A0A3Q0KVH8_SCHMA Loading...

ATP synthase F0 subunit 6 (mitochondrion)

AlphaFold DB , UniProt , Accession A0A3Q0KVH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 132 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
1M62.5Low74.1Confident203 Ų203126.2 Ų126.2100%161%0.605SS**  0-50.50-161171.3164.100112.6I3 G4M1-I3 PolarHBondContact O-N 3.32Å; M1-G4 PolarHBondContact O-N 3.36Å
2F65.9Low74.1Confident176 Ų176124.3 Ų124.377%0.77260%0.595SS**Hα-helixtrans-58.7-37.9179.6-82-79000115.7G4 L5 W6F2-G4 VanDerWaalsContact C-N 3.32Å; F2-G4 PolarHBondContact O-N 3.25Å; F2-L5 PolarHBondContact O-N 2.92Å; F2-W6 PolarHBondContact O-N 3.39Å
3I72.8Confident74.2Confident150 Ų150126.5 Ų126.577%0.76959%0.593SS**Hα-helixtrans-65.7-33.9-179-14579.7000112.7M1 W6 Y7M1-I3 PolarHBondContact O-N 3.32Å; I3-W6 PolarHBondContact O-N 2.96Å; I3-Y7 PolarHBondContact O-N 3.49Å
4G79.6Confident74.1Confident32 Ų32122.9 Ų122.933%0.3358%0.579SS.*Hα-helixtrans-73.2-34.4179.900000112.8M1 F2 Y7 N8M1-G4 PolarHBondContact O-N 3.36Å; F2-G4 VanDerWaalsContact C-N 3.32Å; F2-G4 PolarHBondContact O-N 3.25Å; G4-Y7 PolarHBondContact O-N 3.46Å; G4-N8 WeakPolarHBondContact O-CB 3.35Å; G4-N8 PolarHBondContact O-N 3.23Å; G4-N8 PolarHBondContact O-ND2 3.39Å
5L76.1Confident73.6Confident98 Ų98118.7 Ų118.751%0.51357%0.568SS.*Hα-helixtrans-66.5-41.5174.1-71.3165.4000111.3F2 K9F2-L5 PolarHBondContact O-N 2.92Å; L5-K9 VanDerWaalsContact O-CB 3.32Å; L5-K9 WeakPolarHBondContact O-CB 3.32Å; L5-K9 WeakPolarHBondContact O-CG 3.38Å; L5-K9 PolarHBondContact O-N 3.03Å
6W75.1Confident72.8Confident194 Ų194119 Ų11974%0.73557%0.573SS**Hα-helixtrans-63.3-45.1174.8-107.783.9000111.9F2 I3 K9 L10F2-W6 PolarHBondContact O-N 3.39Å; I3-W6 PolarHBondContact O-N 2.96Å; W6-K9 PolarHBondContact O-N 2.91Å; W6-L10 WeakPolarHBondContact O-CB 3.29Å; W6-L10 PolarHBondContact O-N 3.48Å
7Y80.3Confident72.5Confident156 Ų156120.7 Ų120.761%0.61257%0.572SS**Hα-helixtrans-60-50176.3-179.1-99.1000111.7I3 G4 K9 L10 V11I3-Y7 PolarHBondContact O-N 3.49Å; G4-Y7 PolarHBondContact O-N 3.46Å; Y7-K9 PolarHBondContact O-N 3.44Å; Y7-L10 PolarHBondContact O-N 3.48Å; Y7-V11 HydrophobicContact CD1-CG2 4.16Å; Y7-V11 HydrophobicContact CD2-CG2 4.37Å; Y7-V11 HydrophobicContact CE1-CG2 3.79Å; Y7-V11 HydrophobicContact CE2-CG2 4.02Å; Y7-V11 HydrophobicContact CG-CG2 4.44Å; Y7-V11 WeakPolarHBondContact O-CB 3.46Å; Y7-V11 VanDerWaalsContact O-CG2 3.29Å; Y7-V11 WeakPolarHBondContact O-CG2 3.16Å; Y7-V11 PolarHBondContact O-N 3.23Å
8N75.9Confident72Confident95 Ų95119.9 Ų119.951%0.50857%0.572SS.*Hα-helixtrans-64.8-41.5-179.8-74.9-35.5000112.4G4 L10 V11 E12G4-N8 WeakPolarHBondContact O-CB 3.35Å; G4-N8 PolarHBondContact O-N 3.23Å; G4-N8 PolarHBondContact O-ND2 3.39Å; N8-L10 VanDerWaalsContact C-N 3.32Å; N8-L10 PolarHBondContact O-N 2.85Å; N8-V11 PolarHBondContact O-N 2.83Å; N8-E12 WeakPolarHBondContact O-CB 3.37Å; N8-E12 WeakPolarHBondContact O-CG 3.28Å; N8-E12 PolarHBondContact O-N 3.37Å
9K75.5Confident71.4Confident142 Ų142117.7 Ų117.762%0.61757%0.566SS**Hα-helixtrans-62.2-39.9174.2-79.8-73.7178.6-153.90112.2L5 W6 Y7 E12 W13L5-K9 VanDerWaalsContact O-CB 3.32Å; L5-K9 WeakPolarHBondContact O-CB 3.32Å; L5-K9 WeakPolarHBondContact O-CG 3.38Å; L5-K9 PolarHBondContact O-N 3.03Å; W6-K9 PolarHBondContact O-N 2.91Å; Y7-K9 PolarHBondContact O-N 3.44Å; K9-E12 IonicContact NZ-OE2 3.89Å; K9-W13 WeakPolarHBondContact O-CB 3.2Å; K9-W13 PolarHBondContact O-N 2.88Å
10L77.1Confident70.8Confident81 Ų81120.3 Ų120.342%0.42458%0.575SS.*Hα-helixtrans-67.9-44178.6-168.1158.4000110.6W6 Y7 N8 W13 I14W6-L10 WeakPolarHBondContact O-CB 3.29Å; W6-L10 PolarHBondContact O-N 3.48Å; Y7-L10 PolarHBondContact O-N 3.48Å; N8-L10 VanDerWaalsContact C-N 3.32Å; N8-L10 PolarHBondContact O-N 2.85Å; L10-W13 PolarHBondContact O-N 2.92Å; L10-I14 HydrophobicContact CD2-CD1 3.41Å; L10-I14 VanDerWaalsContact CD2-CD1 3.41Å; L10-I14 HydrophobicContact CD2-CG1 4.18Å; L10-I14 WeakPolarHBondContact O-CB 3.47Å; L10-I14 WeakPolarHBondContact O-CG1 3.33Å; L10-I14 PolarHBondContact O-N 3.34Å
11V74.8Confident70.4Confident61 Ų61118.4 Ų118.437%0.3757%0.571SS.*Hα-helixtrans-64.1-44.8175.8172.30000111.3Y7 N8 W13 I14 S15Y7-V11 HydrophobicContact CD1-CG2 4.16Å; Y7-V11 HydrophobicContact CD2-CG2 4.37Å; Y7-V11 HydrophobicContact CE1-CG2 3.79Å; Y7-V11 HydrophobicContact CE2-CG2 4.02Å; Y7-V11 HydrophobicContact CG-CG2 4.44Å; Y7-V11 WeakPolarHBondContact O-CB 3.46Å; Y7-V11 VanDerWaalsContact O-CG2 3.29Å; Y7-V11 WeakPolarHBondContact O-CG2 3.16Å; Y7-V11 PolarHBondContact O-N 3.23Å; N8-V11 PolarHBondContact O-N 2.83Å; V11-W13 PolarHBondContact O-N 2.82Å; V11-I14 PolarHBondContact O-N 3.41Å; V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 3.49Å
12E73.5Confident70.2Confident104 Ų104112.7 Ų112.749%0.48654%0.543SS..Hα-helixtrans-60.4-44.2173.8-79.7-179.7169.900111.5N8 K9 I14 S15 L16N8-E12 WeakPolarHBondContact O-CB 3.37Å; N8-E12 WeakPolarHBondContact O-CG 3.28Å; N8-E12 PolarHBondContact O-N 3.37Å; K9-E12 IonicContact NZ-OE2 3.89Å; E12-I14 PolarHBondContact O-N 3.17Å; E12-S15 PolarHBondContact O-N 3.33Å; E12-L16 WeakPolarHBondContact O-CB 3.2Å; E12-L16 VanDerWaalsContact O-CG 3.28Å; E12-L16 WeakPolarHBondContact O-CG 3.28Å; E12-L16 PolarHBondContact O-N 3.3Å
13W75.3Confident69.7Low152 Ų152111.8 Ų111.858%0.57654%0.543SS*.Hα-helixtrans-64.1-42.5179.9-176.186.9000112K9 L10 V11 R17K9-W13 WeakPolarHBondContact O-CB 3.2Å; K9-W13 PolarHBondContact O-N 2.88Å; L10-W13 PolarHBondContact O-N 2.92Å; V11-W13 PolarHBondContact O-N 2.82Å; W13-R17 VanDerWaalsContact O-CB 3.28Å; W13-R17 WeakPolarHBondContact O-CB 3.36Å; W13-R17 PolarHBondContact O-N 3.5Å
14I73.5Confident69.2Low77 Ų77108.9 Ų108.940%0.39554%0.535SS..Hα-helixtrans-64.9-46.3174-70.3178.7000110.3L10 V11 E12 R17 L18L10-I14 HydrophobicContact CD2-CD1 3.41Å; L10-I14 VanDerWaalsContact CD2-CD1 3.41Å; L10-I14 HydrophobicContact CD2-CG1 4.18Å; L10-I14 WeakPolarHBondContact O-CB 3.47Å; L10-I14 WeakPolarHBondContact O-CG1 3.33Å; L10-I14 PolarHBondContact O-N 3.34Å; V11-I14 PolarHBondContact O-N 3.41Å; E12-I14 PolarHBondContact O-N 3.17Å; I14-R17 PolarHBondContact O-N 2.83Å; I14-L18 HydrophobicContact CG2-CD1 3.68Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 WeakPolarHBondContact O-CB 3.24Å; I14-L18 VanDerWaalsContact O-CG 3.3Å; I14-L18 WeakPolarHBondContact O-CG 3.43Å; I14-L18 PolarHBondContact O-N 2.88Å
15S66.2Low68.9Low60 Ų60113.1 Ų113.142%0.4255%0.547SS..Hα-helixtrans-62-50.1-178.5-177.80000111.9V11 E12 R17 L18 V19V11-S15 WeakPolarHBondContact O-CB 3.49Å; V11-S15 PolarHBondContact O-N 3.49Å; E12-S15 PolarHBondContact O-N 3.33Å; S15-R17 VanDerWaalsContact C-N 3.32Å; S15-R17 PolarHBondContact O-N 3.38Å; S15-L18 PolarHBondContact O-N 3.48Å; S15-V19 WeakPolarHBondContact O-CB 3.27Å; S15-V19 VanDerWaalsContact O-CG2 3.24Å; S15-V19 WeakPolarHBondContact O-CG2 3.31Å; S15-V19 PolarHBondContact O-N 2.96Å
16L60.7Low68.9Low123 Ų123118.4 Ų118.464%0.64456%0.56SS**Hα-helixtrans-63.7-38.3179.8-70.3174.1000112.1E12 K20E12-L16 WeakPolarHBondContact O-CB 3.2Å; E12-L16 VanDerWaalsContact O-CG 3.28Å; E12-L16 WeakPolarHBondContact O-CG 3.28Å; E12-L16 PolarHBondContact O-N 3.3Å; L16-K20 VanDerWaalsContact O-CB 3.27Å; L16-K20 WeakPolarHBondContact O-CB 3.3Å; L16-K20 PolarHBondContact O-N 2.95Å
17R67.1Low68.9Low148 Ų148118.3 Ų118.356%0.55856%0.56SS**Hα-helixtrans-70.4-42.2178.7-171.5173.6-76.6-122.6-1.8111.5W13 I14 S15 K20 V21W13-R17 VanDerWaalsContact O-CB 3.28Å; W13-R17 WeakPolarHBondContact O-CB 3.36Å; W13-R17 PolarHBondContact O-N 3.5Å; I14-R17 PolarHBondContact O-N 2.83Å; S15-R17 VanDerWaalsContact C-N 3.32Å; S15-R17 PolarHBondContact O-N 3.38Å; R17-K20 PolarHBondContact O-N 3.42Å; R17-V21 VanDerWaalsContact O-CG2 3.31Å; R17-V21 WeakPolarHBondContact O-CG2 3.46Å; R17-V21 PolarHBondContact O-N 3.39Å
18L63.8Low68.7Low107 Ų107116.7 Ų116.756%0.5655%0.553SS**Hα-helixtrans-62.5-48.2174.6-74.6172000111.1I14 S15 K20 V21 M22I14-L18 HydrophobicContact CG2-CD1 3.68Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 WeakPolarHBondContact O-CB 3.24Å; I14-L18 VanDerWaalsContact O-CG 3.3Å; I14-L18 WeakPolarHBondContact O-CG 3.43Å; I14-L18 PolarHBondContact O-N 2.88Å; S15-L18 PolarHBondContact O-N 3.48Å; L18-K20 VanDerWaalsContact C-N 3.33Å; L18-K20 PolarHBondContact O-N 3.22Å; L18-V21 PolarHBondContact O-N 3.49Å; L18-M22 WeakPolarHBondContact O-CB 3.2Å; L18-M22 VanDerWaalsContact O-CG 3.25Å; L18-M22 WeakPolarHBondContact O-CG 3.49Å; L18-M22 PolarHBondContact O-N 3.07Å
19V60.2Low68.7Low77 Ų77112.6 Ų112.647%0.46753%0.532SS..Hα-helixtrans-61.6-40.7179.2172.40000111.4S15 M22 M23S15-V19 WeakPolarHBondContact O-CB 3.27Å; S15-V19 VanDerWaalsContact O-CG2 3.24Å; S15-V19 WeakPolarHBondContact O-CG2 3.31Å; S15-V19 PolarHBondContact O-N 2.96Å; V19-M22 WeakPolarHBondContact O-CB 3.25Å; V19-M22 PolarHBondContact O-N 3.23Å; V19-M23 HydrophobicContact CG1-CG 4.36Å; V19-M23 WeakPolarHBondContact O-CG 3.39Å; V19-M23 PolarHBondContact O-N 3.21Å
20K60Low69Low169 Ų169112.2 Ų112.274%0.73553%0.531SS*.Hα-helixtrans-66.3-38.1177.8-168.2173.9-1771780112.6L16 R17 L18 M22 M23 S24L16-K20 VanDerWaalsContact O-CB 3.27Å; L16-K20 WeakPolarHBondContact O-CB 3.3Å; L16-K20 PolarHBondContact O-N 2.95Å; R17-K20 PolarHBondContact O-N 3.42Å; L18-K20 VanDerWaalsContact C-N 3.33Å; L18-K20 PolarHBondContact O-N 3.22Å; K20-M22 VanDerWaalsContact C-N 3.34Å; K20-M23 PolarHBondContact O-N 3.36Å; K20-S24 PolarHBondContact O-N 3.36Å
21V62.8Low69.1Low82 Ų82110.3 Ų110.350%0.49752%0.522SS..Hα-helixtrans-66.7-40.3172.8172.60000110.4R17 L18 M23 S24 S29R17-V21 VanDerWaalsContact O-CG2 3.31Å; R17-V21 WeakPolarHBondContact O-CG2 3.46Å; R17-V21 PolarHBondContact O-N 3.39Å; L18-V21 PolarHBondContact O-N 3.49Å; V21-M23 VanDerWaalsContact C-N 3.28Å; V21-M23 PolarHBondContact O-N 3.27Å; V21-S24 PolarHBondContact O-N 3.47Å; V21-S29 PolarHBondContact O-OG 3.1Å
22M57.9Low69.3Low83 Ų83111.4 Ų111.441%0.40953%0.525SS..Hα-helixtrans-61.3-35.6177.4-72.2-17777.200113.5L18 V19 K20 S29 M33L18-M22 WeakPolarHBondContact O-CB 3.2Å; L18-M22 VanDerWaalsContact O-CG 3.25Å; L18-M22 WeakPolarHBondContact O-CG 3.49Å; L18-M22 PolarHBondContact O-N 3.07Å; V19-M22 WeakPolarHBondContact O-CB 3.25Å; V19-M22 PolarHBondContact O-N 3.23Å; K20-M22 VanDerWaalsContact C-N 3.34Å; M22-S29 VanDerWaalsContact CA-OG 3.25Å; M22-S29 WeakPolarHBondContact CA-OG 3.4Å; M22-S29 PolarHBondContact O-OG 3.17Å; M22-M33 HydrophobicContact CE-CE 4.32Å; M22-M33 HydrophobicContact SD-CE 4.36Å
23M56.4Low69.7Low157 Ų157110.9 Ų110.977%0.77352%0.523SS*.Hα-helixtrans-75.6-21.6179.5-70.4-99.192.600113.6V19 K20 V21V19-M23 HydrophobicContact CG1-CG 4.36Å; V19-M23 WeakPolarHBondContact O-CG 3.39Å; V19-M23 PolarHBondContact O-N 3.21Å; K20-M23 PolarHBondContact O-N 3.36Å; V21-M23 VanDerWaalsContact C-N 3.28Å; V21-M23 PolarHBondContact O-N 3.27Å
24S62.4Low70.1Confident88 Ų88105.4 Ų105.462%0.61551%0.508SS*.Hα-helixtrans-71.6-42.7-175.1-167.50000111.8K20 V21K20-S24 PolarHBondContact O-N 3.36Å; V21-S24 PolarHBondContact O-N 3.47Å
25E72.5Confident70.5Confident121 Ų121102.6 Ų102.657%0.56549%0.494SS*.  trans-148.2107-178.5-66.7-60158.500109.5W27 Y28 S29E25-W27 VanDerWaalsContact C-N 3.3Å; E25-W27 PolarHBondContact O-N 3.36Å; E25-Y28 PolarHBondContact O-N 3.49Å; E25-S29 WeakPolarHBondContact O-CB 3.47Å; E25-S29 PolarHBondContact O-N 3.48Å; E25-S29 VanDerWaalsContact O-N 3.13Å; E25-S29 PolarHBondContact O-OG 2.93Å
26W75.7Confident71.3Confident209 Ų209105.9 Ų105.979%0.79250%0.501SS*.Hα-helixtrans-62-39.7-172.8-161.538.4000111.9S29 F30W26-S29 PolarHBondContact O-N 3.37Å; W26-F30 WeakPolarHBondContact O-CB 3.46Å; W26-F30 PolarHBondContact O-N 3.42Å
27W76Confident72.4Confident193 Ų193102.6 Ų102.673%0.73149%0.488SS*.Hα-helixtrans-66.5-48.6179.2-66.3118.8000113.2E25 S29 F30 V31E25-W27 VanDerWaalsContact C-N 3.3Å; E25-W27 PolarHBondContact O-N 3.36Å; W27-S29 PolarHBondContact O-N 2.82Å; W27-F30 PolarHBondContact O-N 2.71Å; W27-V31 WeakPolarHBondContact O-CG2 3.25Å; W27-V31 PolarHBondContact O-N 3.46Å; W27-V31 VanDerWaalsContact O-N 3.11Å
28Y75.8Confident73Confident122 Ų12296.1 Ų96.148%0.47847%0.467SS..Hα-helixtrans-59.6-41.6178.9-178.2-101000110.9E25 V31 M32 L64E25-Y28 PolarHBondContact O-N 3.49Å; Y28-V31 PolarHBondContact O-N 2.83Å; Y28-M32 HydrophobicContact CD1-CG 4.01Å; Y28-M32 HydrophobicContact CE1-CG 3.62Å; Y28-M32 HydrophobicContact CE1-SD 4.45Å; Y28-M32 HydrophobicContact CE2-CG 4.19Å; Y28-M32 HydrophobicContact CE2-SD 4.45Å; Y28-M32 HydrophobicContact CG-CG 4.45Å; Y28-M32 WeakPolarHBondContact O-CB 3.25Å; Y28-M32 VanDerWaalsContact O-CG 3.25Å; Y28-M32 WeakPolarHBondContact O-CG 3.38Å; Y28-M32 PolarHBondContact O-N 3.5Å; Y28-L64 HydrophobicContact CD2-CD2 3.88Å; Y28-L64 HydrophobicContact CE2-CD2 4.01Å
29S74.8Confident73.8Confident9 Ų993.2 Ų93.26%0.06345%0.452CS..Hα-helixtrans-66.9-39.3-179.6-55.90000112.5V21 M22 E25 W26 W27 M32 M33V21-S29 PolarHBondContact O-OG 3.1Å; M22-S29 VanDerWaalsContact CA-OG 3.25Å; M22-S29 WeakPolarHBondContact CA-OG 3.4Å; M22-S29 PolarHBondContact O-OG 3.17Å; E25-S29 WeakPolarHBondContact O-CB 3.47Å; E25-S29 PolarHBondContact O-N 3.48Å; E25-S29 VanDerWaalsContact O-N 3.13Å; E25-S29 PolarHBondContact O-OG 2.93Å; W26-S29 PolarHBondContact O-N 3.37Å; W27-S29 PolarHBondContact O-N 2.82Å; S29-M32 PolarHBondContact O-N 2.96Å; S29-M33 VanDerWaalsContact O-CB 3.27Å; S29-M33 WeakPolarHBondContact O-CB 3.48Å; S29-M33 PolarHBondContact O-N 3.32Å
30F82.1Confident74.8Confident133 Ų13393.2 Ų93.258%0.58345%0.452SS*.Hα-helixtrans-62.4-45.8174.8179.9-99.6000111.9W26 W27 M33 S34W26-F30 WeakPolarHBondContact O-CB 3.46Å; W26-F30 PolarHBondContact O-N 3.42Å; W27-F30 PolarHBondContact O-N 2.71Å; F30-M33 PolarHBondContact O-N 2.91Å; F30-S34 WeakPolarHBondContact O-CB 3.49Å; F30-S34 PolarHBondContact O-N 2.85Å; F30-S34 PolarHBondContact O-OG 3.36Å
31V80.4Confident75.6Confident42 Ų4290.5 Ų90.526%0.25544%0.443SS..Hα-helixtrans-67.5-42.6179.1-174.30000110.8W27 Y28 M33 S34 V35 L64W27-V31 WeakPolarHBondContact O-CG2 3.25Å; W27-V31 PolarHBondContact O-N 3.46Å; W27-V31 VanDerWaalsContact O-N 3.11Å; Y28-V31 PolarHBondContact O-N 2.83Å; V31-M33 VanDerWaalsContact C-N 3.35Å; V31-M33 PolarHBondContact O-N 3.27Å; V31-S34 WeakPolarHBondContact O-CB 3.49Å; V31-S34 PolarHBondContact O-N 3.18Å; V31-V35 WeakPolarHBondContact O-CG2 3.31Å; V31-V35 PolarHBondContact O-N 3.26Å; V31-L64 HydrophobicContact CB-CD1 4.35Å; V31-L64 HydrophobicContact CB-CD2 3.95Å; V31-L64 HydrophobicContact CB-CG 4.35Å; V31-L64 HydrophobicContact CG1-CD1 3.58Å; V31-L64 HydrophobicContact CG1-CD2 3.78Å; V31-L64 HydrophobicContact CG1-CG 3.62Å
32M79.4Confident76.1Confident84 Ų8487.4 Ų87.441%0.41443%0.425SS..Hα-helixtrans-62.3-40.9176.4-72.2-61.8-69.700112.4Y28 S29 V35 F36 L64Y28-M32 HydrophobicContact CD1-CG 4.01Å; Y28-M32 HydrophobicContact CE1-CG 3.62Å; Y28-M32 HydrophobicContact CE1-SD 4.45Å; Y28-M32 HydrophobicContact CE2-CG 4.19Å; Y28-M32 HydrophobicContact CE2-SD 4.45Å; Y28-M32 HydrophobicContact CG-CG 4.45Å; Y28-M32 WeakPolarHBondContact O-CB 3.25Å; Y28-M32 VanDerWaalsContact O-CG 3.25Å; Y28-M32 WeakPolarHBondContact O-CG 3.38Å; Y28-M32 PolarHBondContact O-N 3.5Å; S29-M32 PolarHBondContact O-N 2.96Å; M32-V35 PolarHBondContact O-N 3.49Å; M32-F36 WeakPolarHBondContact O-CB 3.39Å; M32-F36 PolarHBondContact O-N 3.47Å; M32-L64 HydrophobicContact SD-CD1 3.88Å
33M81.3Confident76.8Confident93 Ų9390.9 Ų90.946%0.45843%0.433SS..Hα-helixtrans-65-40.1174.4-173.66070.200111.5M22 S29 F30 V31 F36 C37M22-M33 HydrophobicContact CE-CE 4.32Å; M22-M33 HydrophobicContact SD-CE 4.36Å; S29-M33 VanDerWaalsContact O-CB 3.27Å; S29-M33 WeakPolarHBondContact O-CB 3.48Å; S29-M33 PolarHBondContact O-N 3.32Å; F30-M33 PolarHBondContact O-N 2.91Å; V31-M33 VanDerWaalsContact C-N 3.35Å; V31-M33 PolarHBondContact O-N 3.27Å; M33-F36 PolarHBondContact O-N 3.46Å; M33-F36 HydrophobicContact SD-CD1 4.41Å; M33-C37 VanDerWaalsContact O-CB 3.26Å; M33-C37 WeakPolarHBondContact O-CB 3.49Å; M33-C37 PolarHBondContact O-N 3.44Å
34S82.9Confident77.3Confident37 Ų3786.5 Ų86.526%0.25942%0.417SS..Hα-helixtrans-62.6-45.2177.1-59.10000111.2F30 V31 C37 G38F30-S34 WeakPolarHBondContact O-CB 3.49Å; F30-S34 PolarHBondContact O-N 2.85Å; F30-S34 PolarHBondContact O-OG 3.36Å; V31-S34 WeakPolarHBondContact O-CB 3.49Å; V31-S34 PolarHBondContact O-N 3.18Å; S34-C37 PolarHBondContact O-N 3.13Å; S34-G38 PolarHBondContact O-N 3.42Å
35V82.3Confident77.4Confident17 Ų1787 Ų8710%0.10342%0.419CS..Hα-helixtrans-61.2-46.2174.2172.80000110.9V31 M32 G38 L39 C60 V61V31-V35 WeakPolarHBondContact O-CG2 3.31Å; V31-V35 PolarHBondContact O-N 3.26Å; M32-V35 PolarHBondContact O-N 3.49Å; V35-G38 PolarHBondContact O-N 3.35Å; V35-L39 HydrophobicContact CG1-CD1 4.04Å; V35-L39 HydrophobicContact CG1-CG 4.41Å; V35-L39 WeakPolarHBondContact O-CB 3.37Å; V35-L39 VanDerWaalsContact O-CG 3.26Å; V35-L39 WeakPolarHBondContact O-CG 3.27Å; V35-L39 PolarHBondContact O-N 3.3Å; V35-C60 HydrophobicContact CG2-CB 3.52Å; V35-V61 HydrophobicContact CG2-CG2 4.45Å
36F84Confident77.1Confident130 Ų13092.5 Ų92.557%0.5744%0.436SS*.Hα-helixtrans-60.3-47.4178-178.5-101.1000111.7M32 M33 G38 L39 V40M32-F36 WeakPolarHBondContact O-CB 3.39Å; M32-F36 PolarHBondContact O-N 3.47Å; M33-F36 PolarHBondContact O-N 3.46Å; M33-F36 HydrophobicContact SD-CD1 4.41Å; F36-G38 PolarHBondContact O-N 3.31Å; F36-L39 PolarHBondContact O-N 2.77Å; F36-V40 HydrophobicContact CD1-CG2 4.36Å; F36-V40 HydrophobicContact CE1-CG2 3.97Å; F36-V40 HydrophobicContact CE2-CG2 4.42Å; F36-V40 HydrophobicContact CZ-CG2 4Å; F36-V40 WeakPolarHBondContact O-CG2 3.28Å; F36-V40 PolarHBondContact O-N 3.37Å
37C82.4Confident76.9Confident54 Ų5488.1 Ų88.137%0.36543%0.427SS..Hα-helixtrans-60.3-46.6177.6-170.40000111.5M33 S34 L39 V40 M41M33-C37 VanDerWaalsContact O-CB 3.26Å; M33-C37 WeakPolarHBondContact O-CB 3.49Å; M33-C37 PolarHBondContact O-N 3.44Å; S34-C37 PolarHBondContact O-N 3.13Å; C37-L39 VanDerWaalsContact C-N 3.33Å; C37-L39 PolarHBondContact O-N 3.34Å; C37-V40 PolarHBondContact O-N 2.99Å; C37-V40 VanDerWaalsContact O-N 3.13Å; C37-M41 WeakPolarHBondContact O-CG 3.39Å; C37-M41 PolarHBondContact O-N 3.37Å; C37-M41 VanDerWaalsContact SG-CE 3.5Å
38G80.7Confident76.9Confident12 Ų1280.7 Ų80.712%0.12440%0.399CS..Hα-helixtrans-61.8-37.617600000113.4S34 V35 F36 T42S34-G38 PolarHBondContact O-N 3.42Å; V35-G38 PolarHBondContact O-N 3.35Å; F36-G38 PolarHBondContact O-N 3.31Å; G38-T42 WeakPolarHBondContact O-CB 3.1Å; G38-T42 WeakPolarHBondContact O-CG2 3.25Å; G38-T42 PolarHBondContact O-N 3.03Å; G38-T42 VanDerWaalsContact O-N 3.1Å; G38-T42 PolarHBondContact O-OG1 3.41Å
39L80.5Confident77.2Confident45 Ų4576.7 Ų76.724%0.23640%0.395CS..Hα-helixtrans-67.4-33173.8-71.8175.3000113.2V35 F36 C37 T42 R43 F53 L57 P116V35-L39 HydrophobicContact CG1-CD1 4.04Å; V35-L39 HydrophobicContact CG1-CG 4.41Å; V35-L39 WeakPolarHBondContact O-CB 3.37Å; V35-L39 VanDerWaalsContact O-CG 3.26Å; V35-L39 WeakPolarHBondContact O-CG 3.27Å; V35-L39 PolarHBondContact O-N 3.3Å; F36-L39 PolarHBondContact O-N 2.77Å; C37-L39 VanDerWaalsContact C-N 3.33Å; C37-L39 PolarHBondContact O-N 3.34Å; L39-T42 WeakPolarHBondContact CA-OG1 3.41Å; L39-T42 PolarHBondContact O-OG1 3.47Å; L39-T42 VanDerWaalsContact O-OG1 3.06Å; L39-R43 WeakPolarHBondContact O-CG 3.42Å; L39-F53 HydrophobicContact CD2-CE2 3.94Å; L39-F53 HydrophobicContact CD2-CZ 3.69Å; L39-L57 HydrophobicContact CD2-CD2 4.32Å; L39-P116 HydrophobicContact CD2-CB 3.99Å
40V80.8Confident77.5Confident78 Ų7882.4 Ų82.447%0.47342%0.415SS..Hα-helixtrans-74.6-46.8175.5173.50000110.6F36 C37 T42 R43F36-V40 HydrophobicContact CD1-CG2 4.36Å; F36-V40 HydrophobicContact CE1-CG2 3.97Å; F36-V40 HydrophobicContact CE2-CG2 4.42Å; F36-V40 HydrophobicContact CZ-CG2 4Å; F36-V40 WeakPolarHBondContact O-CG2 3.28Å; F36-V40 PolarHBondContact O-N 3.37Å; C37-V40 PolarHBondContact O-N 2.99Å; C37-V40 VanDerWaalsContact O-N 3.13Å; V40-T42 VanDerWaalsContact C-N 3.26Å; V40-T42 PolarHBondContact O-N 2.88Å; V40-R43 WeakPolarHBondContact O-CB 3.32Å; V40-R43 PolarHBondContact O-N 3.05Å
41M76.7Confident77.7Confident111 Ų11183.4 Ų83.455%0.54742%0.423SS..Hα-helixtrans-59.9-36.8179.7-72.7178.3171.200112.4C37 R43 C44C37-M41 WeakPolarHBondContact O-CG 3.39Å; C37-M41 PolarHBondContact O-N 3.37Å; C37-M41 VanDerWaalsContact SG-CE 3.5Å; M41-R43 PolarHBondContact O-N 2.96Å; M41-C44 WeakPolarHBondContact O-CB 3.13Å; M41-C44 PolarHBondContact O-N 3.34Å; M41-C44 VanDerWaalsContact O-N 3.13Å
42T73.6Confident78Confident18 Ų1883.8 Ų83.811%0.1144%0.436CS..THydrogen-bonded Turntrans-71-917850.70000114.3G38 L39 V40 F53G38-T42 WeakPolarHBondContact O-CB 3.1Å; G38-T42 WeakPolarHBondContact O-CG2 3.25Å; G38-T42 PolarHBondContact O-N 3.03Å; G38-T42 VanDerWaalsContact O-N 3.1Å; G38-T42 PolarHBondContact O-OG1 3.41Å; L39-T42 WeakPolarHBondContact CA-OG1 3.41Å; L39-T42 PolarHBondContact O-OG1 3.47Å; L39-T42 VanDerWaalsContact O-OG1 3.06Å; V40-T42 VanDerWaalsContact C-N 3.26Å; V40-T42 PolarHBondContact O-N 2.88Å; T42-F53 HydrophobicContact CG2-CD2 3.39Å; T42-F53 HydrophobicContact CG2-CE2 3.71Å; T42-F53 HydrophobicContact CG2-CG 4.26Å
43R71.7Confident78.3Confident156 Ų15680.1 Ų80.159%0.58942%0.418SS*.THydrogen-bonded Turntrans-83.2-15.4170.9-64.1-70.7161.8794.4113L39 V40 M41L39-R43 WeakPolarHBondContact O-CG 3.42Å; V40-R43 WeakPolarHBondContact O-CB 3.32Å; V40-R43 PolarHBondContact O-N 3.05Å; M41-R43 PolarHBondContact O-N 2.96Å
44C68.2Low78.7Confident64 Ų6479.6 Ų79.643%0.43241%0.413SS..SBendtrans-71.3127.3172.3-68.20000109.3M41 I47M41-C44 WeakPolarHBondContact O-CB 3.13Å; M41-C44 PolarHBondContact O-N 3.34Å; M41-C44 VanDerWaalsContact O-N 3.13Å; C44-I47 HydrophobicContact CB-CD1 4.03Å
45P64.4Low79Confident100 Ų10080.6 Ų80.665%0.64942%0.423SS*.THydrogen-bonded Turntrans-58.3151.6177.725.3-33.1000110.5I47P45-I47 VanDerWaalsContact C-N 3.35Å; P45-I47 PolarHBondContact O-N 3.21Å
46Y65.8Low79.3Confident235 Ų23583 Ų8392%0.92243%0.432SS*.THydrogen-bonded Turntrans76.6-15.5179.6-51.6-77.3000118.7Y48Y46-Y48 VanDerWaalsContact C-N 3.34Å
47I71.4Confident79.5Confident118 Ų11876.8 Ų76.861%0.60541%0.405SS*.  trans-86-12.1177.5-61.8170.2000111.8C44 P45 G49C44-I47 HydrophobicContact CB-CD1 4.03Å; P45-I47 VanDerWaalsContact C-N 3.35Å; P45-I47 PolarHBondContact O-N 3.21Å; I47-G49 PolarHBondContact O-N 3.21Å
48Y75.2Confident80Confident36 Ų3676.4 Ų76.414%0.14140%0.401CS..  trans-79.7105.6-167.6-173.4-117.1000114Y46 W50 F53 V120 S121 I124Y46-Y48 VanDerWaalsContact C-N 3.34Å; Y48-W50 AromaticContact CD1-CD1 3.66Å; Y48-W50 AromaticContact CD1-NE1 3.85Å; Y48-W50 AromaticContact CE1-CD1 3.03Å; Y48-W50 HydrophobicContact CE1-CG 4.24Å; Y48-W50 AromaticContact CE1-NE1 3.32Å; Y48-W50 VanDerWaalsContact CE1-NE1 3.32Å; Y48-W50 AromaticContact CZ-CD1 3.63Å; Y48-F53 HydrophobicContact CD2-CB 4.32Å; Y48-F53 HydrophobicContact CE2-CB 3.71Å; Y48-F53 AromaticContact CE2-CD1 3.68Å; Y48-F53 HydrophobicContact CE2-CD1 3.68Å; Y48-F53 HydrophobicContact CE2-CE1 4.42Å; Y48-F53 AromaticContact CE2-CG 3.78Å; Y48-F53 HydrophobicContact CE2-CG 3.78Å; Y48-V120 HydrophobicContact CD2-CG1 4.15Å; Y48-V120 HydrophobicContact CE2-CG1 3.74Å; Y48-S121 WeakPolarHBondContact OH-CB 3.43Å; Y48-S121 PolarHBondContact OH-OG 2.62Å; Y48-I124 HydrophobicContact CD1-CB 4.36Å; Y48-I124 HydrophobicContact CD1-CD1 3.34Å; Y48-I124 HydrophobicContact CD1-CG1 4.43Å; Y48-I124 HydrophobicContact CD1-CG2 4.1Å; Y48-I124 HydrophobicContact CD2-CD1 3.71Å; Y48-I124 HydrophobicContact CE1-CD1 3.77Å; Y48-I124 HydrophobicContact CE2-CD1 4.18Å; Y48-I124 HydrophobicContact CG-CD1 3.3Å
49G82.7Confident80.4Confident38 Ų3880.2 Ų80.239%0.39243%0.425SS..  trans-103.7127163.500000111.7I47 M51 G52 F53I47-G49 PolarHBondContact O-N 3.21Å; G49-M51 PolarHBondContact O-N 3.46Å; G49-G52 PolarHBondContact O-N 2.96Å; G49-F53 WeakPolarHBondContact O-CB 2.99Å; G49-F53 PolarHBondContact O-N 3.18Å
50W81.5Confident80.7Confident129 Ų12979.1 Ų79.149%0.48942%0.42SS..Hα-helixtrans-58.4-46.8-176.9-650.6000112.2Y48 F54 R125Y48-W50 AromaticContact CD1-CD1 3.66Å; Y48-W50 AromaticContact CD1-NE1 3.85Å; Y48-W50 AromaticContact CE1-CD1 3.03Å; Y48-W50 HydrophobicContact CE1-CG 4.24Å; Y48-W50 AromaticContact CE1-NE1 3.32Å; Y48-W50 VanDerWaalsContact CE1-NE1 3.32Å; Y48-W50 AromaticContact CZ-CD1 3.63Å; W50-F54 WeakPolarHBondContact O-CB 3.24Å; W50-F54 PolarHBondContact O-N 3.45Å; W50-F54 VanDerWaalsContact O-N 3.11Å; W50-R125 VanDerWaalsContact CZ2-CD 3.49Å; W50-R125 HydrophobicContact CZ2-CG 3.95Å
51M86.6Confident81Confident154 Ų15476.2 Ų76.276%0.75940%0.403SS*.Hα-helixtrans-69.9-43-179.4-65.5-58.2-71.100112.3G49 F54 A55G49-M51 PolarHBondContact O-N 3.46Å; M51-F54 PolarHBondContact O-N 3.42Å; M51-A55 WeakPolarHBondContact O-CB 3.39Å; M51-A55 PolarHBondContact O-N 3.41Å
52G85.6Confident81.5Confident50 Ų5073 Ų7352%0.51539%0.388SS..Hα-helixtrans-63.5-43.3179.400000112.2G49 A55 F56G49-G52 PolarHBondContact O-N 2.96Å; G52-A55 PolarHBondContact O-N 3Å; G52-F56 WeakPolarHBondContact O-CB 3.45Å; G52-F56 PolarHBondContact O-N 3.11Å
53F86.2Confident82.2Confident8 Ų875.6 Ų75.64%0.03541%0.405CS..Hα-helixtrans-66.2-42.2176.9-177.7-121.3000112.5L39 T42 Y48 G49 F56 L57 F117 V120L39-F53 HydrophobicContact CD2-CE2 3.94Å; L39-F53 HydrophobicContact CD2-CZ 3.69Å; T42-F53 HydrophobicContact CG2-CD2 3.39Å; T42-F53 HydrophobicContact CG2-CE2 3.71Å; T42-F53 HydrophobicContact CG2-CG 4.26Å; Y48-F53 HydrophobicContact CD2-CB 4.32Å; Y48-F53 HydrophobicContact CE2-CB 3.71Å; Y48-F53 AromaticContact CE2-CD1 3.68Å; Y48-F53 HydrophobicContact CE2-CD1 3.68Å; Y48-F53 HydrophobicContact CE2-CE1 4.42Å; Y48-F53 AromaticContact CE2-CG 3.78Å; Y48-F53 HydrophobicContact CE2-CG 3.78Å; G49-F53 WeakPolarHBondContact O-CB 2.99Å; G49-F53 PolarHBondContact O-N 3.18Å; F53-F56 PolarHBondContact O-N 3.24Å; F53-L57 HydrophobicContact CD1-CD1 3.95Å; F53-L57 HydrophobicContact CD2-CG 4.45Å; F53-L57 HydrophobicContact CE1-CD1 3.52Å; F53-L57 HydrophobicContact CE1-CG 4.32Å; F53-L57 HydrophobicContact CE2-CD1 4.17Å; F53-L57 HydrophobicContact CE2-CD2 4.3Å; F53-L57 HydrophobicContact CE2-CG 4.09Å; F53-L57 HydrophobicContact CG-CD1 4.49Å; F53-L57 HydrophobicContact CZ-CD1 3.62Å; F53-L57 HydrophobicContact CZ-CD2 4.23Å; F53-L57 HydrophobicContact CZ-CG 4.03Å; F53-L57 WeakPolarHBondContact O-CG 3.37Å; F53-L57 PolarHBondContact O-N 2.88Å; F53-F117 AromaticContact CD1-CD2 3.95Å; F53-F117 HydrophobicContact CD1-CD2 3.95Å; F53-F117 HydrophobicContact CE1-CD2 4.41Å; F53-V120 HydrophobicContact CE1-CB 3.78Å; F53-V120 HydrophobicContact CE1-CG1 4.11Å; F53-V120 HydrophobicContact CE1-CG2 3.97Å; F53-V120 HydrophobicContact CZ-CB 4.11Å; F53-V120 HydrophobicContact CZ-CG1 4.38Å; F53-V120 HydrophobicContact CZ-CG2 3.8Å
54F88.5Confident82.9Confident82 Ų8269.7 Ų69.736%0.3639%0.385SS..Hα-helixtrans-62.6-45.9176.4-175.4-104.1000111.5W50 M51 F56 L57 V58 V113 F117W50-F54 WeakPolarHBondContact O-CB 3.24Å; W50-F54 PolarHBondContact O-N 3.45Å; W50-F54 VanDerWaalsContact O-N 3.11Å; M51-F54 PolarHBondContact O-N 3.42Å; F54-F56 VanDerWaalsContact C-N 3.35Å; F54-F56 PolarHBondContact O-N 3.49Å; F54-L57 PolarHBondContact O-N 2.93Å; F54-V58 HydrophobicContact CD1-CG2 4.08Å; F54-V58 HydrophobicContact CE1-CG2 3.7Å; F54-V58 HydrophobicContact CE2-CG2 4.23Å; F54-V58 HydrophobicContact CG-CG2 4.5Å; F54-V58 HydrophobicContact CZ-CG2 3.78Å; F54-V58 VanDerWaalsContact O-CG2 3.3Å; F54-V58 WeakPolarHBondContact O-CG2 3.26Å; F54-V58 PolarHBondContact O-N 3.37Å; F54-V113 HydrophobicContact CD2-CG1 4.35Å; F54-V113 HydrophobicContact CE2-CG1 3.88Å; F54-F117 HydrophobicContact CB-CD2 4.07Å; F54-F117 HydrophobicContact CB-CE2 3.89Å; F54-F117 AromaticContact CD2-CD2 3.9Å; F54-F117 HydrophobicContact CD2-CD2 3.9Å; F54-F117 HydrophobicContact CD2-CE2 4.16Å; F54-F117 HydrophobicContact CD2-CG 4.14Å; F54-F117 HydrophobicContact CG-CD2 4.48Å; F54-F117 HydrophobicContact CG-CE2 4.43Å
55A90.7Very high83.8Confident57 Ų5768 Ų6847%0.47137%0.37SS..Hα-helixtrans-60.8-41.7176.800000112.4M51 G52 V58 C59M51-A55 WeakPolarHBondContact O-CB 3.39Å; M51-A55 PolarHBondContact O-N 3.41Å; G52-A55 PolarHBondContact O-N 3Å; A55-V58 PolarHBondContact O-N 3.33Å; A55-C59 VanDerWaalsContact O-CB 3.29Å; A55-C59 WeakPolarHBondContact O-CB 3.37Å; A55-C59 PolarHBondContact O-N 3.11Å
56F87.9Confident84.9Confident67 Ų6767.8 Ų67.829%0.29436%0.363SS..Hα-helixtrans-59.4-47.2174.1174.6-100000112G52 F53 F54 C59 C60G52-F56 WeakPolarHBondContact O-CB 3.45Å; G52-F56 PolarHBondContact O-N 3.11Å; F53-F56 PolarHBondContact O-N 3.24Å; F54-F56 VanDerWaalsContact C-N 3.35Å; F54-F56 PolarHBondContact O-N 3.49Å; F56-C59 PolarHBondContact O-N 3.26Å; F56-C60 PolarHBondContact O-N 3.43Å
57L89.2Confident85.9Confident1 Ų160 Ų601%0.00534%0.342CS..Hα-helixtrans-63-43.8177.6-72.5174.5000112L39 F53 F54 V61 V113 P116 F117L39-L57 HydrophobicContact CD2-CD2 4.32Å; F53-L57 HydrophobicContact CD1-CD1 3.95Å; F53-L57 HydrophobicContact CD2-CG 4.45Å; F53-L57 HydrophobicContact CE1-CD1 3.52Å; F53-L57 HydrophobicContact CE1-CG 4.32Å; F53-L57 HydrophobicContact CE2-CD1 4.17Å; F53-L57 HydrophobicContact CE2-CD2 4.3Å; F53-L57 HydrophobicContact CE2-CG 4.09Å; F53-L57 HydrophobicContact CG-CD1 4.49Å; F53-L57 HydrophobicContact CZ-CD1 3.62Å; F53-L57 HydrophobicContact CZ-CD2 4.23Å; F53-L57 HydrophobicContact CZ-CG 4.03Å; F53-L57 WeakPolarHBondContact O-CG 3.37Å; F53-L57 PolarHBondContact O-N 2.88Å; F54-L57 PolarHBondContact O-N 2.93Å; L57-V61 HydrophobicContact CD2-CG2 4.22Å; L57-V61 WeakPolarHBondContact O-CA 3.41Å; L57-V61 WeakPolarHBondContact O-CB 3.26Å; L57-V61 VanDerWaalsContact O-CG2 3.31Å; L57-V61 WeakPolarHBondContact O-CG2 3.36Å; L57-V61 PolarHBondContact O-N 3.01Å; L57-V113 HydrophobicContact CB-CG1 4.05Å; L57-P116 HydrophobicContact CD1-CB 4.31Å; L57-P116 HydrophobicContact CD1-CG 3.93Å; L57-P116 HydrophobicContact CD2-CB 4.29Å; L57-P116 HydrophobicContact CD2-CG 3.88Å; L57-F117 HydrophobicContact CD1-CB 3.9Å
58V91.3Very high86.5Confident46 Ų4658.7 Ų58.728%0.27934%0.336SS..Hα-helixtrans-59.9-47.3176.6167.50000110.4F54 A55 L62 V113F54-V58 HydrophobicContact CD1-CG2 4.08Å; F54-V58 HydrophobicContact CE1-CG2 3.7Å; F54-V58 HydrophobicContact CE2-CG2 4.23Å; F54-V58 HydrophobicContact CG-CG2 4.5Å; F54-V58 HydrophobicContact CZ-CG2 3.78Å; F54-V58 VanDerWaalsContact O-CG2 3.3Å; F54-V58 WeakPolarHBondContact O-CG2 3.26Å; F54-V58 PolarHBondContact O-N 3.37Å; A55-V58 PolarHBondContact O-N 3.33Å; V58-L62 HydrophobicContact CB-CD1 4.33Å; V58-L62 HydrophobicContact CG1-CD1 3.55Å; V58-L62 HydrophobicContact CG1-CG 4.38Å; V58-L62 WeakPolarHBondContact O-CB 3.49Å; V58-L62 WeakPolarHBondContact O-CG 3.39Å; V58-L62 PolarHBondContact O-N 3.49Å; V58-V113 HydrophobicContact CG2-CG1 3.9Å
59C89.5Confident87Confident91 Ų9160.5 Ų60.562%0.61535%0.347SS*.Hα-helixtrans-66.9-37-177.8-1700000113.3A55 F56 P63A55-C59 VanDerWaalsContact O-CB 3.29Å; A55-C59 WeakPolarHBondContact O-CB 3.37Å; A55-C59 PolarHBondContact O-N 3.11Å; F56-C59 PolarHBondContact O-N 3.26Å; C59-P63 WeakPolarHBondContact O-CD 3.39Å; C59-P63 WeakPolarHBondContact O-CG 3.3Å
60C86.4Confident87.1Confident22 Ų2262 Ų6215%0.14935%0.348CS..Hα-helixtrans-91.1-40.8-178.7-63.20000113.4V35 F56 L64V35-C60 HydrophobicContact CG2-CB 3.52Å; F56-C60 PolarHBondContact O-N 3.43Å; C60-L64 WeakPolarHBondContact O-CG 3.38Å
61V88Confident87.3Confident17 Ų1759.7 Ų59.710%0.10335%0.348CS..Hα-helixtrans-84.1-36.9-171.9-1780000112.1V35 L57 L64 F65 T112 V113V35-V61 HydrophobicContact CG2-CG2 4.45Å; L57-V61 HydrophobicContact CD2-CG2 4.22Å; L57-V61 WeakPolarHBondContact O-CA 3.41Å; L57-V61 WeakPolarHBondContact O-CB 3.26Å; L57-V61 VanDerWaalsContact O-CG2 3.31Å; L57-V61 WeakPolarHBondContact O-CG2 3.36Å; L57-V61 PolarHBondContact O-N 3.01Å; V61-L64 PolarHBondContact O-N 2.96Å; V61-F65 PolarHBondContact O-N 2.87Å; V61-T112 HydrophobicContact CG1-CG2 3.61Å; V61-V113 HydrophobicContact CB-CG2 4.14Å; V61-V113 HydrophobicContact CG1-CG2 4.15Å
62L87.9Confident87.1Confident45 Ų4558.8 Ų58.824%0.23634%0.337CS..Hα-helixtrans-64-46.1179.3-67.5179.5000112.6V58 L64 F65 I66 P109 V113V58-L62 HydrophobicContact CB-CD1 4.33Å; V58-L62 HydrophobicContact CG1-CD1 3.55Å; V58-L62 HydrophobicContact CG1-CG 4.38Å; V58-L62 WeakPolarHBondContact O-CB 3.49Å; V58-L62 WeakPolarHBondContact O-CG 3.39Å; V58-L62 PolarHBondContact O-N 3.49Å; L62-L64 VanDerWaalsContact C-N 3.28Å; L62-L64 PolarHBondContact O-N 2.95Å; L62-F65 PolarHBondContact O-N 3.12Å; L62-F65 VanDerWaalsContact O-N 3.14Å; L62-I66 VanDerWaalsContact O-CG1 3.28Å; L62-I66 WeakPolarHBondContact O-CG1 3.46Å; L62-I66 PolarHBondContact O-N 3.34Å; L62-P109 HydrophobicContact CD2-CB 3.84Å; L62-V113 HydrophobicContact CD2-CG2 3.84Å; L62-V113 HydrophobicContact CG-CG2 4.06Å
63P87.7Confident87Confident72 Ų7259.3 Ų59.347%0.46833%0.327SS..Hα-helixtrans-62.6-35.2178-26.638.7000113.1C59 I66 S67C59-P63 WeakPolarHBondContact O-CD 3.39Å; C59-P63 WeakPolarHBondContact O-CG 3.3Å; P63-I66 PolarHBondContact O-N 2.87Å; P63-S67 VanDerWaalsContact O-CB 3.28Å; P63-S67 WeakPolarHBondContact O-CB 3.28Å; P63-S67 PolarHBondContact O-N 3.26Å
64L86.4Confident86.8Confident32 Ų3265 Ų6517%0.16836%0.358CS..Hα-helixtrans-62-44.6173.5-76177.3000111.9Y28 V31 M32 C60 V61 L62 S67 L68Y28-L64 HydrophobicContact CD2-CD2 3.88Å; Y28-L64 HydrophobicContact CE2-CD2 4.01Å; V31-L64 HydrophobicContact CB-CD1 4.35Å; V31-L64 HydrophobicContact CB-CD2 3.95Å; V31-L64 HydrophobicContact CB-CG 4.35Å; V31-L64 HydrophobicContact CG1-CD1 3.58Å; V31-L64 HydrophobicContact CG1-CD2 3.78Å; V31-L64 HydrophobicContact CG1-CG 3.62Å; M32-L64 HydrophobicContact SD-CD1 3.88Å; C60-L64 WeakPolarHBondContact O-CG 3.38Å; V61-L64 PolarHBondContact O-N 2.96Å; L62-L64 VanDerWaalsContact C-N 3.28Å; L62-L64 PolarHBondContact O-N 2.95Å; L64-S67 PolarHBondContact O-N 3.4Å; L64-L68 PolarHBondContact O-N 3.26Å; L64-L68 VanDerWaalsContact O-N 3.11Å
65F87.9Confident86.4Confident29 Ų2965.9 Ų65.913%0.12737%0.37CS..Hα-helixtrans-65.9-44.1178-174.3-88.4000111.7V61 L62 S67 L68 M69 R108 P109V61-F65 PolarHBondContact O-N 2.87Å; L62-F65 PolarHBondContact O-N 3.12Å; L62-F65 VanDerWaalsContact O-N 3.14Å; F65-S67 VanDerWaalsContact C-N 3.34Å; F65-S67 PolarHBondContact O-N 3.25Å; F65-L68 PolarHBondContact O-N 3.23Å; F65-M69 PolarHBondContact O-N 3.1Å; F65-R108 HydrophobicContact CE2-CB 4.02Å; F65-R108 HydrophobicContact CE2-CG 3.59Å; F65-R108 HydrophobicContact CZ-CB 3.74Å; F65-R108 HydrophobicContact CZ-CG 3.81Å; F65-P109 HydrophobicContact CD1-CB 3.55Å; F65-P109 HydrophobicContact CD1-CG 4.06Å; F65-P109 HydrophobicContact CE1-CB 3.87Å; F65-P109 VanDerWaalsContact CE1-CD 3.49Å; F65-P109 HydrophobicContact CE1-CG 3.89Å; F65-P109 HydrophobicContact CG-CB 4Å
66I86.8Confident86Confident95 Ų9565.4 Ų65.449%0.48736%0.363SS..Hα-helixtrans-62.1-43.6177.7-67.6166000110.3L62 P63 L68 M69 V70L62-I66 VanDerWaalsContact O-CG1 3.28Å; L62-I66 WeakPolarHBondContact O-CG1 3.46Å; L62-I66 PolarHBondContact O-N 3.34Å; P63-I66 PolarHBondContact O-N 2.87Å; I66-L68 VanDerWaalsContact C-N 3.35Å; I66-L68 PolarHBondContact O-N 3.31Å; I66-M69 PolarHBondContact O-N 2.85Å; I66-V70 HydrophobicContact CG2-CG2 4.2Å; I66-V70 WeakPolarHBondContact O-CG2 3.33Å; I66-V70 PolarHBondContact O-N 2.98Å
67S86.5Confident85.6Confident70 Ų7064.7 Ų64.749%0.4937%0.369SS..Hα-helixtrans-56.6-48.2175.6173.40000111.4P63 L64 F65 M69 V70 T71P63-S67 VanDerWaalsContact O-CB 3.28Å; P63-S67 WeakPolarHBondContact O-CB 3.28Å; P63-S67 PolarHBondContact O-N 3.26Å; L64-S67 PolarHBondContact O-N 3.4Å; F65-S67 VanDerWaalsContact C-N 3.34Å; F65-S67 PolarHBondContact O-N 3.25Å; S67-M69 VanDerWaalsContact C-N 3.33Å; S67-M69 PolarHBondContact O-N 3.44Å; S67-V70 PolarHBondContact O-N 3.44Å; S67-T71 PolarHBondContact O-N 2.86Å; S67-T71 PolarHBondContact O-OG1 3.28Å
68L84.3Confident85.3Confident91 Ų9170.5 Ų70.548%0.47641%0.405SS..Hα-helixtrans-61.5-40.8177.3-174.370.7000112.3L64 F65 I66 R72L64-L68 PolarHBondContact O-N 3.26Å; L64-L68 VanDerWaalsContact O-N 3.11Å; F65-L68 PolarHBondContact O-N 3.23Å; I66-L68 VanDerWaalsContact C-N 3.35Å; I66-L68 PolarHBondContact O-N 3.31Å; L68-R72 WeakPolarHBondContact O-CG 3.4Å; L68-R72 PolarHBondContact O-N 3.42Å
69M85.3Confident84.9Confident75 Ų7574.4 Ų74.437%0.36942%0.42SS..Hα-helixtrans-64.9-46.2178.3-177.7-179.3164.300111.3F65 I66 S67 R72 L73F65-M69 PolarHBondContact O-N 3.1Å; I66-M69 PolarHBondContact O-N 2.85Å; S67-M69 VanDerWaalsContact C-N 3.33Å; S67-M69 PolarHBondContact O-N 3.44Å; M69-R72 PolarHBondContact O-N 2.82Å; M69-L73 HydrophobicContact CE-CD1 3.86Å; M69-L73 HydrophobicContact CG-CD1 4.1Å; M69-L73 WeakPolarHBondContact O-CG 3.34Å; M69-L73 PolarHBondContact O-N 3.29Å
70V85.6Confident84.4Confident68 Ų6870.9 Ų70.941%0.41239%0.394SS..Hα-helixtrans-63.7-43.1178.8171.50000111.1I66 S67 R72 L73 N74I66-V70 HydrophobicContact CG2-CG2 4.2Å; I66-V70 WeakPolarHBondContact O-CG2 3.33Å; I66-V70 PolarHBondContact O-N 2.98Å; S67-V70 PolarHBondContact O-N 3.44Å; V70-R72 VanDerWaalsContact C-N 3.29Å; V70-R72 PolarHBondContact O-N 3.24Å; V70-L73 PolarHBondContact O-N 2.92Å; V70-N74 WeakPolarHBondContact CG1-ND2 3.41Å; V70-N74 WeakPolarHBondContact O-CB 3.35Å; V70-N74 PolarHBondContact O-N 3.45Å; V70-N74 PolarHBondContact O-ND2 3.14Å
71T85.4Confident84.1Confident81 Ų8175.6 Ų75.650%0.49741%0.412SS..Hα-helixtrans-58.6-41.3175.9-59.10000111.6S67 N74 V75S67-T71 PolarHBondContact O-N 2.86Å; S67-T71 PolarHBondContact O-OG1 3.28Å; T71-N74 PolarHBondContact O-N 3.04Å; T71-V75 WeakPolarHBondContact O-CG2 3.02Å; T71-V75 PolarHBondContact O-N 3.4Å
72R82.3Confident83.7Confident136 Ų13676.6 Ų76.651%0.51343%0.426SS..Hα-helixtrans-68.6-39.6177.5-71.8-179.8179.3-137-2.4113L68 M69 V70 N74 V75 F80L68-R72 WeakPolarHBondContact O-CG 3.4Å; L68-R72 PolarHBondContact O-N 3.42Å; M69-R72 PolarHBondContact O-N 2.82Å; V70-R72 VanDerWaalsContact C-N 3.29Å; V70-R72 PolarHBondContact O-N 3.24Å; R72-N74 VanDerWaalsContact C-N 3.3Å; R72-N74 PolarHBondContact O-N 3.49Å; R72-V75 PolarHBondContact O-N 2.99Å; R72-F80 HydrophobicContact CB-CD2 4.35Å
73L84.5Confident83.3Confident60 Ų6078.1 Ų78.131%0.31444%0.44SS..Hα-helixtrans-65.1-34.4177.2-72.5171.1000112.4M69 V70 F80M69-L73 HydrophobicContact CE-CD1 3.86Å; M69-L73 HydrophobicContact CG-CD1 4.1Å; M69-L73 WeakPolarHBondContact O-CG 3.34Å; M69-L73 PolarHBondContact O-N 3.29Å; V70-L73 PolarHBondContact O-N 2.92Å; L73-F80 HydrophobicContact CD2-CD1 3.42Å; L73-F80 VanDerWaalsContact CD2-CD1 3.42Å; L73-F80 HydrophobicContact CD2-CD2 4.5Å; L73-F80 HydrophobicContact CD2-CE1 3.48Å; L73-F80 VanDerWaalsContact CD2-CE1 3.48Å; L73-F80 HydrophobicContact CD2-CG 3.95Å; L73-F80 HydrophobicContact CD2-CZ 4.11Å
74N81.6Confident82.9Confident129 Ų12975.3 Ų75.369%0.6942%0.421SS*.Hα-helixtrans-74.3-25.5-179.5-76.5-29.1000114.2V70 T71 R72V70-N74 WeakPolarHBondContact CG1-ND2 3.41Å; V70-N74 WeakPolarHBondContact O-CB 3.35Å; V70-N74 PolarHBondContact O-N 3.45Å; V70-N74 PolarHBondContact O-ND2 3.14Å; T71-N74 PolarHBondContact O-N 3.04Å; R72-N74 VanDerWaalsContact C-N 3.3Å; R72-N74 PolarHBondContact O-N 3.49Å
75V79.8Confident82.7Confident100 Ų10076.7 Ų76.761%0.60643%0.428SS*.Hα-helixtrans-65.9-51.5-179.3170.80000110.6T71 R72T71-V75 WeakPolarHBondContact O-CG2 3.02Å; T71-V75 PolarHBondContact O-N 3.4Å; R72-V75 PolarHBondContact O-N 2.99Å
76S81.5Confident82.2Confident47 Ų4778.6 Ų78.633%0.32944%0.443SS..  trans-170.9116.9173-870000109.8V78 E79 F80S76-V78 PolarHBondContact O-N 3.49Å; S76-E79 PolarHBondContact O-N 3.29Å; S76-F80 WeakPolarHBondContact O-CB 3.27Å; S76-F80 PolarHBondContact O-N 3.19Å
77A80.4Confident81.7Confident51 Ų5182.9 Ų82.942%0.42146%0.461SS..Hα-helixtrans-59.7-36.8175.800000111.7F80 F81A77-F80 PolarHBondContact O-N 2.9Å; A77-F81 WeakPolarHBondContact O-CD2 3.22Å; A77-F81 PolarHBondContact O-N 2.76Å
78V83.2Confident81.4Confident124 Ų12483.4 Ų83.475%0.75248%0.477SS*.Hα-helixtrans-64.8-45.9178.3-177.70000111.2S76 F80 F81 G82S76-V78 PolarHBondContact O-N 3.49Å; V78-F80 VanDerWaalsContact C-N 3.32Å; V78-F80 PolarHBondContact O-N 2.91Å; V78-F81 PolarHBondContact O-N 3.49Å; V78-G82 PolarHBondContact O-N 3.35Å
79E81.6Confident81.3Confident127 Ų12780.3 Ų80.359%0.59346%0.463SS*.Hα-helixtrans-66.1-36.4175.9-64.3-178.6168.900111.5S76 G82 S83S76-E79 PolarHBondContact O-N 3.29Å; E79-G82 PolarHBondContact O-N 2.85Å; E79-S83 VanDerWaalsContact O-CB 3.25Å; E79-S83 WeakPolarHBondContact O-CB 3.45Å; E79-S83 PolarHBondContact O-N 3.03Å; E79-S83 PolarHBondContact O-OG 3.46Å
80F80.1Confident81.4Confident18 Ų1879.7 Ų79.78%0.07947%0.465CS..Hα-helixtrans-62.9-50.2176.7-180-107.2000111.7R72 L73 S76 A77 V78 S83 M84 Y105R72-F80 HydrophobicContact CB-CD2 4.35Å; L73-F80 HydrophobicContact CD2-CD1 3.42Å; L73-F80 VanDerWaalsContact CD2-CD1 3.42Å; L73-F80 HydrophobicContact CD2-CD2 4.5Å; L73-F80 HydrophobicContact CD2-CE1 3.48Å; L73-F80 VanDerWaalsContact CD2-CE1 3.48Å; L73-F80 HydrophobicContact CD2-CG 3.95Å; L73-F80 HydrophobicContact CD2-CZ 4.11Å; S76-F80 WeakPolarHBondContact O-CB 3.27Å; S76-F80 PolarHBondContact O-N 3.19Å; A77-F80 PolarHBondContact O-N 2.9Å; V78-F80 VanDerWaalsContact C-N 3.32Å; V78-F80 PolarHBondContact O-N 2.91Å; F80-S83 PolarHBondContact O-N 3.38Å; F80-S83 PolarHBondContact O-OG 3.18Å; F80-M84 HydrophobicContact CD1-CE 3.7Å; F80-M84 HydrophobicContact CE1-CE 3.06Å; F80-M84 HydrophobicContact CE2-CE 4.3Å; F80-M84 HydrophobicContact CZ-CE 3.42Å; F80-M84 VanDerWaalsContact CZ-CE 3.42Å; F80-M84 WeakPolarHBondContact O-CG 3.31Å; F80-M84 PolarHBondContact O-N 3.44Å; F80-Y105 HydrophobicContact CE2-CE1 4.02Å; F80-Y105 HydrophobicContact CE2-CE2 4.45Å; F80-Y105 AromaticContact CE2-CZ 3.92Å; F80-Y105 HydrophobicContact CZ-CD1 4.32Å; F80-Y105 HydrophobicContact CZ-CD2 4.45Å; F80-Y105 HydrophobicContact CZ-CE1 4.13Å; F80-Y105 HydrophobicContact CZ-CE2 4.27Å; F80-Y105 HydrophobicContact CZ-CG 4.49Å
81F79.5Confident81.3Confident121 Ų12184.3 Ų84.353%0.53148%0.484SS..Hα-helixtrans-69.1-35.5176.6-71.8-64.1000112.6A77 V78 S83 M84A77-F81 WeakPolarHBondContact O-CD2 3.22Å; A77-F81 PolarHBondContact O-N 2.76Å; V78-F81 PolarHBondContact O-N 3.49Å; F81-S83 VanDerWaalsContact C-N 3.33Å; F81-S83 PolarHBondContact O-N 2.9Å; F81-M84 HydrophobicContact CD1-CE 4.03Å; F81-M84 HydrophobicContact CD1-SD 4.18Å; F81-M84 HydrophobicContact CE1-CE 4.19Å; F81-M84 WeakPolarHBondContact O-CB 3.25Å; F81-M84 PolarHBondContact O-N 3.02Å
82G79.5Confident81.4Confident37 Ų3790.6 Ų90.638%0.38150%0.499SS..Hα-helixtrans-61.3-41.4172.900000112.1V78 E79 M84 I85V78-G82 PolarHBondContact O-N 3.35Å; E79-G82 PolarHBondContact O-N 2.85Å; G82-M84 PolarHBondContact O-N 3.44Å; G82-M84 VanDerWaalsContact O-N 3.17Å; G82-I85 PolarHBondContact O-N 2.88Å; G82-I85 VanDerWaalsContact O-N 3.1Å
83S80.1Confident81.8Confident77 Ų7787.6 Ų87.654%0.53849%0.492SS..THydrogen-bonded Turntrans-66.8-14.5177.876.40000114.4E79 F80 F81 I85E79-S83 VanDerWaalsContact O-CB 3.25Å; E79-S83 WeakPolarHBondContact O-CB 3.45Å; E79-S83 PolarHBondContact O-N 3.03Å; E79-S83 PolarHBondContact O-OG 3.46Å; F80-S83 PolarHBondContact O-N 3.38Å; F80-S83 PolarHBondContact O-OG 3.18Å; F81-S83 VanDerWaalsContact C-N 3.33Å; F81-S83 PolarHBondContact O-N 2.9Å; S83-I85 PolarHBondContact O-N 2.9Å
84M78.4Confident81.9Confident13 Ų1387.1 Ų87.16%0.06449%0.49CS..THydrogen-bonded Turntrans-74.6-16.3174.3-61.8-162.2-176.300112.8F80 F81 G82 E101 Y105F80-M84 HydrophobicContact CD1-CE 3.7Å; F80-M84 HydrophobicContact CE1-CE 3.06Å; F80-M84 HydrophobicContact CE2-CE 4.3Å; F80-M84 HydrophobicContact CZ-CE 3.42Å; F80-M84 VanDerWaalsContact CZ-CE 3.42Å; F80-M84 WeakPolarHBondContact O-CG 3.31Å; F80-M84 PolarHBondContact O-N 3.44Å; F81-M84 HydrophobicContact CD1-CE 4.03Å; F81-M84 HydrophobicContact CD1-SD 4.18Å; F81-M84 HydrophobicContact CE1-CE 4.19Å; F81-M84 WeakPolarHBondContact O-CB 3.25Å; F81-M84 PolarHBondContact O-N 3.02Å; G82-M84 PolarHBondContact O-N 3.44Å; G82-M84 VanDerWaalsContact O-N 3.17Å; M84-E101 HydrophobicContact CB-CB 4.14Å; M84-E101 HydrophobicContact CB-CG 3.8Å; M84-E101 HydrophobicContact CG-CG 3.94Å; M84-E101 HydrophobicContact SD-CB 4.43Å; M84-E101 HydrophobicContact SD-CG 4.23Å; M84-Y105 HydrophobicContact CE-CD2 3.69Å; M84-Y105 HydrophobicContact CE-CE2 3.74Å; M84-Y105 HydrophobicContact CG-CE2 4.01Å; M84-Y105 HydrophobicContact SD-CD2 4.2Å; M84-Y105 HydrophobicContact SD-CE2 4.2Å
85I82Confident82Confident61 Ų6184 Ų8431%0.31348%0.476SS..SBendtrans-99.9119.7-179-57.6170.6000107.5G82 S83 E87 L94G82-I85 PolarHBondContact O-N 2.88Å; G82-I85 VanDerWaalsContact O-N 3.1Å; S83-I85 PolarHBondContact O-N 2.9Å; I85-E87 PolarHBondContact O-N 3.36Å; I85-L94 HydrophobicContact CG2-CD2 3.52Å
86P77Confident82.5Confident69 Ų6985.8 Ų85.845%0.44848%0.477SS..PPolyproline II helixtrans-69.4127.3173.27.11.3000109.8G88 S89 I97P86-G88 PolarHBondContact O-N 3Å; P86-S89 VanDerWaalsContact CG-OG 3.31Å; P86-S89 WeakPolarHBondContact CG-OG 3.28Å; P86-S89 PolarHBondContact O-N 3.2Å; P86-S89 PolarHBondContact O-OG 3.3Å; P86-I97 HydrophobicContact CG-CG2 4.36Å
87E78.1Confident82.9Confident185 Ų18585.3 Ų85.386%0.86447%0.47SS*.THydrogen-bonded Turntrans-55.2129170.9-61.8-62.8166.800110I85I85-E87 PolarHBondContact O-N 3.36Å
88G78.6Confident83.2Confident81 Ų8186.6 Ų86.684%0.83547%0.467SS*.THydrogen-bonded Turntrans91.78.8-179.600000115.7P86P86-G88 PolarHBondContact O-N 3Å
89S82.4Confident83.5Confident26 Ų2687.2 Ų87.218%0.18246%0.457CS..  trans-72.9135.8172.7-59.70000111.5P86 M91P86-S89 VanDerWaalsContact CG-OG 3.31Å; P86-S89 WeakPolarHBondContact CG-OG 3.28Å; P86-S89 PolarHBondContact O-N 3.2Å; P86-S89 PolarHBondContact O-OG 3.3Å; S89-M91 PolarHBondContact O-N 3.25Å
90P87.1Confident84Confident62 Ų6285.6 Ų85.640%0.40346%0.456SS..  trans-62138.1178.722-29000110.9W92 I93P90-W92 HydrophobicContact CB-CD2 4Å; P90-W92 HydrophobicContact CB-CG 4.31Å; P90-W92 HydrophobicContact CB-CZ2 4.04Å; P90-W92 HydrophobicContact CG-CD2 4.48Å; P90-W92 HydrophobicContact CG-CZ2 4.05Å; P90-W92 PolarHBondContact O-N 3.09Å; P90-I93 HydrophobicContact CG-CG2 3.89Å; P90-I93 WeakPolarHBondContact O-CG2 3.45Å; P90-I93 PolarHBondContact O-N 3.31Å
91M84.4Confident84.5Confident166 Ų16687.1 Ų87.182%0.81846%0.463SS*.THydrogen-bonded Turntrans-55.6-26.3-172.6-72.4-178.4-8100114.1S89 I93 L94S89-M91 PolarHBondContact O-N 3.25Å; M91-I93 VanDerWaalsContact C-N 3.32Å; M91-I93 PolarHBondContact O-N 3.01Å; M91-L94 HydrophobicContact CB-CD1 4.28Å; M91-L94 HydrophobicContact CG-CD1 4.07Å
92W88.4Confident84.9Confident212 Ų21285.1 Ų85.180%0.80346%0.456SS*.THydrogen-bonded Turntrans-65.8-27.7179.863.655.2000114P90P90-W92 HydrophobicContact CB-CD2 4Å; P90-W92 HydrophobicContact CB-CG 4.31Å; P90-W92 HydrophobicContact CB-CZ2 4.04Å; P90-W92 HydrophobicContact CG-CD2 4.48Å; P90-W92 HydrophobicContact CG-CZ2 4.05Å; P90-W92 PolarHBondContact O-N 3.09Å
93I89.3Confident85.6Confident73 Ų7387.8 Ų87.837%0.37446%0.46SS..THydrogen-bonded Turntrans-105.1-15.2-173.7-164.8160.9000112.5P90 M91 P95 F96 I97P90-I93 HydrophobicContact CG-CG2 3.89Å; P90-I93 WeakPolarHBondContact O-CG2 3.45Å; P90-I93 PolarHBondContact O-N 3.31Å; M91-I93 VanDerWaalsContact C-N 3.32Å; M91-I93 PolarHBondContact O-N 3.01Å; I93-P95 VanDerWaalsContact C-N 3.34Å; I93-F96 PolarHBondContact O-N 3.47Å; I93-I97 HydrophobicContact CB-CD1 4.5Å; I93-I97 HydrophobicContact CG1-CD1 4.32Å; I93-I97 HydrophobicContact CG1-CG1 4.12Å; I93-I97 HydrophobicContact CG2-CD1 3.68Å; I93-I97 HydrophobicContact CG2-CG1 4.39Å; I93-I97 PolarHBondContact O-N 3.4Å
94L86.3Confident86.2Confident51 Ų5186.2 Ų86.227%0.26745%0.449SS..Hα-helixtrans-44-47.6178.7-69.8179.3000114.6I85 M91 F96 I97I85-L94 HydrophobicContact CG2-CD2 3.52Å; M91-L94 HydrophobicContact CB-CD1 4.28Å; M91-L94 HydrophobicContact CG-CD1 4.07Å; L94-F96 PolarHBondContact O-N 3.11Å; L94-I97 PolarHBondContact O-N 3.43Å
95P84.7Confident86.7Confident62 Ų6287.4 Ų87.440%0.40345%0.453SS..Hα-helixtrans-66.1-23.8-177.525.7-35.5000113.3I93 Q98 Y99I93-P95 VanDerWaalsContact C-N 3.34Å; P95-Q98 VanDerWaalsContact O-CG 3.24Å; P95-Q98 WeakPolarHBondContact O-CG 3.37Å; P95-Q98 PolarHBondContact O-NE2 3.11Å; P95-Y99 WeakPolarHBondContact O-CD2 3.26Å; P95-Y99 WeakPolarHBondContact O-CE2 3.47Å
96F89.3Confident87.1Confident139 Ų13989 Ų8961%0.6146%0.461SS*.Hα-helixtrans-84.9-34.8178.8-65-72.2000112.7I93 L94 Q98 Y99 V100I93-F96 PolarHBondContact O-N 3.47Å; L94-F96 PolarHBondContact O-N 3.11Å; F96-Q98 PolarHBondContact O-N 3.39Å; F96-Y99 PolarHBondContact O-N 3.17Å; F96-V100 PolarHBondContact O-N 2.87Å
97I90.8Very high87.9Confident36 Ų3690.3 Ų90.319%0.18546%0.463CS..Hα-helixtrans-60.7-44.2-176.1-67171.7000111.5P86 I93 L94 Y99 V100 E101P86-I97 HydrophobicContact CG-CG2 4.36Å; I93-I97 HydrophobicContact CB-CD1 4.5Å; I93-I97 HydrophobicContact CG1-CD1 4.32Å; I93-I97 HydrophobicContact CG1-CG1 4.12Å; I93-I97 HydrophobicContact CG2-CD1 3.68Å; I93-I97 HydrophobicContact CG2-CG1 4.39Å; I93-I97 PolarHBondContact O-N 3.4Å; L94-I97 PolarHBondContact O-N 3.43Å; I97-Y99 VanDerWaalsContact C-N 3.26Å; I97-Y99 PolarHBondContact O-N 3.03Å; I97-V100 PolarHBondContact O-N 3.29Å; I97-V100 VanDerWaalsContact O-N 3.12Å; I97-E101 PolarHBondContact O-N 3.13Å
98Q86.2Confident88.5Confident79 Ų7986.6 Ų86.637%0.36944%0.441SS..Hα-helixtrans-56.6-38.7179.359.8178.89.400112.8P95 F96 M102P95-Q98 VanDerWaalsContact O-CG 3.24Å; P95-Q98 WeakPolarHBondContact O-CG 3.37Å; P95-Q98 PolarHBondContact O-NE2 3.11Å; F96-Q98 PolarHBondContact O-N 3.39Å; Q98-M102 WeakPolarHBondContact O-CB 3.46Å; Q98-M102 PolarHBondContact O-N 3.38Å
99Y89.3Confident89.1Confident137 Ų13783.6 Ų83.654%0.53741%0.407SS..Hα-helixtrans-70.4-40.2178.9-65.4-64.8000111.2P95 F96 I97 M102 M103P95-Y99 WeakPolarHBondContact O-CD2 3.26Å; P95-Y99 WeakPolarHBondContact O-CE2 3.47Å; F96-Y99 PolarHBondContact O-N 3.17Å; I97-Y99 VanDerWaalsContact C-N 3.26Å; I97-Y99 PolarHBondContact O-N 3.03Å; Y99-M102 HydrophobicContact CD1-CE 4.39Å; Y99-M102 PolarHBondContact O-N 2.82Å; Y99-M103 WeakPolarHBondContact O-CG 3.45Å; Y99-M103 PolarHBondContact O-N 2.91Å
100V92.8Very high89.6Confident93 Ų9388.2 Ų88.256%0.56442%0.424SS*.Hα-helixtrans-65.7-41.3176.9175.70000111.1F96 I97 M103 S104F96-V100 PolarHBondContact O-N 2.87Å; I97-V100 PolarHBondContact O-N 3.29Å; I97-V100 VanDerWaalsContact O-N 3.12Å; V100-M103 PolarHBondContact O-N 3.06Å; V100-S104 WeakPolarHBondContact O-CB 3.38Å; V100-S104 PolarHBondContact O-N 3.28Å; V100-S104 PolarHBondContact O-OG 3.32Å
101E90.2Very high89.9Confident50 Ų5088.1 Ų88.123%0.23442%0.423CS..Hα-helixtrans-68.1-40.2178.2-169.758.5-151.300110.8M84 I97 M103 S104 Y105 R108M84-E101 HydrophobicContact CB-CB 4.14Å; M84-E101 HydrophobicContact CB-CG 3.8Å; M84-E101 HydrophobicContact CG-CG 3.94Å; M84-E101 HydrophobicContact SD-CB 4.43Å; M84-E101 HydrophobicContact SD-CG 4.23Å; I97-E101 PolarHBondContact O-N 3.13Å; E101-M103 PolarHBondContact O-N 2.94Å; E101-S104 CarbonylContact O-C 3.36Å; E101-S104 WeakPolarHBondContact O-CA 3.17Å; E101-S104 WeakPolarHBondContact O-CB 3.05Å; E101-S104 PolarHBondContact O-N 2.85Å; E101-S104 VanDerWaalsContact O-N 3.1Å; E101-Y105 HydrophobicContact CG-CD2 3.94Å; E101-Y105 HydrophobicContact CG-CE2 3.71Å; E101-Y105 VanDerWaalsContact O-CD2 3.26Å; E101-Y105 WeakPolarHBondContact O-CD2 3.43Å; E101-Y105 PolarHBondContact O-N 3.1Å; E101-Y105 WeakPolarHBondContact OE1-CE2 3.31Å; E101-R108 IonicContact OE1-NH2 3.56Å
102M88.8Confident90.2Very high79 Ų7982.9 Ų82.939%0.38940%0.4SS..Hα-helixtrans-59.3-44.6173.1-174.717671.700112Q98 Y99 S104 Y105 I106Q98-M102 WeakPolarHBondContact O-CB 3.46Å; Q98-M102 PolarHBondContact O-N 3.38Å; Y99-M102 HydrophobicContact CD1-CE 4.39Å; Y99-M102 PolarHBondContact O-N 2.82Å; M102-S104 VanDerWaalsContact C-N 3.31Å; M102-S104 PolarHBondContact O-N 3.07Å; M102-Y105 PolarHBondContact O-N 3.37Å; M102-I106 WeakPolarHBondContact O-CG1 3.4Å; M102-I106 PolarHBondContact O-N 3.41Å
103M93.4Very high90.3Very high92 Ų9273 Ų7345%0.45336%0.363SS..Hα-helixtrans-62.1-40.1173.7-69.1-58.2112.200111.8Y99 V100 E101 Y105 I106 I107Y99-M103 WeakPolarHBondContact O-CG 3.45Å; Y99-M103 PolarHBondContact O-N 2.91Å; V100-M103 PolarHBondContact O-N 3.06Å; E101-M103 PolarHBondContact O-N 2.94Å; M103-Y105 VanDerWaalsContact C-N 3.32Å; M103-Y105 PolarHBondContact O-N 2.98Å; M103-I106 HydrophobicContact CE-CD1 3.89Å; M103-I106 PolarHBondContact O-N 3.2Å; M103-I106 HydrophobicContact SD-CD1 4.42Å; M103-I107 WeakPolarHBondContact O-CG1 3.12Å; M103-I107 PolarHBondContact O-N 3.35Å
104S92.4Very high90.4Very high45 Ų4573.5 Ų73.532%0.31537%0.366SS..Hα-helixtrans-63.6-37.7177-61.90000112V100 E101 M102 I106 I107 R108V100-S104 WeakPolarHBondContact O-CB 3.38Å; V100-S104 PolarHBondContact O-N 3.28Å; V100-S104 PolarHBondContact O-OG 3.32Å; E101-S104 CarbonylContact O-C 3.36Å; E101-S104 WeakPolarHBondContact O-CA 3.17Å; E101-S104 WeakPolarHBondContact O-CB 3.05Å; E101-S104 PolarHBondContact O-N 2.85Å; E101-S104 VanDerWaalsContact O-N 3.1Å; M102-S104 VanDerWaalsContact C-N 3.31Å; M102-S104 PolarHBondContact O-N 3.07Å; S104-I106 VanDerWaalsContact C-N 3.35Å; S104-I107 PolarHBondContact O-N 3.35Å; S104-R108 WeakPolarHBondContact O-CB 3.1Å; S104-R108 PolarHBondContact O-N 3.27Å
105Y89.5Confident90.7Very high38 Ų3878.2 Ų78.215%0.14938%0.38CS..Hα-helixtrans-62.6-38.7172.9-88.4-71000112.7F80 M84 E101 M102 M103 P109F80-Y105 HydrophobicContact CE2-CE1 4.02Å; F80-Y105 HydrophobicContact CE2-CE2 4.45Å; F80-Y105 AromaticContact CE2-CZ 3.92Å; F80-Y105 HydrophobicContact CZ-CD1 4.32Å; F80-Y105 HydrophobicContact CZ-CD2 4.45Å; F80-Y105 HydrophobicContact CZ-CE1 4.13Å; F80-Y105 HydrophobicContact CZ-CE2 4.27Å; F80-Y105 HydrophobicContact CZ-CG 4.49Å; M84-Y105 HydrophobicContact CE-CD2 3.69Å; M84-Y105 HydrophobicContact CE-CE2 3.74Å; M84-Y105 HydrophobicContact CG-CE2 4.01Å; M84-Y105 HydrophobicContact SD-CD2 4.2Å; M84-Y105 HydrophobicContact SD-CE2 4.2Å; E101-Y105 HydrophobicContact CG-CD2 3.94Å; E101-Y105 HydrophobicContact CG-CE2 3.71Å; E101-Y105 VanDerWaalsContact O-CD2 3.26Å; E101-Y105 WeakPolarHBondContact O-CD2 3.43Å; E101-Y105 PolarHBondContact O-N 3.1Å; E101-Y105 WeakPolarHBondContact OE1-CE2 3.31Å; M102-Y105 PolarHBondContact O-N 3.37Å; M103-Y105 VanDerWaalsContact C-N 3.32Å; M103-Y105 PolarHBondContact O-N 2.98Å; Y105-P109 VanDerWaalsContact O-CD 3.3Å; Y105-P109 WeakPolarHBondContact O-CD 3.21Å
106I90.7Very high90.8Very high95 Ų9576.4 Ų76.449%0.48737%0.368SS..Hα-helixtrans-69-38.2176.9-65.1167.2000111.6M102 M103 S104 P109 F110M102-I106 WeakPolarHBondContact O-CG1 3.4Å; M102-I106 PolarHBondContact O-N 3.41Å; M103-I106 HydrophobicContact CE-CD1 3.89Å; M103-I106 PolarHBondContact O-N 3.2Å; M103-I106 HydrophobicContact SD-CD1 4.42Å; S104-I106 VanDerWaalsContact C-N 3.35Å; I106-P109 VanDerWaalsContact O-CD 3.22Å; I106-P109 WeakPolarHBondContact O-CD 3.38Å; I106-P109 VanDerWaalsContact O-CG 3.28Å; I106-P109 WeakPolarHBondContact O-CG 3.28Å; I106-F110 VanDerWaalsContact O-CD2 3.25Å; I106-F110 WeakPolarHBondContact O-CD2 3.2Å; I106-F110 VanDerWaalsContact O-CE2 3.31Å; I106-F110 WeakPolarHBondContact O-CE2 3.16Å
107I93.7Very high90.9Very high96 Ų9672 Ų7249%0.49235%0.349SS..Hα-helixtrans-76-30.3-177.9-66.9163.7000112M103 S104 F110 V111M103-I107 WeakPolarHBondContact O-CG1 3.12Å; M103-I107 PolarHBondContact O-N 3.35Å; S104-I107 PolarHBondContact O-N 3.35Å; I107-F110 WeakPolarHBondContact O-CB 3.46Å; I107-F110 PolarHBondContact O-N 2.88Å; I107-F110 VanDerWaalsContact O-N 3.11Å; I107-V111 HydrophobicContact CG2-CG2 3.67Å; I107-V111 PolarHBondContact O-N 2.88Å; I107-V111 VanDerWaalsContact O-N 3.11Å
108R91.4Very high90.9Very high106 Ų10673.6 Ų73.640%0.436%0.36SS..Hα-helixtrans-50.5-45.7-177.5-160.9179.3-61.6-102.85.2116.3F65 E101 S104 F110 V111 T112F65-R108 HydrophobicContact CE2-CB 4.02Å; F65-R108 HydrophobicContact CE2-CG 3.59Å; F65-R108 HydrophobicContact CZ-CB 3.74Å; F65-R108 HydrophobicContact CZ-CG 3.81Å; E101-R108 IonicContact OE1-NH2 3.56Å; S104-R108 WeakPolarHBondContact O-CB 3.1Å; S104-R108 PolarHBondContact O-N 3.27Å; R108-F110 VanDerWaalsContact C-N 3.32Å; R108-F110 PolarHBondContact O-N 3.45Å; R108-V111 PolarHBondContact O-N 2.93Å; R108-T112 PolarHBondContact O-N 3.44Å; R108-T112 VanDerWaalsContact O-N 3.09Å; R108-T112 PolarHBondContact O-OG1 3.13Å
109P90.7Very high91Very high18 Ų1876.5 Ų76.512%0.11737%0.371CS..Hα-helixtrans-59.9-41.9176.618.6-29.8000112.2L62 F65 Y105 I106 T112 V113L62-P109 HydrophobicContact CD2-CB 3.84Å; F65-P109 HydrophobicContact CD1-CB 3.55Å; F65-P109 HydrophobicContact CD1-CG 4.06Å; F65-P109 HydrophobicContact CE1-CB 3.87Å; F65-P109 VanDerWaalsContact CE1-CD 3.49Å; F65-P109 HydrophobicContact CE1-CG 3.89Å; F65-P109 HydrophobicContact CG-CB 4Å; Y105-P109 VanDerWaalsContact O-CD 3.3Å; Y105-P109 WeakPolarHBondContact O-CD 3.21Å; I106-P109 VanDerWaalsContact O-CD 3.22Å; I106-P109 WeakPolarHBondContact O-CD 3.38Å; I106-P109 VanDerWaalsContact O-CG 3.28Å; I106-P109 WeakPolarHBondContact O-CG 3.28Å; P109-T112 PolarHBondContact O-N 3.4Å; P109-V113 PolarHBondContact O-N 3.23Å
110F92.2Very high91Very high124 Ų12470 Ų7054%0.54435%0.346SS..Hα-helixtrans-65.2-45.3179.7-59-78.8000111.4I106 I107 R108 T112 V113 I114I106-F110 VanDerWaalsContact O-CD2 3.25Å; I106-F110 WeakPolarHBondContact O-CD2 3.2Å; I106-F110 VanDerWaalsContact O-CE2 3.31Å; I106-F110 WeakPolarHBondContact O-CE2 3.16Å; I107-F110 WeakPolarHBondContact O-CB 3.46Å; I107-F110 PolarHBondContact O-N 2.88Å; I107-F110 VanDerWaalsContact O-N 3.11Å; R108-F110 VanDerWaalsContact C-N 3.32Å; R108-F110 PolarHBondContact O-N 3.45Å; F110-T112 VanDerWaalsContact C-N 3.25Å; F110-T112 PolarHBondContact O-N 2.91Å; F110-V113 PolarHBondContact O-N 3Å; F110-I114 HydrophobicContact CB-CD1 4.42Å; F110-I114 WeakPolarHBondContact O-CB 3.41Å; F110-I114 WeakPolarHBondContact O-CD1 3.45Å; F110-I114 VanDerWaalsContact O-CG1 3.22Å; F110-I114 WeakPolarHBondContact O-CG1 3.44Å; F110-I114 PolarHBondContact O-N 3.4Å
111V93.2Very high90.7Very high60 Ų6065.6 Ų65.636%0.36432%0.32SS..Hα-helixtrans-61.2-36.5177.9175.80000111.6I107 R108 I114 R115I107-V111 HydrophobicContact CG2-CG2 3.67Å; I107-V111 PolarHBondContact O-N 2.88Å; I107-V111 VanDerWaalsContact O-N 3.11Å; R108-V111 PolarHBondContact O-N 2.93Å; V111-I114 PolarHBondContact O-N 2.91Å; V111-R115 WeakPolarHBondContact O-CB 3.48Å; V111-R115 PolarHBondContact O-N 3.25Å
112T90.1Very high90.7Very high56 Ų5666.2 Ų66.234%0.34433%0.326SS..Hα-helixtrans-66.4-36.4179.3-52.90000112V61 R108 P109 F110 P116V61-T112 HydrophobicContact CG1-CG2 3.61Å; R108-T112 PolarHBondContact O-N 3.44Å; R108-T112 VanDerWaalsContact O-N 3.09Å; R108-T112 PolarHBondContact O-OG1 3.13Å; P109-T112 PolarHBondContact O-N 3.4Å; F110-T112 VanDerWaalsContact C-N 3.25Å; F110-T112 PolarHBondContact O-N 2.91Å; T112-P116 WeakPolarHBondContact O-CD 3.49Å
113V91.6Very high90.7Very high5 Ų564.6 Ų64.63%0.0333%0.33CS..Hα-helixtrans-74.6-43.8174.4174.50000111.8F54 L57 V58 V61 L62 P109 F110 R115 P116 F117F54-V113 HydrophobicContact CD2-CG1 4.35Å; F54-V113 HydrophobicContact CE2-CG1 3.88Å; L57-V113 HydrophobicContact CB-CG1 4.05Å; V58-V113 HydrophobicContact CG2-CG1 3.9Å; V61-V113 HydrophobicContact CB-CG2 4.14Å; V61-V113 HydrophobicContact CG1-CG2 4.15Å; L62-V113 HydrophobicContact CD2-CG2 3.84Å; L62-V113 HydrophobicContact CG-CG2 4.06Å; P109-V113 PolarHBondContact O-N 3.23Å; F110-V113 PolarHBondContact O-N 3Å; V113-R115 VanDerWaalsContact C-N 3.32Å; V113-R115 PolarHBondContact O-N 2.92Å; V113-P116 VanDerWaalsContact O-CD 3.27Å; V113-P116 WeakPolarHBondContact O-CD 3.22Å; V113-P116 WeakPolarHBondContact O-CG 3.43Å; V113-F117 WeakPolarHBondContact O-CB 3.43Å; V113-F117 PolarHBondContact O-N 3.24Å
114I91.9Very high90.2Very high83 Ų8362.8 Ų62.843%0.42632%0.322SS..Hα-helixtrans-65.3-35.5-177-69.7166.5000111.3F110 V111 F117 V118F110-I114 HydrophobicContact CB-CD1 4.42Å; F110-I114 WeakPolarHBondContact O-CB 3.41Å; F110-I114 WeakPolarHBondContact O-CD1 3.45Å; F110-I114 VanDerWaalsContact O-CG1 3.22Å; F110-I114 WeakPolarHBondContact O-CG1 3.44Å; F110-I114 PolarHBondContact O-N 3.4Å; V111-I114 PolarHBondContact O-N 2.91Å; I114-F117 WeakPolarHBondContact O-CB 3.41Å; I114-F117 PolarHBondContact O-N 3.44Å; I114-V118 HydrophobicContact CG2-CG2 3.71Å; I114-V118 WeakPolarHBondContact O-CG2 3.18Å; I114-V118 PolarHBondContact O-N 3.39Å
115R90.8Very high89.9Confident149 Ų14965.8 Ų65.856%0.56233%0.326SS*.Hα-helixtrans-56.4-56.3-176.9-176.6-173.9-56.9-84.40.5114V111 V113 F117 K119V111-R115 WeakPolarHBondContact O-CB 3.48Å; V111-R115 PolarHBondContact O-N 3.25Å; V113-R115 VanDerWaalsContact C-N 3.32Å; V113-R115 PolarHBondContact O-N 2.92Å; R115-F117 VanDerWaalsContact C-N 3.35Å; R115-K119 VanDerWaalsContact O-CG 3.28Å; R115-K119 WeakPolarHBondContact O-CG 3.18Å; R115-K119 PolarHBondContact O-N 3.45Å
116P88.4Confident89.9Confident25 Ų2568.7 Ų68.716%0.16234%0.344CS..Hα-helixtrans-68-34.4175.125.9-33.2000112.3L39 L57 T112 V113 K119 V120L39-P116 HydrophobicContact CD2-CB 3.99Å; L57-P116 HydrophobicContact CD1-CB 4.31Å; L57-P116 HydrophobicContact CD1-CG 3.93Å; L57-P116 HydrophobicContact CD2-CB 4.29Å; L57-P116 HydrophobicContact CD2-CG 3.88Å; T112-P116 WeakPolarHBondContact O-CD 3.49Å; V113-P116 VanDerWaalsContact O-CD 3.27Å; V113-P116 WeakPolarHBondContact O-CD 3.22Å; V113-P116 WeakPolarHBondContact O-CG 3.43Å; P116-K119 PolarHBondContact O-N 3.09Å; P116-V120 WeakPolarHBondContact O-CG2 3.38Å; P116-V120 PolarHBondContact O-N 3.25Å
117F89.7Confident89.6Confident45 Ų4565.5 Ų65.520%0.19733%0.334CS..Hα-helixtrans-54.6-59.5176.5179.6-104.5000111.5F53 F54 L57 V113 I114 R115 K119 V120 S121F53-F117 AromaticContact CD1-CD2 3.95Å; F53-F117 HydrophobicContact CD1-CD2 3.95Å; F53-F117 HydrophobicContact CE1-CD2 4.41Å; F54-F117 HydrophobicContact CB-CD2 4.07Å; F54-F117 HydrophobicContact CB-CE2 3.89Å; F54-F117 AromaticContact CD2-CD2 3.9Å; F54-F117 HydrophobicContact CD2-CD2 3.9Å; F54-F117 HydrophobicContact CD2-CE2 4.16Å; F54-F117 HydrophobicContact CD2-CG 4.14Å; F54-F117 HydrophobicContact CG-CD2 4.48Å; F54-F117 HydrophobicContact CG-CE2 4.43Å; L57-F117 HydrophobicContact CD1-CB 3.9Å; V113-F117 WeakPolarHBondContact O-CB 3.43Å; V113-F117 PolarHBondContact O-N 3.24Å; I114-F117 WeakPolarHBondContact O-CB 3.41Å; I114-F117 PolarHBondContact O-N 3.44Å; R115-F117 VanDerWaalsContact C-N 3.35Å; F117-K119 VanDerWaalsContact C-N 3.35Å; F117-K119 PolarHBondContact O-N 3.38Å; F117-V120 PolarHBondContact O-N 2.83Å; F117-S121 WeakPolarHBondContact O-CB 3.3Å; F117-S121 PolarHBondContact O-N 2.96Å; F117-S121 PolarHBondContact O-OG 2.91Å
118V91.2Very high89.2Confident71 Ų7166.1 Ų66.143%0.4334%0.342SS..Hα-helixtrans-59.6-44.6-179.4174.30000111.2I114 V120 S121 V122I114-V118 HydrophobicContact CG2-CG2 3.71Å; I114-V118 WeakPolarHBondContact O-CG2 3.18Å; I114-V118 PolarHBondContact O-N 3.39Å; V118-V120 VanDerWaalsContact C-N 3.34Å; V118-V120 PolarHBondContact O-N 3.4Å; V118-S121 PolarHBondContact O-N 2.95Å; V118-V122 HydrophobicContact CG1-CG2 3.78Å; V118-V122 WeakPolarHBondContact O-CB 3.41Å; V118-V122 WeakPolarHBondContact O-CG2 3.29Å; V118-V122 PolarHBondContact O-N 3.31Å
119K89.7Confident89.1Confident139 Ų13965.2 Ų65.260%0.60435%0.352SS*.Hα-helixtrans-58.6-42.7-179.3-75179.3178.3-1680112.8R115 P116 F117 G123R115-K119 VanDerWaalsContact O-CG 3.28Å; R115-K119 WeakPolarHBondContact O-CG 3.18Å; R115-K119 PolarHBondContact O-N 3.45Å; P116-K119 PolarHBondContact O-N 3.09Å; F117-K119 VanDerWaalsContact C-N 3.35Å; F117-K119 PolarHBondContact O-N 3.38Å; K119-G123 PolarHBondContact O-N 3.01Å
120V87.6Confident89Confident2 Ų269 Ų691%0.01238%0.375CS..Hα-helixtrans-75.8-49179.21760000110.9Y48 F53 P116 F117 V118 V122 G123 I124Y48-V120 HydrophobicContact CD2-CG1 4.15Å; Y48-V120 HydrophobicContact CE2-CG1 3.74Å; F53-V120 HydrophobicContact CE1-CB 3.78Å; F53-V120 HydrophobicContact CE1-CG1 4.11Å; F53-V120 HydrophobicContact CE1-CG2 3.97Å; F53-V120 HydrophobicContact CZ-CB 4.11Å; F53-V120 HydrophobicContact CZ-CG1 4.38Å; F53-V120 HydrophobicContact CZ-CG2 3.8Å; P116-V120 WeakPolarHBondContact O-CG2 3.38Å; P116-V120 PolarHBondContact O-N 3.25Å; F117-V120 PolarHBondContact O-N 2.83Å; V118-V120 VanDerWaalsContact C-N 3.34Å; V118-V120 PolarHBondContact O-N 3.4Å; V120-V122 VanDerWaalsContact C-N 3.35Å; V120-V122 PolarHBondContact O-N 3.32Å; V120-G123 PolarHBondContact O-N 2.97Å; V120-I124 HydrophobicContact CG1-CD1 3.69Å; V120-I124 WeakPolarHBondContact O-CG1 3.4Å; V120-I124 PolarHBondContact O-N 3.38Å
121S87.6Confident88.4Confident0 Ų066.4 Ų66.40%038%0.382CS..Hα-helixtrans-62.4-41.1-177.3-53.30000112.9Y48 F117 V118 R125Y48-S121 WeakPolarHBondContact OH-CB 3.43Å; Y48-S121 PolarHBondContact OH-OG 2.62Å; F117-S121 WeakPolarHBondContact O-CB 3.3Å; F117-S121 PolarHBondContact O-N 2.96Å; F117-S121 PolarHBondContact O-OG 2.91Å; V118-S121 PolarHBondContact O-N 2.95Å; S121-R125 WeakPolarHBondContact O-CB 3.46Å; S121-R125 PolarHBondContact O-N 3.38Å; S121-R125 VanDerWaalsContact O-N 3.09Å; S121-R125 PolarHBondContact O-NE 3.46Å
122V89.5Confident86.6Confident62 Ų6276.4 Ų76.438%0.37641%0.414SS..Hα-helixtrans-68.7-44.2177.5172.30000109.5V118 V120 I124 R125 L126V118-V122 HydrophobicContact CG1-CG2 3.78Å; V118-V122 WeakPolarHBondContact O-CB 3.41Å; V118-V122 WeakPolarHBondContact O-CG2 3.29Å; V118-V122 PolarHBondContact O-N 3.31Å; V120-V122 VanDerWaalsContact C-N 3.35Å; V120-V122 PolarHBondContact O-N 3.32Å; V122-I124 PolarHBondContact O-N 3.19Å; V122-R125 PolarHBondContact O-N 3.46Å; V122-L126 HydrophobicContact CG1-CD1 3.4Å; V122-L126 HydrophobicContact CG1-CG 3.88Å; V122-L126 WeakPolarHBondContact O-CB 3.41Å; V122-L126 WeakPolarHBondContact O-CG 3.36Å; V122-L126 PolarHBondContact O-N 3.39Å
123G88.2Confident86.4Confident45 Ų4577.4 Ų77.446%0.46442%0.417SS..Hα-helixtrans-56.5-46.217700000113.3K119 V120 G127K119-G123 PolarHBondContact O-N 3.01Å; V120-G123 PolarHBondContact O-N 2.97Å; G123-G127 PolarHBondContact O-N 3.33Å
124I84.5Confident86.1Confident55 Ų5581.2 Ų81.228%0.28244%0.438SS..Hα-helixtrans-70.3-47.1-178.9-65.1168.6000111.4Y48 V120 V122 L126 G127 V128Y48-I124 HydrophobicContact CD1-CB 4.36Å; Y48-I124 HydrophobicContact CD1-CD1 3.34Å; Y48-I124 HydrophobicContact CD1-CG1 4.43Å; Y48-I124 HydrophobicContact CD1-CG2 4.1Å; Y48-I124 HydrophobicContact CD2-CD1 3.71Å; Y48-I124 HydrophobicContact CE1-CD1 3.77Å; Y48-I124 HydrophobicContact CE2-CD1 4.18Å; Y48-I124 HydrophobicContact CG-CD1 3.3Å; V120-I124 HydrophobicContact CG1-CD1 3.69Å; V120-I124 WeakPolarHBondContact O-CG1 3.4Å; V120-I124 PolarHBondContact O-N 3.38Å; V122-I124 PolarHBondContact O-N 3.19Å; I124-L126 VanDerWaalsContact C-N 3.33Å; I124-L126 PolarHBondContact O-N 3.11Å; I124-G127 PolarHBondContact O-N 3.28Å; I124-V128 WeakPolarHBondContact O-CG2 3.29Å; I124-V128 PolarHBondContact O-N 2.97Å
125R85.3Confident85.8Confident108 Ų10881.1 Ų81.141%0.40844%0.438SS..Hα-helixtrans-65.5-37.7179.1-79.2-173-83.7-144.17.3112.4W50 S121 V122 S129W50-R125 VanDerWaalsContact CZ2-CD 3.49Å; W50-R125 HydrophobicContact CZ2-CG 3.95Å; S121-R125 WeakPolarHBondContact O-CB 3.46Å; S121-R125 PolarHBondContact O-N 3.38Å; S121-R125 VanDerWaalsContact O-N 3.09Å; S121-R125 PolarHBondContact O-NE 3.46Å; V122-R125 PolarHBondContact O-N 3.46Å; R125-S129 WeakPolarHBondContact O-CB 3.38Å; R125-S129 PolarHBondContact O-N 3.11Å; R125-S129 PolarHBondContact O-OG 3.47Å
126L89.1Confident85.5Confident99 Ų9977.1 Ų77.152%0.51843%0.431SS..Hα-helixtrans-66.4-44.5174.4-71.5-179.9000111V122 I124 V128 S129 V130V122-L126 HydrophobicContact CG1-CD1 3.4Å; V122-L126 HydrophobicContact CG1-CG 3.88Å; V122-L126 WeakPolarHBondContact O-CB 3.41Å; V122-L126 WeakPolarHBondContact O-CG 3.36Å; V122-L126 PolarHBondContact O-N 3.39Å; I124-L126 VanDerWaalsContact C-N 3.33Å; I124-L126 PolarHBondContact O-N 3.11Å; L126-V128 PolarHBondContact O-N 2.92Å; L126-S129 WeakPolarHBondContact CA-OG 3.41Å; L126-S129 PolarHBondContact O-N 3.26Å; L126-S129 PolarHBondContact O-OG 3.06Å; L126-V130 VanDerWaalsContact O-CG2 3.29Å; L126-V130 WeakPolarHBondContact O-CG2 3.37Å; L126-V130 PolarHBondContact O-N 3.42Å
127G85.8Confident85.3Confident28 Ų2880.4 Ų80.429%0.28945%0.448SS..Hα-helixtrans-53.8-52.1175.600000112.3G123 I124 S129 V130 G131 W132G123-G127 PolarHBondContact O-N 3.33Å; I124-G127 PolarHBondContact O-N 3.28Å; G127-S129 VanDerWaalsContact C-N 3.28Å; G127-S129 PolarHBondContact O-N 2.7Å; G127-V130 PolarHBondContact O-N 3.27Å; G127-V130 VanDerWaalsContact O-N 3.11Å; G127-G131 PolarHBondContact O-N 3.01Å; G127-W132 CarbonylContact C-O 3.57Å; G127-W132 PolarHBondContact O-N 3.47Å; G127-W132 VanDerWaalsContact O-O 3.12Å
128V85.2Confident85Confident109 Ų10982.7 Ų82.766%0.66147%0.465SS*.Hα-helixtrans-58.4-38.7176174.60000111.9I124 L126 G131I124-V128 WeakPolarHBondContact O-CG2 3.29Å; I124-V128 PolarHBondContact O-N 2.97Å; L126-V128 PolarHBondContact O-N 2.92Å; V128-G131 PolarHBondContact O-N 3.05Å
129S87.9Confident84.6Confident86 Ų8683.6 Ų83.660%0.60147%0.467SS*.Hα-helixtrans-71.7-27.9179.474.10000114.2R125 L126 G127 G131R125-S129 WeakPolarHBondContact O-CB 3.38Å; R125-S129 PolarHBondContact O-N 3.11Å; R125-S129 PolarHBondContact O-OG 3.47Å; L126-S129 WeakPolarHBondContact CA-OG 3.41Å; L126-S129 PolarHBondContact O-N 3.26Å; L126-S129 PolarHBondContact O-OG 3.06Å; G127-S129 VanDerWaalsContact C-N 3.28Å; G127-S129 PolarHBondContact O-N 2.7Å; S129-G131 VanDerWaalsContact C-N 3.25Å
130V89.8Confident84.2Confident99 Ų9979.3 Ų79.360%0.646%0.456SS*.Hα-helixtrans-84.8-4177.9-172.90000110.8L126 G127L126-V130 VanDerWaalsContact O-CG2 3.29Å; L126-V130 WeakPolarHBondContact O-CG2 3.37Å; L126-V130 PolarHBondContact O-N 3.42Å; G127-V130 PolarHBondContact O-N 3.27Å; G127-V130 VanDerWaalsContact O-N 3.11Å
131G78.9Confident83.9Confident68 Ų6885.8 Ų85.870%0.70149%0.494SS*.THydrogen-bonded Turntrans7825.6178.500000113.9G127 V128 S129G127-G131 PolarHBondContact O-N 3.01Å; V128-G131 PolarHBondContact O-N 3.05Å; S129-G131 VanDerWaalsContact C-N 3.25Å
132W54.9Low83.6Confident270 Ų27093.5 Ų93.5100%1.02354%0.538SS*.  trans-113.90173.4-63.387.2000111.8G127G127-W132 CarbonylContact C-O 3.57Å; G127-W132 PolarHBondContact O-N 3.47Å; G127-W132 VanDerWaalsContact O-O 3.12Å

Retrieved 132 of 132 residues in 226.9 ms (Link to these results)

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