R214L206-I210 VanDerWaalsContact O-CG1 3.28Å; L206-I210 WeakPolarHBondContact O-CG1 3.21Å; L206-I210 PolarHBondContact O-N 2.76Å; A207-I210 PolarHBondContact O-N 2.94Å; I210-L212 VanDerWaalsContact C-N 3.31Å; I210-L212 PolarHBondContact O-N 3.16Å; I210-Y213 PolarHBondContact O-N 3.05Å; I210-R214 WeakPolarHBondContact O-CG 3.43Å; I210-R214 PolarHBondContact O-N 3.3Å
211L84.9Confident81.8Confident112 Ų11276.8 Ų76.859%0.58639%0.389SS*.Hα-helixtrans-61.3-40.4178.6-70.8173.1000111.7A207 T208 K215A207-L211 WeakPolarHBondContact O-CB 3.31Å; A207-L211 VanDerWaalsContact O-CG 3.24Å; A207-L211 WeakPolarHBondContact O-CG 3.34Å; A207-L211 PolarHBondContact O-N 2.93Å; T208-L211 PolarHBondContact O-N 3.14Å; L211-K215 WeakPolarHBondContact O-CB 3.3Å; L211-K215 PolarHBondContact O-N 3.31Å
212L78.8Confident80.1Confident41 Ų4179 Ų7922%0.21541%0.408CS..Hα-helixtrans-71.5-36.5179-71.4164.2000111.9L6 W10 T208 S209 I210 K215 S216L6-L212 HydrophobicContact CD1-CD2 3.77Å; L6-L212 HydrophobicContact CG-CD2 4.42Å; W10-L212 VanDerWaalsContact CD1-CD1 3.47Å; W10-L212 HydrophobicContact CG-CD1 4.38Å; T208-L212 WeakPolarHBondContact O-CB 3.45Å; T208-L212 WeakPolarHBondContact O-CD1 2.98Å; T208-L212 VanDerWaalsContact O-CG 3.25Å; T208-L212 WeakPolarHBondContact O-CG 3.49Å; T208-L212 PolarHBondContact O-N 3.21Å; S209-L212 PolarHBondContact O-N 3.49Å; I210-L212 VanDerWaalsContact C-N 3.31Å; I210-L212 PolarHBondContact O-N 3.16Å; L212-K215 PolarHBondContact O-N 3.29Å; L212-S216 PolarHBondContact O-N 3.12Å; L212-S216 VanDerWaalsContact O-N 3.08Å
213Y75.8Confident78Confident160 Ų16087.3 Ų87.363%0.62746%0.459SS*.Hα-helixtrans-60.6-49.8172.2-175.1-96.2000112S209 I210 K215 S216 E217S209-Y213 WeakPolarHBondContact O-CB 3.41Å; S209-Y213 PolarHBondContact O-N 3.21Å; I210-Y213 PolarHBondContact O-N 3.05Å; Y213-K215 VanDerWaalsContact C-N 3.31Å; Y213-K215 PolarHBondContact O-N 3.03Å; Y213-S216 WeakPolarHBondContact O-CB 3.19Å; Y213-S216 PolarHBondContact O-N 3.03Å; Y213-S216 VanDerWaalsContact O-N 3.14Å; Y213-E217 PolarHBondContact O-N 3.46Å; Y213-E217 VanDerWaalsContact O-N 3.11Å
214R78.8Confident77.2Confident163 Ų16389 Ų8962%0.61546%0.459SS*.Hα-helixtrans-60.1-38.9177.4-72179.9176.1-178.9-0.7112.9I210 S216 E217 K218I210-R214 WeakPolarHBondContact O-CG 3.43Å; I210-R214 PolarHBondContact O-N 3.3Å; R214-S216 VanDerWaalsContact C-N 3.33Å; R214-E217 PolarHBondContact O-N 3.08Å; R214-K218 PolarHBondContact O-N 2.79Å; R214-K218 VanDerWaalsContact O-N 3.11Å
215K77.7Confident76.4Confident94 Ų9488.2 Ų88.241%0.40946%0.455SS..Hα-helixtrans-65.9-36.7177.3-172.1172.6-176.51740112L6 L211 L212 Y213 N219L6-K215 HydrophobicContact CD2-CD 4.29Å; L211-K215 WeakPolarHBondContact O-CB 3.3Å; L211-K215 PolarHBondContact O-N 3.31Å; L212-K215 PolarHBondContact O-N 3.29Å; Y213-K215 VanDerWaalsContact C-N 3.31Å; Y213-K215 PolarHBondContact O-N 3.03Å; K215-N219 VanDerWaalsContact O-CG 3.31Å; K215-N219 PolarHBondContact O-N 3Å; K215-N219 PolarHBondContact O-ND2 2.98Å
216S73.8Confident75.4Confident54 Ų5492.8 Ų92.838%0.37848%0.48SS..Hα-helixtrans-64.2-47175.7-1700000111.6L212 Y213 R214 K218 N219 N220L212-S216 PolarHBondContact O-N 3.12Å; L212-S216 VanDerWaalsContact O-N 3.08Å; Y213-S216 WeakPolarHBondContact O-CB 3.19Å; Y213-S216 PolarHBondContact O-N 3.03Å; Y213-S216 VanDerWaalsContact O-N 3.14Å; R214-S216 VanDerWaalsContact C-N 3.33Å; S216-K218 PolarHBondContact O-N 3.09Å; S216-N219 PolarHBondContact O-N 3.2Å; S216-N220 PolarHBondContact O-N 3.49Å; S216-N220 VanDerWaalsContact O-N 3.12Å
217E74.5Confident74.5Confident104 Ų10496.7 Ų96.749%0.48650%0.5SS..Hα-helixtrans-61.3-45178.9-172.3176.7-166.200112.3Y213 R214 N219 N220 L221Y213-E217 PolarHBondContact O-N 3.46Å; Y213-E217 VanDerWaalsContact O-N 3.11Å; R214-E217 PolarHBondContact O-N 3.08Å; E217-N219 VanDerWaalsContact C-N 3.31Å; E217-N219 PolarHBondContact O-N 2.79Å; E217-N220 PolarHBondContact O-N 3.42Å; E217-N220 VanDerWaalsContact O-N 3.17Å; E217-L221 HydrophobicContact CG-CD1 4.33Å; E217-L221 PolarHBondContact O-N 3.06Å; E217-L221 VanDerWaalsContact O-N 3.14Å
218K72.4Confident73.6Confident156 Ų15699.7 Ų99.768%0.67851%0.506SS*.Hα-helixtrans-60.9-39.3177.2-170.2177.2-178.7179.50112.5R214 S216 N220 L221 S222R214-K218 PolarHBondContact O-N 2.79Å; R214-K218 VanDerWaalsContact O-N 3.11Å; S216-K218 PolarHBondContact O-N 3.09Å; K218-N220 VanDerWaalsContact C-N 3.33Å; K218-L221 PolarHBondContact O-N 2.62Å; K218-S222 PolarHBondContact O-N 2.62Å; K218-S222 PolarHBondContact O-OG 3.32Å
219N66.4Low72.6Confident43 Ų43103.3 Ų103.323%0.2352%0.521CS..Hα-helixtrans-69.2-32.4178.4-72.5-12.7000112.3L3 K215 S216 E217 L221 S222 V223L3-N219 HydrophobicContact CD2-CB 4.47Å; K215-N219 VanDerWaalsContact O-CG 3.31Å; K215-N219 PolarHBondContact O-N 3Å; K215-N219 PolarHBondContact O-ND2 2.98Å; S216-N219 PolarHBondContact O-N 3.2Å; E217-N219 VanDerWaalsContact C-N 3.31Å; E217-N219 PolarHBondContact O-N 2.79Å; N219-L221 VanDerWaalsContact C-N 3.33Å; N219-S222 WeakPolarHBondContact CA-OG 3.5Å; N219-S222 PolarHBondContact O-N 2.99Å; N219-S222 PolarHBondContact O-OG 2.76Å; N219-V223 WeakPolarHBondContact O-CG2 3.38Å
220N64.6Low71.8Confident110 Ų110109.9 Ų109.959%0.58855%0.553SS**Hα-helixtrans-71.8-26.1175.2-71.9-10.6000112.8S216 E217 K218S216-N220 PolarHBondContact O-N 3.49Å; S216-N220 VanDerWaalsContact O-N 3.12Å; E217-N220 PolarHBondContact O-N 3.42Å; E217-N220 VanDerWaalsContact O-N 3.17Å; K218-N220 VanDerWaalsContact C-N 3.33Å
221L64Low71Confident139 Ų139111.2 Ų111.273%0.72856%0.559SS**Hα-helixtrans-81.3-20.4175.4-78.2157.2000113.5E217 K218 N219E217-L221 HydrophobicContact CG-CD1 4.33Å; E217-L221 PolarHBondContact O-N 3.06Å; E217-L221 VanDerWaalsContact O-N 3.14Å; K218-L221 PolarHBondContact O-N 2.62Å; N219-L221 VanDerWaalsContact C-N 3.33Å
222S59.8Low69.9Low93 Ų93111.2 Ų111.265%0.6556%0.556SS**  trans-89.8-1.3179.657.80000114.7K218 N219K218-S222 PolarHBondContact O-N 2.62Å; K218-S222 PolarHBondContact O-OG 3.32Å; N219-S222 WeakPolarHBondContact CA-OG 3.5Å; N219-S222 PolarHBondContact O-N 2.99Å; N219-S222 PolarHBondContact O-OG 2.76Å
223V52Low69.1Low177 Ų177117.5 Ų117.5100%1.07359%0.587SS**  trans-108.20176.4177.50000108.2N219N219-V223 WeakPolarHBondContact O-CG2 3.38Å

Retrieved 223 of 223 residues in 309.2 ms (Link to these results)

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