A0A087YIB6_POEFO Loading...

Epithelial membrane protein 2

AlphaFold DB , UniProt , Accession A0A087YIB6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 176 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
1S65.8Low73Confident140 Ų140104.9 Ų104.998%0.97956%0.56SS**  0-31.8055.50000115.7
2A66.2Low73.8Confident78 Ų78103.1 Ų103.165%0.64555%0.547SS*.Hα-helixtrans-90.9-40.917000000113.6E4 S5 Q6A2-E4 VanDerWaalsContact C-N 3.32Å; A2-E4 PolarHBondContact O-N 2.74Å; A2-S5 PolarHBondContact O-N 3.03Å; A2-Q6 PolarHBondContact O-N 3.4Å
3L68.1Low74.7Confident128 Ų128102.8 Ų102.867%0.6755%0.545SS*.Hα-helixtrans-62.8-37.9178.2-164.777.2000112.4Q6 T7L3-Q6 PolarHBondContact O-N 3.37Å; L3-T7 WeakPolarHBondContact O-CB 3.41Å; L3-T7 PolarHBondContact O-N 3.44Å; L3-T7 PolarHBondContact O-OG1 3.3Å
4E67.7Low75.6Confident129 Ų129102.3 Ų102.360%0.60354%0.541SS*.Hα-helixtrans-68.1-41.3176.9-167.3173.5-178.100111.8A2 T7 N8A2-E4 VanDerWaalsContact C-N 3.32Å; A2-E4 PolarHBondContact O-N 2.74Å; E4-T7 PolarHBondContact O-N 3.46Å; E4-N8 WeakPolarHBondContact O-CB 3.41Å; E4-N8 PolarHBondContact O-N 2.89Å; E4-N8 PolarHBondContact O-ND2 3Å
5S68.7Low76.4Confident65 Ų6597.1 Ų97.146%0.45551%0.513SS..Hα-helixtrans-64.2-41.2173.2177.70000112.5A2 R9A2-S5 PolarHBondContact O-N 3.03Å; S5-R9 WeakPolarHBondContact O-CB 3.37Å; S5-R9 PolarHBondContact O-N 3.22Å
6Q72.8Confident77.1Confident92 Ų9293.6 Ų93.643%0.4350%0.495SS..Hα-helixtrans-67.4-39.4175.9-164.6-172.910.300112.1A2 L3 R9 R10A2-Q6 PolarHBondContact O-N 3.4Å; L3-Q6 PolarHBondContact O-N 3.37Å; Q6-R9 PolarHBondContact O-N 2.91Å; Q6-R10 WeakPolarHBondContact O-CG 3.33Å; Q6-R10 PolarHBondContact O-N 3.07Å
7T75Confident77.8Confident72 Ų7291.5 Ų91.544%0.44249%0.494SS..Hα-helixtrans-65.1-45.8176.3-58.90000110.9L3 E4 R9 R10 V11L3-T7 WeakPolarHBondContact O-CB 3.41Å; L3-T7 PolarHBondContact O-N 3.44Å; L3-T7 PolarHBondContact O-OG1 3.3Å; E4-T7 PolarHBondContact O-N 3.46Å; T7-R9 VanDerWaalsContact C-N 3.32Å; T7-R9 PolarHBondContact O-N 2.97Å; T7-R10 PolarHBondContact O-N 3.3Å; T7-V11 WeakPolarHBondContact O-CG2 3.35Å; T7-V11 PolarHBondContact O-N 3.43Å
8N75.6Confident78.6Confident90 Ų9092 Ų9248%0.48149%0.491SS..Hα-helixtrans-62-39.6176.8-70.7-17.1000112.1E4 V11 M12E4-N8 WeakPolarHBondContact O-CB 3.41Å; E4-N8 PolarHBondContact O-N 2.89Å; E4-N8 PolarHBondContact O-ND2 3Å; N8-V11 PolarHBondContact O-N 3.43Å; N8-M12 WeakPolarHBondContact O-CB 3.33Å; N8-M12 PolarHBondContact O-N 3Å
9R78Confident79.2Confident161 Ų16187.2 Ų87.261%0.60847%0.465SS*.Hα-helixtrans-62.3-44.3174.5-173.7-176.1-64.5-112.70.4112.4S5 Q6 T7 M12 L13S5-R9 WeakPolarHBondContact O-CB 3.37Å; S5-R9 PolarHBondContact O-N 3.22Å; Q6-R9 PolarHBondContact O-N 2.91Å; T7-R9 VanDerWaalsContact C-N 3.32Å; T7-R9 PolarHBondContact O-N 2.97Å; R9-M12 PolarHBondContact O-N 3Å; R9-L13 WeakPolarHBondContact O-CG 3.37Å; R9-L13 PolarHBondContact O-N 3.31Å
10R82.4Confident79.8Confident157 Ų15786 Ų8659%0.59246%0.458SS*.Hα-helixtrans-62.6-45.5177.6-72.7177.6-174.7-1683.5111.5Q6 T7 M12 L13 I14Q6-R10 WeakPolarHBondContact O-CG 3.33Å; Q6-R10 PolarHBondContact O-N 3.07Å; T7-R10 PolarHBondContact O-N 3.3Å; R10-M12 VanDerWaalsContact C-N 3.32Å; R10-M12 PolarHBondContact O-N 3.48Å; R10-L13 PolarHBondContact O-N 3.44Å; R10-I14 WeakPolarHBondContact O-CG1 3.46Å; R10-I14 PolarHBondContact O-N 3.27Å; R10-I14 VanDerWaalsContact O-N 3.12Å
11V82.9Confident80.5Confident42 Ų4286.8 Ų86.826%0.25546%0.462SS..Hα-helixtrans-63.1-39.6178.9176.40000111.6T7 N8 L13 I14 I15T7-V11 WeakPolarHBondContact O-CG2 3.35Å; T7-V11 PolarHBondContact O-N 3.43Å; N8-V11 PolarHBondContact O-N 3.43Å; V11-L13 PolarHBondContact O-N 3.12Å; V11-I14 PolarHBondContact O-N 3.18Å; V11-I15 HydrophobicContact CG1-CD1 3.85Å; V11-I15 HydrophobicContact CG1-CG1 4.39Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 3.41Å
12M82.4Confident81.8Confident83 Ų8382.6 Ų82.641%0.40943%0.426SS..Hα-helixtrans-61-42.9175.9-176.5-177.570.700112.5N8 R9 R10 I14 I15 L16 L172N8-M12 WeakPolarHBondContact O-CB 3.33Å; N8-M12 PolarHBondContact O-N 3Å; R9-M12 PolarHBondContact O-N 3Å; R10-M12 VanDerWaalsContact C-N 3.32Å; R10-M12 PolarHBondContact O-N 3.48Å; M12-I14 VanDerWaalsContact C-N 3.34Å; M12-I15 PolarHBondContact O-N 3.42Å; M12-L16 WeakPolarHBondContact O-CB 3.2Å; M12-L16 PolarHBondContact O-N 3.45Å; M12-L172 HydrophobicContact CG-CD2 4.44Å
13L85.1Confident83.2Confident100 Ų10078.9 Ų78.952%0.52440%0.396SS..Hα-helixtrans-65.3-37.8177.4-68.4174.2000112.3R9 R10 V11 L16 A17R9-L13 WeakPolarHBondContact O-CG 3.37Å; R9-L13 PolarHBondContact O-N 3.31Å; R10-L13 PolarHBondContact O-N 3.44Å; V11-L13 PolarHBondContact O-N 3.12Å; L13-L16 PolarHBondContact O-N 3.4Å; L13-A17 PolarHBondContact O-N 3.27Å
14I88.5Confident84.5Confident95 Ų9577.1 Ų77.149%0.48739%0.387SS..Hα-helixtrans-64.6-48176.4-67.6166.3000110.4R10 V11 M12 L16 A17 F18R10-I14 WeakPolarHBondContact O-CG1 3.46Å; R10-I14 PolarHBondContact O-N 3.27Å; R10-I14 VanDerWaalsContact O-N 3.12Å; V11-I14 PolarHBondContact O-N 3.18Å; M12-I14 VanDerWaalsContact C-N 3.34Å; I14-L16 VanDerWaalsContact C-N 3.29Å; I14-L16 PolarHBondContact O-N 3.23Å; I14-A17 PolarHBondContact O-N 3.08Å; I14-F18 HydrophobicContact CG2-CD2 3.7Å; I14-F18 HydrophobicContact CG2-CE2 3.5Å; I14-F18 VanDerWaalsContact CG2-CE2 3.5Å; I14-F18 WeakPolarHBondContact O-CD2 3.28Å; I14-F18 PolarHBondContact O-N 3.5Å
15I86.2Confident85.8Confident24 Ų2472.3 Ų72.312%0.12337%0.368CS..Hα-helixtrans-59.6-43.4177.3-66167.2000110.4V11 M12 A17 F18 I19 V171 L172V11-I15 HydrophobicContact CG1-CD1 3.85Å; V11-I15 HydrophobicContact CG1-CG1 4.39Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 3.41Å; M12-I15 PolarHBondContact O-N 3.42Å; I15-A17 PolarHBondContact O-N 3.03Å; I15-F18 PolarHBondContact O-N 2.97Å; I15-I19 HydrophobicContact CG2-CD1 3.78Å; I15-I19 HydrophobicContact CG2-CG1 4.39Å; I15-I19 VanDerWaalsContact O-CG1 3.32Å; I15-I19 WeakPolarHBondContact O-CG1 3.4Å; I15-I19 PolarHBondContact O-N 3.38Å; I15-V171 HydrophobicContact CD1-CG1 4.36Å; I15-L172 HydrophobicContact CB-CD2 4.09Å; I15-L172 HydrophobicContact CG2-CD2 3.54Å; I15-L172 HydrophobicContact CG2-CG 3.9Å
16L87.8Confident87.2Confident42 Ų4269.2 Ų69.222%0.2235%0.347CS..Hα-helixtrans-58.7-47176.7174.356000112.2M12 L13 I14 F18 I19 I20 F97 L101M12-L16 WeakPolarHBondContact O-CB 3.2Å; M12-L16 PolarHBondContact O-N 3.45Å; L13-L16 PolarHBondContact O-N 3.4Å; I14-L16 VanDerWaalsContact C-N 3.29Å; I14-L16 PolarHBondContact O-N 3.23Å; L16-F18 VanDerWaalsContact C-N 3.34Å; L16-F18 PolarHBondContact O-N 3.43Å; L16-I19 PolarHBondContact O-N 3.02Å; L16-I20 HydrophobicContact CD1-CD1 4.04Å; L16-I20 HydrophobicContact CD1-CG1 4.35Å; L16-I20 HydrophobicContact CG-CD1 4.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 3.42Å; L16-F97 HydrophobicContact CD1-CE1 4.23Å; L16-F97 HydrophobicContact CD1-CE2 4.18Å; L16-F97 HydrophobicContact CD1-CZ 3.39Å; L16-L101 HydrophobicContact CD1-CD1 4.23Å; L16-L101 HydrophobicContact CD1-CD2 3.58Å; L16-L101 HydrophobicContact CD2-CD2 4.21Å
17A90.3Very high88.3Confident58 Ų5865.5 Ų65.548%0.47933%0.332SS..Hα-helixtrans-60.8-43.5177.600000111.9L13 I14 I15 I20 L21L13-A17 PolarHBondContact O-N 3.27Å; I14-A17 PolarHBondContact O-N 3.08Å; I15-A17 PolarHBondContact O-N 3.03Å; A17-I20 PolarHBondContact O-N 3.24Å; A17-L21 WeakPolarHBondContact O-CB 3.34Å; A17-L21 PolarHBondContact O-N 3.4Å
18F91.2Very high89.4Confident100 Ų10066.6 Ų66.644%0.43933%0.334SS..Hα-helixtrans-62.3-44174.9-80.3-64.7000112I14 I15 L16 I20 L21 F22 M168I14-F18 HydrophobicContact CG2-CD2 3.7Å; I14-F18 HydrophobicContact CG2-CE2 3.5Å; I14-F18 VanDerWaalsContact CG2-CE2 3.5Å; I14-F18 WeakPolarHBondContact O-CD2 3.28Å; I14-F18 PolarHBondContact O-N 3.5Å; I15-F18 PolarHBondContact O-N 2.97Å; L16-F18 VanDerWaalsContact C-N 3.34Å; L16-F18 PolarHBondContact O-N 3.43Å; F18-I20 VanDerWaalsContact C-N 3.34Å; F18-I20 PolarHBondContact O-N 2.96Å; F18-L21 PolarHBondContact O-N 3.18Å; F18-F22 HydrophobicContact CB-CD2 4.27Å; F18-F22 HydrophobicContact CD1-CD2 4.27Å; F18-F22 AromaticContact CD1-CE2 3.88Å; F18-F22 HydrophobicContact CD1-CE2 3.88Å; F18-F22 WeakPolarHBondContact O-CB 3.04Å; F18-F22 VanDerWaalsContact O-CD2 3.25Å; F18-F22 WeakPolarHBondContact O-CD2 3.25Å; F18-F22 PolarHBondContact O-N 3.03Å; F18-M168 HydrophobicContact CB-SD 4.05Å
19I90.5Very high90.4Very high0 Ų064.3 Ų64.30%032%0.322CS..Hα-helixtrans-55.9-50.4176.6-73.9165.3000110.8I15 L16 L21 F22 H23 F97 M168 Y169 L172I15-I19 HydrophobicContact CG2-CD1 3.78Å; I15-I19 HydrophobicContact CG2-CG1 4.39Å; I15-I19 VanDerWaalsContact O-CG1 3.32Å; I15-I19 WeakPolarHBondContact O-CG1 3.4Å; I15-I19 PolarHBondContact O-N 3.38Å; L16-I19 PolarHBondContact O-N 3.02Å; I19-L21 VanDerWaalsContact C-N 3.33Å; I19-L21 PolarHBondContact O-N 3.18Å; I19-F22 PolarHBondContact O-N 3.24Å; I19-H23 WeakPolarHBondContact O-CB 3.41Å; I19-H23 PolarHBondContact O-N 2.85Å; I19-F97 HydrophobicContact CB-CZ 4.37Å; I19-F97 HydrophobicContact CG2-CD1 4.28Å; I19-F97 HydrophobicContact CG2-CE1 3.58Å; I19-F97 HydrophobicContact CG2-CE2 4.28Å; I19-F97 HydrophobicContact CG2-CZ 3.54Å; I19-M168 HydrophobicContact CD1-CB 3.96Å; I19-M168 HydrophobicContact CG1-CB 3.51Å; I19-M168 HydrophobicContact CG1-CE 4.18Å; I19-M168 HydrophobicContact CG1-CG 4.46Å; I19-M168 HydrophobicContact CG1-SD 4.25Å; I19-Y169 HydrophobicContact CD1-CD1 4.31Å; I19-Y169 HydrophobicContact CG2-CD1 4Å; I19-Y169 HydrophobicContact CG2-CE1 3.25Å; I19-Y169 HydrophobicContact CG2-CE2 4.28Å; I19-Y169 VanDerWaalsContact CG2-CZ 3.41Å; I19-Y169 WeakPolarHBondContact CG2-OH 3.5Å; I19-L172 HydrophobicContact CD1-CD1 3.31Å; I19-L172 HydrophobicContact CD1-CD2 4.5Å; I19-L172 HydrophobicContact CD1-CG 3.72Å
20I91.8Very high91.4Very high63 Ų6356.6 Ų56.632%0.32329%0.293SS..Hα-helixtrans-59-46.4179.3-66.1167.5000110.8L16 A17 F18 H23 L24 F97 M98 L101L16-I20 HydrophobicContact CD1-CD1 4.04Å; L16-I20 HydrophobicContact CD1-CG1 4.35Å; L16-I20 HydrophobicContact CG-CD1 4.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 3.42Å; A17-I20 PolarHBondContact O-N 3.24Å; F18-I20 VanDerWaalsContact C-N 3.34Å; F18-I20 PolarHBondContact O-N 2.96Å; I20-H23 PolarHBondContact O-N 3.48Å; I20-L24 WeakPolarHBondContact O-CB 3.38Å; I20-L24 PolarHBondContact O-N 3.21Å; I20-F97 HydrophobicContact CG1-CE1 3.72Å; I20-F97 HydrophobicContact CG1-CZ 4.39Å; I20-M98 HydrophobicContact CG1-CE 4.32Å; I20-L101 HydrophobicContact CD1-CD1 4.5Å
21L93.9Very high92.1Very high104 Ų10453.8 Ų53.855%0.54529%0.285SS..Hα-helixtrans-60.9-52.9179.7176.864.5000112.1A17 F18 I19 H23 L24 A25A17-L21 WeakPolarHBondContact O-CB 3.34Å; A17-L21 PolarHBondContact O-N 3.4Å; F18-L21 PolarHBondContact O-N 3.18Å; I19-L21 VanDerWaalsContact C-N 3.33Å; I19-L21 PolarHBondContact O-N 3.18Å; L21-H23 VanDerWaalsContact C-N 3.29Å; L21-H23 PolarHBondContact O-N 3.26Å; L21-L24 PolarHBondContact O-N 3.46Å; L21-A25 VanDerWaalsContact O-CB 3.27Å; L21-A25 WeakPolarHBondContact O-CB 3.16Å; L21-A25 PolarHBondContact O-N 3.37Å
22F93.4Very high92.8Very high52 Ų5254.4 Ų54.423%0.22829%0.289CS..Hα-helixtrans-63.5-37.1-179-88-90.6000111.6F18 I19 S26 M161 I164 M168F18-F22 HydrophobicContact CB-CD2 4.27Å; F18-F22 HydrophobicContact CD1-CD2 4.27Å; F18-F22 AromaticContact CD1-CE2 3.88Å; F18-F22 HydrophobicContact CD1-CE2 3.88Å; F18-F22 WeakPolarHBondContact O-CB 3.04Å; F18-F22 VanDerWaalsContact O-CD2 3.25Å; F18-F22 WeakPolarHBondContact O-CD2 3.25Å; F18-F22 PolarHBondContact O-N 3.03Å; I19-F22 PolarHBondContact O-N 3.24Å; F22-S26 VanDerWaalsContact O-CB 3.25Å; F22-S26 WeakPolarHBondContact O-CB 3.31Å; F22-S26 PolarHBondContact O-N 3.4Å; F22-S26 PolarHBondContact O-OG 3.38Å; F22-M161 HydrophobicContact CD1-CB 4.46Å; F22-M161 HydrophobicContact CD1-CE 3.69Å; F22-M161 HydrophobicContact CE1-CE 4.06Å; F22-M161 HydrophobicContact CG-CE 4.43Å; F22-I164 HydrophobicContact CE1-CG2 4.39Å; F22-M168 HydrophobicContact CB-CE 3.66Å; F22-M168 HydrophobicContact CD1-CE 4.43Å; F22-M168 HydrophobicContact CD2-CE 3.6Å; F22-M168 HydrophobicContact CD2-SD 4.43Å; F22-M168 HydrophobicContact CE2-CE 4.34Å; F22-M168 HydrophobicContact CG-CE 3.64Å
23H94.2Very high93.5Very high0 Ų050.5 Ų50.50%027%0.269CS..Hα-helixtrans-69.2-45.6179.5-149.5112.1000111.8I19 I20 L21 S26 A27 C90 S93 F94 Q117 Y169I19-H23 WeakPolarHBondContact O-CB 3.41Å; I19-H23 PolarHBondContact O-N 2.85Å; I20-H23 PolarHBondContact O-N 3.48Å; L21-H23 VanDerWaalsContact C-N 3.29Å; L21-H23 PolarHBondContact O-N 3.26Å; H23-S26 PolarHBondContact O-N 3.46Å; H23-A27 PolarHBondContact O-N 3Å; H23-C90 PolarHBondContact NE2-O 2.99Å; H23-S93 PolarHBondContact CE1-OG 3.39Å; H23-F94 HydrophobicContact CB-CD2 4.15Å; H23-F94 AromaticContact CD2-CD2 3.63Å; H23-F94 AromaticContact CD2-CG 3.95Å; H23-F94 AromaticContact CG-CD2 3.9Å; H23-F94 WeakPolarHBondContact NE2-CB 3.26Å; H23-F94 PolarHBondContact NE2-N 2.87Å; H23-Q117 PolarHBondContact CE1-OE1 3.41Å; H23-Q117 PolarHBondContact NE2-OE1 3.47Å; H23-Y169 AromaticContact CE1-CE2 3.89Å; H23-Y169 PolarHBondContact CE1-OH 3.12Å; H23-Y169 AromaticContact ND1-CE2 3.49Å; H23-Y169 WeakPolarHBondContact ND1-CE2 3.42Å; H23-Y169 AromaticContact ND1-CZ 3.53Å; H23-Y169 PolarHBondContact ND1-OH 3.33Å
24L95.4Very high94Very high91 Ų9146.4 Ų46.448%0.47625%0.249SC..Hα-helixtrans-64.3-45.2176.6-178.862.3000111.4I20 L21 S26 A27 I28I20-L24 WeakPolarHBondContact O-CB 3.38Å; I20-L24 PolarHBondContact O-N 3.21Å; L21-L24 PolarHBondContact O-N 3.46Å; L24-S26 VanDerWaalsContact C-N 3.34Å; L24-S26 PolarHBondContact O-N 3.31Å; L24-A27 PolarHBondContact O-N 2.82Å; L24-I28 HydrophobicContact CD1-CD1 4.26Å; L24-I28 HydrophobicContact CG-CD1 4.03Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 3.49Å
25A96.6Very high94.3Very high27 Ų2747.2 Ų47.222%0.22325%0.253CS..Hα-helixtrans-60.1-44.8175.600000111.2L21 A27 I28 L29 M161L21-A25 VanDerWaalsContact O-CB 3.27Å; L21-A25 WeakPolarHBondContact O-CB 3.16Å; L21-A25 PolarHBondContact O-N 3.37Å; A25-A27 VanDerWaalsContact C-N 3.34Å; A25-A27 PolarHBondContact O-N 3.22Å; A25-I28 PolarHBondContact O-N 3.42Å; A25-L29 WeakPolarHBondContact O-CB 3.49Å; A25-L29 VanDerWaalsContact O-CG 3.23Å; A25-L29 WeakPolarHBondContact O-CG 3.42Å; A25-L29 PolarHBondContact O-N 3.42Å; A25-M161 HydrophobicContact CB-CE 3.51Å; A25-M161 HydrophobicContact CB-SD 4.38Å
26S96.7Very high94.6Very high0 Ų051 Ų510%027%0.27CS..Hα-helixtrans-58.3-45.3175.6-62.30000112F22 H23 L24 L29 L30 M161 T162F22-S26 VanDerWaalsContact O-CB 3.25Å; F22-S26 WeakPolarHBondContact O-CB 3.31Å; F22-S26 PolarHBondContact O-N 3.4Å; F22-S26 PolarHBondContact O-OG 3.38Å; H23-S26 PolarHBondContact O-N 3.46Å; L24-S26 VanDerWaalsContact C-N 3.34Å; L24-S26 PolarHBondContact O-N 3.31Å; S26-L29 PolarHBondContact O-N 3.41Å; S26-L30 WeakPolarHBondContact O-CB 3.29Å; S26-L30 VanDerWaalsContact O-CG 3.26Å; S26-L30 WeakPolarHBondContact O-CG 3.35Å; S26-L30 PolarHBondContact O-N 3.43Å; S26-M161 WeakPolarHBondContact OG-CB 3.46Å; S26-T162 PolarHBondContact OG-N 3.33Å
27A96.6Very high94.4Very high15 Ų1551.6 Ų51.612%0.12427%0.273CS..Hα-helixtrans-61.4-47178.200000111.6H23 L24 A25 L29 L30 F31H23-A27 PolarHBondContact O-N 3Å; L24-A27 PolarHBondContact O-N 2.82Å; A25-A27 VanDerWaalsContact C-N 3.34Å; A25-A27 PolarHBondContact O-N 3.22Å; A27-L29 PolarHBondContact O-N 3.21Å; A27-L30 PolarHBondContact O-N 2.88Å; A27-F31 WeakPolarHBondContact O-CD2 3.48Å; A27-F31 PolarHBondContact O-N 3.25Å
28I97.8Very high94.5Very high94 Ų9449 Ų4948%0.48225%0.252SS..Hα-helixtrans-59.8-48.7177.4-67.6166000110.7L24 A25 L30 F31 V32L24-I28 HydrophobicContact CD1-CD1 4.26Å; L24-I28 HydrophobicContact CG-CD1 4.03Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 3.49Å; A25-I28 PolarHBondContact O-N 3.42Å; I28-L30 VanDerWaalsContact C-N 3.31Å; I28-L30 PolarHBondContact O-N 2.87Å; I28-F31 PolarHBondContact O-N 3.01Å; I28-V32 HydrophobicContact CG2-CG2 4.44Å; I28-V32 WeakPolarHBondContact O-CG2 3.24Å; I28-V32 PolarHBondContact O-N 3.31Å
29L97.6Very high94.8Very high42 Ų4244.2 Ų44.222%0.2223%0.231CC..Hα-helixtrans-61.8-39.7179.4-66.7173.7000111.6A25 S26 A27 V32 A33 V154 V157 M161A25-L29 WeakPolarHBondContact O-CB 3.49Å; A25-L29 VanDerWaalsContact O-CG 3.23Å; A25-L29 WeakPolarHBondContact O-CG 3.42Å; A25-L29 PolarHBondContact O-N 3.42Å; S26-L29 PolarHBondContact O-N 3.41Å; A27-L29 PolarHBondContact O-N 3.21Å; L29-V32 PolarHBondContact O-N 3.01Å; L29-A33 WeakPolarHBondContact O-CB 3.32Å; L29-A33 PolarHBondContact O-N 2.95Å; L29-V154 HydrophobicContact CB-CG1 3.9Å; L29-V154 HydrophobicContact CD2-CG1 3.86Å; L29-V154 HydrophobicContact CG-CG1 4.45Å; L29-V154 VanDerWaalsContact O-CG1 3.25Å; L29-V154 WeakPolarHBondContact O-CG1 3.5Å; L29-V157 HydrophobicContact CD1-CG1 4.06Å; L29-M161 HydrophobicContact CD1-SD 3.36Å; L29-M161 WeakPolarHBondContact CD1-SD 3.32Å
30L97.9Very high95.1Very high0 Ų044.6 Ų44.60%023%0.232CC..Hα-helixtrans-65.3-41.9175.7-74.8171.5000112.3S26 A27 I28 A33 T34 C90 V124 S158 T162S26-L30 WeakPolarHBondContact O-CB 3.29Å; S26-L30 VanDerWaalsContact O-CG 3.26Å; S26-L30 WeakPolarHBondContact O-CG 3.35Å; S26-L30 PolarHBondContact O-N 3.43Å; A27-L30 PolarHBondContact O-N 2.88Å; I28-L30 VanDerWaalsContact C-N 3.31Å; I28-L30 PolarHBondContact O-N 2.87Å; L30-A33 PolarHBondContact O-N 3.2Å; L30-T34 WeakPolarHBondContact O-CB 3.46Å; L30-T34 PolarHBondContact O-N 3.23Å; L30-T34 PolarHBondContact O-OG1 3.5Å; L30-C90 HydrophobicContact CD1-CB 3.76Å; L30-V124 HydrophobicContact CD1-CG2 4.48Å; L30-V124 HydrophobicContact CD2-CG1 4.44Å; L30-V124 HydrophobicContact CD2-CG2 3.43Å; L30-V124 VanDerWaalsContact CD2-CG2 3.43Å; L30-S158 WeakPolarHBondContact CD2-OG 3.16Å; L30-T162 HydrophobicContact CD1-CG2 4.07Å
31F97.4Very high95.3Very high97 Ų9742.6 Ų42.643%0.42522%0.223SC..Hα-helixtrans-60.3-48.2173-83.9-68.7000111.3A27 I28 A33 T34 I35 T87A27-F31 WeakPolarHBondContact O-CD2 3.48Å; A27-F31 PolarHBondContact O-N 3.25Å; I28-F31 PolarHBondContact O-N 3.01Å; F31-A33 PolarHBondContact O-N 2.84Å; F31-T34 PolarHBondContact O-N 2.9Å; F31-I35 WeakPolarHBondContact O-CG1 3.41Å; F31-I35 WeakPolarHBondContact O-CG2 3.47Å; F31-I35 PolarHBondContact O-N 3.05Å; F31-T87 HydrophobicContact CD1-CG2 4.15Å; F31-T87 HydrophobicContact CD2-CG2 4.41Å; F31-T87 HydrophobicContact CE1-CG2 3.81Å; F31-T87 HydrophobicContact CE2-CG2 4.08Å; F31-T87 HydrophobicContact CG-CG2 4.43Å; F31-T87 HydrophobicContact CZ-CG2 3.77Å
32V97.4Very high95.4Very high56 Ų5638 Ų3834%0.33920%0.199SC..Hα-helixtrans-59.4-48.1178.3172.10000111.1I28 L29 T34 I35 H36 V154I28-V32 HydrophobicContact CG2-CG2 4.44Å; I28-V32 WeakPolarHBondContact O-CG2 3.24Å; I28-V32 PolarHBondContact O-N 3.31Å; L29-V32 PolarHBondContact O-N 3.01Å; V32-T34 VanDerWaalsContact C-N 3.29Å; V32-T34 PolarHBondContact O-N 3.46Å; V32-I35 PolarHBondContact O-N 3.38Å; V32-H36 HydrophobicContact CG1-CB 4.31Å; V32-H36 WeakPolarHBondContact O-CB 3.14Å; V32-H36 PolarHBondContact O-N 3.14Å; V32-V154 HydrophobicContact CB-CG1 4.38Å; V32-V154 HydrophobicContact CG1-CG1 4.28Å
33A97.3Very high95.4Very high0 Ų039.8 Ų39.80%022%0.218CC..Hα-helixtrans-58.7-42.1176.400000111.3L29 L30 F31 W39 I83 V154 A155L29-A33 WeakPolarHBondContact O-CB 3.32Å; L29-A33 PolarHBondContact O-N 2.95Å; L30-A33 PolarHBondContact O-N 3.2Å; F31-A33 PolarHBondContact O-N 2.84Å; A33-W39 HydrophobicContact CB-CZ2 4.37Å; A33-W39 PolarHBondContact O-NE1 2.89Å; A33-I83 HydrophobicContact CB-CD1 4.19Å; A33-V154 HydrophobicContact CB-CG1 4.1Å; A33-A155 HydrophobicContact CB-CB 4.06Å
34T95.9Very high95.1Very high14 Ų1441 Ų419%0.08623%0.226CC..Hα-helixtrans-74.6-34.4-177.2-59.80000113.3L30 F31 V32 W55 I83L30-T34 WeakPolarHBondContact O-CB 3.46Å; L30-T34 PolarHBondContact O-N 3.23Å; L30-T34 PolarHBondContact O-OG1 3.5Å; F31-T34 PolarHBondContact O-N 2.9Å; V32-T34 VanDerWaalsContact C-N 3.29Å; V32-T34 PolarHBondContact O-N 3.46Å; T34-W55 HydrophobicContact CG2-CZ2 4.06Å; T34-W55 PolarHBondContact O-NE1 3.38Å; T34-I83 HydrophobicContact CG2-CG2 4.25Å
35I94.6Very high94.7Very high113 Ų11342.9 Ų42.958%0.57924%0.244SC*.Hα-helixtrans-108.7-16.5-168.376.4-166000115.2F31 V32F31-I35 WeakPolarHBondContact O-CG1 3.41Å; F31-I35 WeakPolarHBondContact O-CG2 3.47Å; F31-I35 PolarHBondContact O-N 3.05Å; V32-I35 PolarHBondContact O-N 3.38Å
36H92Very high94.3Very high103 Ų10346 Ų4648%0.47728%0.279SS..SBendtrans-93.1128.4-173.8-171.9-84.3000112V32 A38 S151V32-H36 HydrophobicContact CG1-CB 4.31Å; V32-H36 WeakPolarHBondContact O-CB 3.14Å; V32-H36 PolarHBondContact O-N 3.14Å; H36-A38 VanDerWaalsContact C-N 3.28Å; H36-A38 PolarHBondContact O-N 3.28Å; H36-S151 PolarHBondContact O-OG 3.41Å
37N83.4Confident93.8Very high55 Ų5555.5 Ų55.529%0.29432%0.315SS..SBendtrans-62.663.7-178.8-71-51.9000114.6Y51 D53N37-Y51 WeakPolarHBondContact O-CB 2.93Å; N37-D53 PolarHBondContact OD1-OD2 3.37Å
38A93.8Very high93.5Very high3 Ų360.4 Ų60.43%0.02534%0.335CS..  trans-159.644.5-178.600000114.9H36 G149 S150 S151H36-A38 VanDerWaalsContact C-N 3.28Å; H36-A38 PolarHBondContact O-N 3.28Å; A38-G149 CarbonylContact O-C 3.5Å; A38-G149 WeakPolarHBondContact O-CA 3.43Å; A38-S150 WeakPolarHBondContact CB-OG 3.4Å; A38-S150 PolarHBondContact O-N 2.84Å; A38-S151 WeakPolarHBondContact O-CB 3.26Å; A38-S151 PolarHBondContact O-N 2.82Å
39W96.9Very high93.3Very high0 Ų058.5 Ų58.50%033%0.327CS..SBendtrans-82.4-31.5171.2-82.168.7000113.2A33 S52 L54 V79 I83 Y131 G149 Y152 A155A33-W39 HydrophobicContact CB-CZ2 4.37Å; A33-W39 PolarHBondContact O-NE1 2.89Å; W39-S52 WeakPolarHBondContact CA-O 3.33Å; W39-S52 PolarHBondContact N-O 2.8Å; W39-L54 HydrophobicContact CD2-CD1 4.47Å; W39-L54 HydrophobicContact CD2-CD2 3.62Å; W39-L54 HydrophobicContact CD2-CG 3.99Å; W39-L54 HydrophobicContact CE3-CD2 3.84Å; W39-L54 HydrophobicContact CG-CD2 3.94Å; W39-L54 HydrophobicContact CG-CG 4.13Å; W39-L54 HydrophobicContact CH2-CD1 4.46Å; W39-L54 HydrophobicContact CZ2-CD1 3.9Å; W39-L54 HydrophobicContact CZ2-CD2 4.37Å; W39-L54 HydrophobicContact CZ2-CG 4.32Å; W39-L54 HydrophobicContact CZ3-CD2 4.28Å; W39-V79 HydrophobicContact CZ3-CG1 4.44Å; W39-I83 HydrophobicContact CH2-CD1 3.87Å; W39-I83 HydrophobicContact CZ2-CD1 3.43Å; W39-I83 VanDerWaalsContact CZ2-CD1 3.43Å; W39-Y131 HydrophobicContact CB-CE1 4.26Å; W39-Y131 HydrophobicContact CB-CE2 4.22Å; W39-Y131 WeakPolarHBondContact CB-OH 3.4Å; W39-Y131 HydrophobicContact CD2-CE2 4.36Å; W39-Y131 AromaticContact CE3-CD1 3.72Å; W39-Y131 HydrophobicContact CE3-CD1 3.72Å; W39-Y131 AromaticContact CE3-CD2 3.59Å; W39-Y131 HydrophobicContact CE3-CD2 3.59Å; W39-Y131 AromaticContact CE3-CE1 3.9Å; W39-Y131 HydrophobicContact CE3-CE1 3.9Å; W39-Y131 AromaticContact CE3-CE2 3.75Å; W39-Y131 HydrophobicContact CE3-CE2 3.75Å; W39-Y131 AromaticContact CE3-CG 3.56Å; W39-Y131 HydrophobicContact CE3-CG 3.56Å; W39-Y131 AromaticContact CE3-CZ 3.92Å; W39-Y131 HydrophobicContact CZ3-CD1 4.15Å; W39-Y131 AromaticContact CZ3-CD2 3.93Å; W39-Y131 HydrophobicContact CZ3-CD2 3.93Å; W39-Y131 AromaticContact CZ3-CG 3.71Å; W39-Y131 HydrophobicContact CZ3-CG 3.71Å; W39-G149 PolarHBondContact O-N 2.89Å; W39-Y152 AromaticContact CE3-CD2 3.88Å; W39-Y152 HydrophobicContact CE3-CD2 3.88Å; W39-Y152 HydrophobicContact CE3-CG 4.38Å; W39-Y152 AromaticContact CZ3-CD2 3.85Å; W39-Y152 HydrophobicContact CZ3-CD2 3.85Å; W39-A155 HydrophobicContact CH2-CB 3.6Å; W39-A155 HydrophobicContact CZ2-CB 3.78Å; W39-A155 HydrophobicContact CZ3-CB 4.5Å
40W96.6Very high93.2Very high7 Ų758.2 Ų58.23%0.02733%0.326CS..EExtended strand (participates in β ladder)trans-139.3142.2-178.7-167.7-109.2000110.2Y51 S52 Y131 H139 L143 G146 S147 Y148W40-Y51 WeakPolarHBondContact O-CA 3.39Å; W40-S52 PolarHBondContact N-O 3.45Å; W40-S52 PolarHBondContact O-N 3.22Å; W40-Y131 WeakPolarHBondContact CB-OH 3.36Å; W40-Y131 HydrophobicContact CE3-CE1 4.42Å; W40-H139 AromaticContact CD1-CD2 3.86Å; W40-H139 AromaticContact CD1-CE1 3.94Å; W40-H139 AromaticContact CD1-NE2 3.61Å; W40-H139 AromaticContact CD2-NE2 3.8Å; W40-H139 AromaticContact CG-CD2 3.94Å; W40-H139 AromaticContact CG-CE1 3.97Å; W40-H139 AromaticContact CG-NE2 3.39Å; W40-H139 AromaticContact NE1-CD2 3.89Å; W40-L143 PolarHBondContact NE1-O 3.36Å; W40-G146 VanDerWaalsContact CE2-CA 3.49Å; W40-G146 WeakPolarHBondContact CH2-O 3.49Å; W40-G146 VanDerWaalsContact CZ2-CA 3.41Å; W40-G146 WeakPolarHBondContact CZ2-O 3.46Å; W40-S147 CarbonylContact C-O 3.01Å; W40-S147 WeakPolarHBondContact CA-O 3.21Å; W40-Y148 AromaticContact CE3-CD1 3.96Å; W40-Y148 HydrophobicContact CE3-CD1 3.96Å; W40-Y148 HydrophobicContact CE3-CE1 4.26Å; W40-Y148 HydrophobicContact CE3-CG 4.48Å; W40-Y148 AromaticContact CZ3-CD1 3.78Å; W40-Y148 HydrophobicContact CZ3-CD1 3.78Å; W40-Y148 AromaticContact CZ3-CE1 3.77Å; W40-Y148 HydrophobicContact CZ3-CE1 3.77Å; W40-Y148 HydrophobicContact CZ3-CG 4.18Å
41V96Very high93Very high22 Ų2263 Ų6313%0.13335%0.345CS..EExtended strand (participates in β ladder)trans-134.8128.6-176-170.80000109.5V49 I50 Y51 G146 S147V41-V49 HydrophobicContact CG1-CG1 3.52Å; V41-I50 WeakPolarHBondContact CA-O 3.27Å; V41-Y51 HydrophobicContact CB-CD1 4.45Å; V41-Y51 HydrophobicContact CB-CE1 4.5Å; V41-Y51 HydrophobicContact CG1-CD1 4.09Å; V41-Y51 HydrophobicContact CG1-CE1 3.82Å; V41-Y51 HydrophobicContact CG2-CD1 3.69Å; V41-Y51 HydrophobicContact CG2-CE1 3.83Å; V41-G146 CarbonylContact O-C 3.57Å; V41-G146 WeakPolarHBondContact O-CA 3.39Å; V41-S147 PolarHBondContact N-O 2.97Å; V41-S147 PolarHBondContact O-N 3.34Å; V41-S147 PolarHBondContact O-OG 3.41Å
42V95.4Very high92.9Very high8 Ų858.5 Ų58.55%0.04833%0.325CS..EExtended strand (participates in β ladder)trans-121.4131.8176.6-176.20000108.1P44 V49 I50 L143V42-P44 HydrophobicContact CG1-CG 4.27Å; V42-P44 WeakPolarHBondContact O-CD 3.21Å; V42-V49 WeakPolarHBondContact O-CG1 3.34Å; V42-I50 HydrophobicContact CB-CB 4.39Å; V42-I50 PolarHBondContact N-O 3.49Å; V42-I50 PolarHBondContact O-N 3.5Å; V42-L143 HydrophobicContact CB-CD2 4.4Å; V42-L143 HydrophobicContact CG2-CB 4.14Å; V42-L143 HydrophobicContact CG2-CD2 3.96Å; V42-L143 WeakPolarHBondContact CG2-O 3.26Å
43S93.2Very high92.6Very high88 Ų8855.9 Ų55.962%0.61531%0.309SS*.  trans-120.682.4179.8-64.50000110.3
44P88.1Confident92.5Very high26 Ų2655.9 Ų55.917%0.16931%0.309CS..  trans-70.7143.7-178.3-5.320.3000111V42 G46 R47 I50V42-P44 HydrophobicContact CG1-CG 4.27Å; V42-P44 WeakPolarHBondContact O-CD 3.21Å; P44-G46 PolarHBondContact O-N 3.18Å; P44-R47 HydrophobicContact CB-CB 4.17Å; P44-R47 HydrophobicContact CG-CB 4.28Å; P44-R47 PolarHBondContact O-N 3.42Å; P44-I50 HydrophobicContact CG-CD1 4.28Å
45P88.3Confident92.5Very high131 Ų13158.2 Ų58.285%0.85132%0.316SS*.THydrogen-bonded Turntrans-58.6126175.9-23.333.2000112.2R47P45-R47 VanDerWaalsContact C-N 3.29Å; P45-R47 PolarHBondContact O-N 3.35Å
46G87.1Confident92.5Very high93 Ų9358.1 Ų58.196%0.95931%0.309SS*.THydrogen-bonded Turntrans70.815.2175.400000115.6P44P44-G46 PolarHBondContact O-N 3.18Å
47R87.3Confident92.6Very high199 Ų19954.4 Ų54.475%0.75129%0.294SS*.SBendtrans-128.7166.4174.9-60.2-174.9-172.4147.92.5111.2P44 P45P44-R47 HydrophobicContact CB-CB 4.17Å; P44-R47 HydrophobicContact CG-CB 4.28Å; P44-R47 PolarHBondContact O-N 3.42Å; P45-R47 VanDerWaalsContact C-N 3.29Å; P45-R47 PolarHBondContact O-N 3.35Å
48E89.9Confident93Very high118 Ų11852.3 Ų52.355%0.55128%0.283SS*.  trans-64148.7173.7-66.1-177.7162.600111.7S60E48-S60 WeakPolarHBondContact OE2-CB 3.18Å; E48-S60 PolarHBondContact OE2-N 2.89Å; E48-S60 PolarHBondContact OE2-OG 3.33Å
49V93.2Very high92.9Very high53 Ų5355.9 Ų55.932%0.32130%0.302SS..  trans-65.7135.6175.6-178.40000109.2V41 V42 Y51V41-V49 HydrophobicContact CG1-CG1 3.52Å; V42-V49 WeakPolarHBondContact O-CG1 3.34Å; V49-Y51 HydrophobicContact CB-CE2 3.89Å; V49-Y51 HydrophobicContact CG1-CD2 4.06Å; V49-Y51 HydrophobicContact CG1-CE1 4.29Å; V49-Y51 HydrophobicContact CG1-CE2 3.47Å; V49-Y51 VanDerWaalsContact CG1-CE2 3.47Å
50I94.8Very high92.5Very high36 Ų3660.2 Ų60.219%0.18533%0.332CS..EExtended strand (participates in β ladder)trans-105.7126.7178-52.3174.3000108V41 V42 P44 T57 C58 N59 L143V41-I50 WeakPolarHBondContact CA-O 3.27Å; V42-I50 HydrophobicContact CB-CB 4.39Å; V42-I50 PolarHBondContact N-O 3.49Å; V42-I50 PolarHBondContact O-N 3.5Å; P44-I50 HydrophobicContact CG-CD1 4.28Å; I50-T57 HydrophobicContact CG2-CG2 3.47Å; I50-T57 VanDerWaalsContact CG2-CG2 3.47Å; I50-C58 WeakPolarHBondContact CA-O 3.36Å; I50-N59 HydrophobicContact CG1-CB 4.28Å; I50-L143 HydrophobicContact CB-CD2 4.42Å; I50-L143 HydrophobicContact CD1-CD2 4.02Å; I50-L143 HydrophobicContact CG2-CD2 3.96Å
51Y95.1Very high92.2Very high102 Ų10263 Ų6340%0.435%0.35SS..EExtended strand (participates in β ladder)trans-111.5129.4175.1-64.4-92.1000109.5N37 W40 V41 V49 T57 C58N37-Y51 WeakPolarHBondContact O-CB 2.93Å; W40-Y51 WeakPolarHBondContact O-CA 3.39Å; V41-Y51 HydrophobicContact CB-CD1 4.45Å; V41-Y51 HydrophobicContact CB-CE1 4.5Å; V41-Y51 HydrophobicContact CG1-CD1 4.09Å; V41-Y51 HydrophobicContact CG1-CE1 3.82Å; V41-Y51 HydrophobicContact CG2-CD1 3.69Å; V41-Y51 HydrophobicContact CG2-CE1 3.83Å; V49-Y51 HydrophobicContact CB-CE2 3.89Å; V49-Y51 HydrophobicContact CG1-CD2 4.06Å; V49-Y51 HydrophobicContact CG1-CE1 4.29Å; V49-Y51 HydrophobicContact CG1-CE2 3.47Å; V49-Y51 VanDerWaalsContact CG1-CE2 3.47Å; Y51-T57 CarbonylContact O-C 3.59Å; Y51-C58 PolarHBondContact N-O 2.92Å; Y51-C58 PolarHBondContact O-N 3.44Å
52S94Very high92.1Very high1 Ų165.4 Ų65.41%0.00737%0.367CS..EExtended strand (participates in β ladder)trans-116.9133.8170.3-54.50000109.7W39 W40 Y56 T57W39-S52 WeakPolarHBondContact CA-O 3.33Å; W39-S52 PolarHBondContact N-O 2.8Å; W40-S52 PolarHBondContact N-O 3.45Å; W40-S52 PolarHBondContact O-N 3.22Å; S52-Y56 CarbonylContact C-O 3.58Å; S52-Y56 WeakPolarHBondContact CA-O 3.35Å; S52-T57 WeakPolarHBondContact CB-OG1 3.34Å; S52-T57 VanDerWaalsContact OG-CG2 3.31Å; S52-T57 WeakPolarHBondContact OG-CG2 3.49Å; S52-T57 PolarHBondContact OG-OG1 3.25Å
53D92.1Very high91.9Very high2 Ų272 Ų721%0.01139%0.392CS..  trans-99.3-154.7159.165.419.7000111.4N37 W55 Y56N37-D53 PolarHBondContact OD1-OD2 3.37Å; D53-W55 VanDerWaalsContact C-N 3.3Å; D53-W55 WeakPolarHBondContact OD1-CA 3.45Å; D53-W55 PolarHBondContact OD1-N 2.86Å; D53-Y56 PolarHBondContact N-O 2.91Å; D53-Y56 PolarHBondContact OD1-N 3.44Å
54L95.2Very high91.9Very high0 Ų072.5 Ų72.50%039%0.387CS..SBendtrans-77.4-16.9178.9-57.4-177.8000112.5W39 L76 V79 Q80 I83 Y131W39-L54 HydrophobicContact CD2-CD1 4.47Å; W39-L54 HydrophobicContact CD2-CD2 3.62Å; W39-L54 HydrophobicContact CD2-CG 3.99Å; W39-L54 HydrophobicContact CE3-CD2 3.84Å; W39-L54 HydrophobicContact CG-CD2 3.94Å; W39-L54 HydrophobicContact CG-CG 4.13Å; W39-L54 HydrophobicContact CH2-CD1 4.46Å; W39-L54 HydrophobicContact CZ2-CD1 3.9Å; W39-L54 HydrophobicContact CZ2-CD2 4.37Å; W39-L54 HydrophobicContact CZ2-CG 4.32Å; W39-L54 HydrophobicContact CZ3-CD2 4.28Å; L54-L76 HydrophobicContact CD2-CD1 4.26Å; L54-V79 HydrophobicContact CD1-CG1 4.09Å; L54-V79 HydrophobicContact CD2-CG1 3.59Å; L54-V79 HydrophobicContact CG-CG1 4.5Å; L54-Q80 HydrophobicContact CB-CG 4.17Å; L54-Q80 PolarHBondContact O-NE2 3.27Å; L54-I83 HydrophobicContact CD1-CD1 4.25Å; L54-I83 HydrophobicContact CD1-CG2 3.67Å; L54-Y131 HydrophobicContact CD2-CD2 3.83Å; L54-Y131 HydrophobicContact CD2-CE2 3.64Å
55W95.2Very high92.1Very high63 Ų6371.6 Ų71.624%0.23938%0.381CS..SBendtrans-120-41.1-169.3-42.9108.6000112.4T34 D53 I64 V65 Q80 I84T34-W55 HydrophobicContact CG2-CZ2 4.06Å; T34-W55 PolarHBondContact O-NE1 3.38Å; D53-W55 VanDerWaalsContact C-N 3.3Å; D53-W55 WeakPolarHBondContact OD1-CA 3.45Å; D53-W55 PolarHBondContact OD1-N 2.86Å; W55-I64 WeakPolarHBondContact O-CA 3.34Å; W55-V65 PolarHBondContact O-N 3.13Å; W55-Q80 HydrophobicContact CE3-CG 3.96Å; W55-Q80 HydrophobicContact CH2-CB 3.51Å; W55-Q80 HydrophobicContact CH2-CG 3.54Å; W55-Q80 HydrophobicContact CZ2-CG 4.35Å; W55-Q80 HydrophobicContact CZ3-CB 3.65Å; W55-Q80 HydrophobicContact CZ3-CG 3.33Å; W55-I84 HydrophobicContact CH2-CD1 3.5Å; W55-I84 HydrophobicContact CH2-CG1 4.07Å; W55-I84 HydrophobicContact CZ2-CD1 4.13Å; W55-I84 HydrophobicContact CZ2-CG1 4.26Å; W55-I84 HydrophobicContact CZ3-CD1 4.4Å
56Y94.8Very high92Very high110 Ų11071 Ų7143%0.43137%0.367SS..EExtended strand (participates in β ladder)trans-130.4150.9-173-59-81.8000112.3S52 D53 Y63 I64S52-Y56 CarbonylContact C-O 3.58Å; S52-Y56 WeakPolarHBondContact CA-O 3.35Å; D53-Y56 PolarHBondContact N-O 2.91Å; D53-Y56 PolarHBondContact OD1-N 3.44Å; Y56-Y63 CarbonylContact C-O 3.48Å; Y56-Y63 WeakPolarHBondContact CA-O 3.25Å; Y56-I64 HydrophobicContact CD1-CG1 4.17Å; Y56-I64 HydrophobicContact CE1-CG1 3.78Å
57T93.8Very high92Very high26 Ų2670.3 Ų70.316%0.1634%0.341CS..EExtended strand (participates in β ladder)trans-112.4127.8163.6-63.70000108.7I50 Y51 S52 C62 Y63 L143I50-T57 HydrophobicContact CG2-CG2 3.47Å; I50-T57 VanDerWaalsContact CG2-CG2 3.47Å; Y51-T57 CarbonylContact O-C 3.59Å; S52-T57 WeakPolarHBondContact CB-OG1 3.34Å; S52-T57 VanDerWaalsContact OG-CG2 3.31Å; S52-T57 WeakPolarHBondContact OG-CG2 3.49Å; S52-T57 PolarHBondContact OG-OG1 3.25Å; T57-C62 WeakPolarHBondContact O-CA 3.25Å; T57-Y63 PolarHBondContact N-O 2.99Å; T57-Y63 PolarHBondContact O-N 3.39Å; T57-L143 HydrophobicContact CG2-CD1 4.12Å
58C93.3Very high92Very high10 Ų1061.1 Ų61.17%0.06831%0.307CS..EExtended strand (participates in β ladder)trans-129134.6-171.3-62.30000111.6I50 Y51 T61 C62I50-C58 WeakPolarHBondContact CA-O 3.36Å; Y51-C58 PolarHBondContact N-O 2.92Å; Y51-C58 PolarHBondContact O-N 3.44Å; C58-T61 VanDerWaalsContact CA-O 3.3Å; C58-T61 WeakPolarHBondContact CA-O 3.44Å; C58-C62 HydrophobicContact CB-CB 4.13Å; C58-C62 WeakPolarHBondContact CB-SG 3.2Å; C58-C62 WeakPolarHBondContact SG-CB 3.5Å; C58-C62 CovalentContact SG-SG 2.04Å; C58-C62 PolarHBondContact SG-SG 3.41Å
59N90.6Very high91.9Very high79 Ų7963.1 Ų63.142%0.42232%0.316SS..SBendtrans-119-107.7159.1604.3000108.7I50 T61I50-N59 HydrophobicContact CG1-CB 4.28Å; N59-T61 PolarHBondContact N-O 3.4Å; N59-T61 PolarHBondContact OD1-N 3.46Å; N59-T61 PolarHBondContact OD1-O 2.9Å
60S88.6Confident91.7Very high90 Ų9062.5 Ų62.563%0.62931%0.314SS*.SBendtrans-73.5-27.7161.832.60000112.9E48E48-S60 WeakPolarHBondContact OE2-CB 3.18Å; E48-S60 PolarHBondContact OE2-N 2.89Å; E48-S60 PolarHBondContact OE2-OG 3.33Å
61T90.8Very high91.4Very high65 Ų6566.6 Ų66.640%0.39934%0.341SS..SBendtrans-126.9155.5173.748.30000110.7C58 N59 Y63C58-T61 VanDerWaalsContact CA-O 3.3Å; C58-T61 WeakPolarHBondContact CA-O 3.44Å; N59-T61 PolarHBondContact N-O 3.4Å; N59-T61 PolarHBondContact OD1-N 3.46Å; N59-T61 PolarHBondContact OD1-O 2.9Å; T61-Y63 WeakPolarHBondContact OG1-CE2 3.3Å; T61-Y63 PolarHBondContact OG1-OH 2.9Å
62C93.1Very high90.9Very high73 Ų7367.9 Ų67.949%0.49335%0.351SS..EExtended strand (participates in β ladder)trans-110.2134.9-179.3-67.90000111T57 C58T57-C62 WeakPolarHBondContact O-CA 3.25Å; C58-C62 HydrophobicContact CB-CB 4.13Å; C58-C62 WeakPolarHBondContact CB-SG 3.2Å; C58-C62 WeakPolarHBondContact SG-CB 3.5Å; C58-C62 CovalentContact SG-SG 2.04Å; C58-C62 PolarHBondContact SG-SG 3.41Å
63Y92.4Very high90.7Very high148 Ų14867.9 Ų67.958%0.5835%0.351SS*.EExtended strand (participates in β ladder)trans-131153.9176.1-52.8-81.5000109.6Y56 T57 T61Y56-Y63 CarbonylContact C-O 3.48Å; Y56-Y63 WeakPolarHBondContact CA-O 3.25Å; T57-Y63 PolarHBondContact N-O 2.99Å; T57-Y63 PolarHBondContact O-N 3.39Å; T61-Y63 WeakPolarHBondContact OG1-CE2 3.3Å; T61-Y63 PolarHBondContact OG1-OH 2.9Å
64I92.5Very high90.8Very high98 Ų9871.1 Ų71.150%0.50337%0.371SS..EExtended strand (participates in β ladder)trans-59.5142174.9-62.2170.4000108.7W55 Y56 E66 S68W55-I64 WeakPolarHBondContact O-CA 3.34Å; Y56-I64 HydrophobicContact CD1-CG1 4.17Å; Y56-I64 HydrophobicContact CE1-CG1 3.78Å; I64-E66 PolarHBondContact O-N 3.43Å; I64-S68 VanDerWaalsContact CG2-OG 3.23Å; I64-S68 WeakPolarHBondContact CG2-OG 3.43Å
65V91.6Very high90.8Very high6 Ų675.8 Ų75.84%0.03639%0.389CS..PPolyproline II helixtrans-53.9128.9174.6173.90000109.7W55 N67 S68 L76W55-V65 PolarHBondContact O-N 3.13Å; V65-N67 PolarHBondContact O-N 2.82Å; V65-S68 WeakPolarHBondContact O-CB 3.34Å; V65-S68 PolarHBondContact O-N 2.86Å; V65-S68 PolarHBondContact O-OG 3.33Å; V65-L76 HydrophobicContact CB-CD2 4.22Å; V65-L76 HydrophobicContact CG1-CD2 3.67Å
66E86.9Confident90.9Very high120 Ų12072.8 Ų72.856%0.56138%0.378SS*.THydrogen-bonded Turntrans-55.3137.5-177.3-171.4172-173.600110.8I64 S68 A140I64-E66 PolarHBondContact O-N 3.43Å; E66-S68 PolarHBondContact O-N 2.67Å; E66-A140 WeakPolarHBondContact OE2-CB 3.23Å
67N87.6Confident90.9Very high78 Ų7870.8 Ų70.842%0.41737%0.372SS..THydrogen-bonded Turntrans56.414.4179.8-60.9-20.4000115.7V65 H69 S70 E72 A73V65-N67 PolarHBondContact O-N 2.82Å; N67-H69 PolarHBondContact O-N 3.2Å; N67-S70 PolarHBondContact O-N 2.94Å; N67-S70 PolarHBondContact O-OG 2.91Å; N67-S70 VanDerWaalsContact O-OG 3.12Å; N67-E72 PolarHBondContact ND2-OE2 3.17Å; N67-A73 WeakPolarHBondContact O-CB 3.43Å
68S87.5Confident91.1Very high6 Ų671.2 Ų71.24%0.04238%0.379CS..THydrogen-bonded Turntrans-55.3-27.1-178.450.70000114.9I64 V65 E66 Q77I64-S68 VanDerWaalsContact CG2-OG 3.23Å; I64-S68 WeakPolarHBondContact CG2-OG 3.43Å; V65-S68 WeakPolarHBondContact O-CB 3.34Å; V65-S68 PolarHBondContact O-N 2.86Å; V65-S68 PolarHBondContact O-OG 3.33Å; E66-S68 PolarHBondContact O-N 2.67Å; S68-Q77 PolarHBondContact O-NE2 3.36Å
69H86.8Confident91.3Very high160 Ų16070.8 Ų70.874%0.74138%0.375SS*.THydrogen-bonded Turntrans-100.57.6177.5-62.8-67.9000114.3N67N67-H69 PolarHBondContact O-N 3.2Å
70S89.6Confident91.6Very high39 Ų3968.1 Ų68.127%0.27336%0.361SS..SBendtrans-99.8171.8178.890.40000111.8N67 E72 A73 Q77N67-S70 PolarHBondContact O-N 2.94Å; N67-S70 PolarHBondContact O-OG 2.91Å; N67-S70 VanDerWaalsContact O-OG 3.12Å; S70-E72 PolarHBondContact O-N 2.67Å; S70-E72 WeakPolarHBondContact OG-CB 3.42Å; S70-E72 PolarHBondContact OG-N 2.94Å; S70-A73 PolarHBondContact O-N 3.27Å; S70-Q77 PolarHBondContact O-NE2 2.75Å; S70-Q77 VanDerWaalsContact O-NE2 3.15Å
71T87.3Confident92.1Very high123 Ų12366.7 Ų66.776%0.75535%0.354SS*.G310 helixtrans-70.4-7.6173.451.30000113.4V74T71-V74 VanDerWaalsContact O-CG1 3.32Å; T71-V74 WeakPolarHBondContact O-CG1 3.48Å
72E85.9Confident92.4Very high129 Ų12964.8 Ų64.860%0.60334%0.342SS*.G310 helixtrans-79.3-25.7177-57.8-179165.300111.6N67 S70N67-E72 PolarHBondContact ND2-OE2 3.17Å; S70-E72 PolarHBondContact O-N 2.67Å; S70-E72 WeakPolarHBondContact OG-CB 3.42Å; S70-E72 PolarHBondContact OG-N 2.94Å
73A89.6Confident92.6Very high1 Ų161.3 Ų61.31%0.00832%0.319CS..G310 helixtrans-101.327.6-177.900000113.4N67 S70 Y75 L76 Q77 F138N67-A73 WeakPolarHBondContact O-CB 3.43Å; S70-A73 PolarHBondContact O-N 3.27Å; A73-Y75 PolarHBondContact O-N 3.18Å; A73-L76 HydrophobicContact CB-CB 4.2Å; A73-L76 HydrophobicContact CB-CD2 4.47Å; A73-L76 WeakPolarHBondContact O-CA 3.29Å; A73-L76 WeakPolarHBondContact O-CB 3.3Å; A73-L76 PolarHBondContact O-N 3.44Å; A73-Q77 PolarHBondContact O-N 3.02Å; A73-F138 HydrophobicContact CB-CB 4.39Å
74V94.2Very high92.9Very high70 Ų7057.7 Ų57.742%0.42431%0.309SS..Hα-helixtrans-55.5-36.5-177-73.70000113.4T71 Q77 A78T71-V74 VanDerWaalsContact O-CG1 3.32Å; T71-V74 WeakPolarHBondContact O-CG1 3.48Å; V74-Q77 PolarHBondContact O-N 2.95Å; V74-A78 PolarHBondContact O-N 3.4Å
75Y95.4Very high93.2Very high98 Ų9856.9 Ų56.938%0.38431%0.305SS..Hα-helixtrans-68.2-41.7176.4-61-70000111.8A73 Q77 A78 V79 I130 E134 N137A73-Y75 PolarHBondContact O-N 3.18Å; Y75-Q77 VanDerWaalsContact C-N 3.35Å; Y75-Q77 PolarHBondContact O-N 3.48Å; Y75-A78 WeakPolarHBondContact O-CB 3.09Å; Y75-A78 PolarHBondContact O-N 3.28Å; Y75-V79 VanDerWaalsContact O-CG2 3.31Å; Y75-V79 WeakPolarHBondContact O-CG2 3.5Å; Y75-V79 PolarHBondContact O-N 3.41Å; Y75-I130 HydrophobicContact CD1-CG2 4.26Å; Y75-E134 HydrophobicContact CD1-CB 4.07Å; Y75-E134 HydrophobicContact CD1-CG 3.49Å; Y75-E134 VanDerWaalsContact CD1-CG 3.49Å; Y75-E134 HydrophobicContact CD2-CB 4.12Å; Y75-E134 HydrophobicContact CD2-CG 4.19Å; Y75-E134 WeakPolarHBondContact CD2-OE2 3.44Å; Y75-E134 HydrophobicContact CE1-CG 3.82Å; Y75-E134 HydrophobicContact CE2-CG 4.5Å; Y75-E134 VanDerWaalsContact CE2-OE2 3.23Å; Y75-E134 WeakPolarHBondContact CE2-OE2 3.45Å; Y75-E134 HydrophobicContact CG-CB 3.7Å; Y75-E134 HydrophobicContact CG-CG 3.66Å; Y75-N137 HydrophobicContact CD2-CB 4.38Å
76L95.8Very high93.5Very high0 Ų056.6 Ų56.60%030%0.303CS..Hα-helixtrans-61.5-44.6174.5179.462.4000110.9L54 V65 A73 A78 V79 Q80 F138L54-L76 HydrophobicContact CD2-CD1 4.26Å; V65-L76 HydrophobicContact CB-CD2 4.22Å; V65-L76 HydrophobicContact CG1-CD2 3.67Å; A73-L76 HydrophobicContact CB-CB 4.2Å; A73-L76 HydrophobicContact CB-CD2 4.47Å; A73-L76 WeakPolarHBondContact O-CA 3.29Å; A73-L76 WeakPolarHBondContact O-CB 3.3Å; A73-L76 PolarHBondContact O-N 3.44Å; L76-A78 VanDerWaalsContact C-N 3.29Å; L76-A78 PolarHBondContact O-N 3.32Å; L76-V79 WeakPolarHBondContact O-CB 3.39Å; L76-V79 PolarHBondContact O-N 2.99Å; L76-V79 VanDerWaalsContact O-N 3.13Å; L76-Q80 HydrophobicContact CD1-CG 4.34Å; L76-Q80 HydrophobicContact CG-CG 4.33Å; L76-Q80 WeakPolarHBondContact O-CB 3.4Å; L76-Q80 VanDerWaalsContact O-CG 3.24Å; L76-Q80 WeakPolarHBondContact O-CG 3.41Å; L76-Q80 PolarHBondContact O-N 3.3Å; L76-F138 HydrophobicContact CB-CB 4.22Å; L76-F138 HydrophobicContact CB-CD1 4.08Å; L76-F138 HydrophobicContact CB-CD2 4.02Å; L76-F138 HydrophobicContact CB-CE1 4.45Å; L76-F138 HydrophobicContact CB-CE2 4.42Å; L76-F138 HydrophobicContact CB-CG 3.84Å; L76-F138 HydrophobicContact CD1-CD2 4.21Å; L76-F138 HydrophobicContact CD1-CE2 3.92Å; L76-F138 HydrophobicContact CD1-CZ 4.23Å; L76-F138 HydrophobicContact CD2-CD2 4.18Å; L76-F138 HydrophobicContact CG-CD2 4.36Å
77Q96.4Very high94.1Very high67 Ų6751.5 Ų51.531%0.31328%0.28SS..Hα-helixtrans-61-38.1176.7-68.8174.65.600112.1S68 S70 A73 V74 Y75 Q80 A81S68-Q77 PolarHBondContact O-NE2 3.36Å; S70-Q77 PolarHBondContact O-NE2 2.75Å; S70-Q77 VanDerWaalsContact O-NE2 3.15Å; A73-Q77 PolarHBondContact O-N 3.02Å; V74-Q77 PolarHBondContact O-N 2.95Å; Y75-Q77 VanDerWaalsContact C-N 3.35Å; Y75-Q77 PolarHBondContact O-N 3.48Å; Q77-Q80 PolarHBondContact O-N 2.9Å; Q77-A81 VanDerWaalsContact O-CB 3.29Å; Q77-A81 WeakPolarHBondContact O-CB 3.41Å; Q77-A81 PolarHBondContact O-N 3.47Å
78A97Very high94.6Very high36 Ų3652.2 Ų52.230%0.29828%0.283SS..Hα-helixtrans-64.2-43.9173.300000112V74 Y75 L76 T82 I130V74-A78 PolarHBondContact O-N 3.4Å; Y75-A78 WeakPolarHBondContact O-CB 3.09Å; Y75-A78 PolarHBondContact O-N 3.28Å; L76-A78 VanDerWaalsContact C-N 3.29Å; L76-A78 PolarHBondContact O-N 3.32Å; A78-T82 WeakPolarHBondContact O-CB 3.26Å; A78-T82 VanDerWaalsContact O-CG2 3.26Å; A78-T82 WeakPolarHBondContact O-CG2 3.4Å; A78-T82 PolarHBondContact O-N 3.16Å; A78-T82 PolarHBondContact O-OG1 3.01Å; A78-I130 HydrophobicContact CB-CD1 4.14Å
79V97.6Very high95.1Very high0 Ų053.2 Ų53.20%029%0.288CS..Hα-helixtrans-60-47.7175.3174.20000110.8W39 L54 Y75 L76 T82 I83 S127 I130 Y131W39-V79 HydrophobicContact CZ3-CG1 4.44Å; L54-V79 HydrophobicContact CD1-CG1 4.09Å; L54-V79 HydrophobicContact CD2-CG1 3.59Å; L54-V79 HydrophobicContact CG-CG1 4.5Å; Y75-V79 VanDerWaalsContact O-CG2 3.31Å; Y75-V79 WeakPolarHBondContact O-CG2 3.5Å; Y75-V79 PolarHBondContact O-N 3.41Å; L76-V79 WeakPolarHBondContact O-CB 3.39Å; L76-V79 PolarHBondContact O-N 2.99Å; L76-V79 VanDerWaalsContact O-N 3.13Å; V79-T82 PolarHBondContact O-OG1 2.94Å; V79-T82 VanDerWaalsContact O-OG1 3.07Å; V79-I83 WeakPolarHBondContact O-CB 3.29Å; V79-I83 WeakPolarHBondContact O-CG2 3.45Å; V79-I83 PolarHBondContact O-N 3.39Å; V79-S127 WeakPolarHBondContact CG1-OG 3.28Å; V79-S127 PolarHBondContact O-OG 3.44Å; V79-S127 VanDerWaalsContact O-OG 3.07Å; V79-I130 HydrophobicContact CG2-CB 3.89Å; V79-I130 HydrophobicContact CG2-CG2 3.64Å; V79-Y131 HydrophobicContact CG1-CD2 4Å; V79-Y131 HydrophobicContact CG2-CD2 4.35Å
80Q97.4Very high95.7Very high24 Ų2445.6 Ų45.611%0.11225%0.253CS..Hα-helixtrans-59.7-50.9178.2-74.1173.8-20.400111.8L54 W55 L76 Q77 T82 I83 I84L54-Q80 HydrophobicContact CB-CG 4.17Å; L54-Q80 PolarHBondContact O-NE2 3.27Å; W55-Q80 HydrophobicContact CE3-CG 3.96Å; W55-Q80 HydrophobicContact CH2-CB 3.51Å; W55-Q80 HydrophobicContact CH2-CG 3.54Å; W55-Q80 HydrophobicContact CZ2-CG 4.35Å; W55-Q80 HydrophobicContact CZ3-CB 3.65Å; W55-Q80 HydrophobicContact CZ3-CG 3.33Å; L76-Q80 HydrophobicContact CD1-CG 4.34Å; L76-Q80 HydrophobicContact CG-CG 4.33Å; L76-Q80 WeakPolarHBondContact O-CB 3.4Å; L76-Q80 VanDerWaalsContact O-CG 3.24Å; L76-Q80 WeakPolarHBondContact O-CG 3.41Å; L76-Q80 PolarHBondContact O-N 3.3Å; Q77-Q80 PolarHBondContact O-N 2.9Å; Q80-T82 PolarHBondContact O-N 3.38Å; Q80-I83 WeakPolarHBondContact O-CG2 3.25Å; Q80-I84 WeakPolarHBondContact O-CB 3.4Å; Q80-I84 VanDerWaalsContact O-CG1 3.27Å; Q80-I84 WeakPolarHBondContact O-CG1 3.37Å; Q80-I84 PolarHBondContact O-N 3.34Å
81A97.9Very high96Very high59 Ų5946.1 Ų46.149%0.48826%0.256SS..Hα-helixtrans-63.8-44.2-179.100000111.7Q77 L85Q77-A81 VanDerWaalsContact O-CB 3.29Å; Q77-A81 WeakPolarHBondContact O-CB 3.41Å; Q77-A81 PolarHBondContact O-N 3.47Å; A81-L85 VanDerWaalsContact O-CB 3.29Å; A81-L85 WeakPolarHBondContact O-CB 3.47Å; A81-L85 PolarHBondContact O-N 3.02Å
82T98.3Very high96.5Very high26 Ų2643.2 Ų43.216%0.1624%0.238CC..Hα-helixtrans-68.8-38.8-178.551.50000112.3A78 V79 Q80 L85 A86 C123 I126 S127A78-T82 WeakPolarHBondContact O-CB 3.26Å; A78-T82 VanDerWaalsContact O-CG2 3.26Å; A78-T82 WeakPolarHBondContact O-CG2 3.4Å; A78-T82 PolarHBondContact O-N 3.16Å; A78-T82 PolarHBondContact O-OG1 3.01Å; V79-T82 PolarHBondContact O-OG1 2.94Å; V79-T82 VanDerWaalsContact O-OG1 3.07Å; Q80-T82 PolarHBondContact O-N 3.38Å; T82-L85 PolarHBondContact O-N 3.16Å; T82-A86 WeakPolarHBondContact O-CB 3.35Å; T82-A86 PolarHBondContact O-N 3.14Å; T82-C123 WeakPolarHBondContact O-CB 3.43Å; T82-I126 HydrophobicContact CG2-CG2 4.02Å; T82-S127 WeakPolarHBondContact OG1-CA 3.17Å; T82-S127 VanDerWaalsContact OG1-CB 3.27Å; T82-S127 WeakPolarHBondContact OG1-CB 3.33Å
83I98Very high96.9Very high0 Ų037.1 Ų37.10%021%0.209CC..Hα-helixtrans-72.7-36.2178-152.8169000112.5A33 T34 W39 L54 V79 Q80 L85 A86 T87A33-I83 HydrophobicContact CB-CD1 4.19Å; T34-I83 HydrophobicContact CG2-CG2 4.25Å; W39-I83 HydrophobicContact CH2-CD1 3.87Å; W39-I83 HydrophobicContact CZ2-CD1 3.43Å; W39-I83 VanDerWaalsContact CZ2-CD1 3.43Å; L54-I83 HydrophobicContact CD1-CD1 4.25Å; L54-I83 HydrophobicContact CD1-CG2 3.67Å; V79-I83 WeakPolarHBondContact O-CB 3.29Å; V79-I83 WeakPolarHBondContact O-CG2 3.45Å; V79-I83 PolarHBondContact O-N 3.39Å; Q80-I83 WeakPolarHBondContact O-CG2 3.25Å; I83-L85 VanDerWaalsContact C-N 3.34Å; I83-A86 WeakPolarHBondContact O-CB 3.46Å; I83-A86 PolarHBondContact O-N 3.5Å; I83-T87 PolarHBondContact O-N 2.95Å; I83-T87 PolarHBondContact O-OG1 3.25Å; I83-T87 VanDerWaalsContact O-OG1 3.13Å
84I98.3Very high97.1Very high72 Ų7240.1 Ų40.137%0.36922%0.222SC..Hα-helixtrans-60.4-48.3171.1-72.2168.9000109.8W55 Q80 A86 T87 I88W55-I84 HydrophobicContact CH2-CD1 3.5Å; W55-I84 HydrophobicContact CH2-CG1 4.07Å; W55-I84 HydrophobicContact CZ2-CD1 4.13Å; W55-I84 HydrophobicContact CZ2-CG1 4.26Å; W55-I84 HydrophobicContact CZ3-CD1 4.4Å; Q80-I84 WeakPolarHBondContact O-CB 3.4Å; Q80-I84 VanDerWaalsContact O-CG1 3.27Å; Q80-I84 WeakPolarHBondContact O-CG1 3.37Å; Q80-I84 PolarHBondContact O-N 3.34Å; I84-A86 VanDerWaalsContact C-N 3.3Å; I84-A86 PolarHBondContact O-N 3.46Å; I84-T87 PolarHBondContact O-N 3.4Å; I84-I88 HydrophobicContact CG2-CD1 3.72Å; I84-I88 HydrophobicContact CG2-CG1 4.39Å; I84-I88 WeakPolarHBondContact O-CG1 3.23Å; I84-I88 PolarHBondContact O-N 3.08Å
85L98.6Very high97.1Very high80 Ų8043 Ų4342%0.41923%0.23SC..Hα-helixtrans-60.8-41.3179-17760000111.2A81 T82 I83 T87 I88 L89A81-L85 VanDerWaalsContact O-CB 3.29Å; A81-L85 WeakPolarHBondContact O-CB 3.47Å; A81-L85 PolarHBondContact O-N 3.02Å; T82-L85 PolarHBondContact O-N 3.16Å; I83-L85 VanDerWaalsContact C-N 3.34Å; L85-T87 PolarHBondContact O-N 3.4Å; L85-I88 PolarHBondContact O-N 2.9Å; L85-L89 HydrophobicContact CD1-CD1 4.04Å; L85-L89 HydrophobicContact CD1-CG 4.02Å; L85-L89 HydrophobicContact CG-CD1 3.83Å; L85-L89 HydrophobicContact CG-CG 4.27Å; L85-L89 WeakPolarHBondContact O-CB 3.37Å; L85-L89 WeakPolarHBondContact O-CG 3.29Å; L85-L89 PolarHBondContact O-N 3.32Å
86A98.6Very high96.9Very high0 Ų039.6 Ų39.60%022%0.219CC..Hα-helixtrans-57.9-47.8174.500000112.1T82 I83 I84 L89 C90 C123 V124T82-A86 WeakPolarHBondContact O-CB 3.35Å; T82-A86 PolarHBondContact O-N 3.14Å; I83-A86 WeakPolarHBondContact O-CB 3.46Å; I83-A86 PolarHBondContact O-N 3.5Å; I84-A86 VanDerWaalsContact C-N 3.3Å; I84-A86 PolarHBondContact O-N 3.46Å; A86-L89 PolarHBondContact O-N 3.18Å; A86-C90 VanDerWaalsContact O-CB 3.3Å; A86-C90 WeakPolarHBondContact O-CB 3.31Å; A86-C90 PolarHBondContact O-N 2.91Å; A86-C123 HydrophobicContact CB-CB 3.72Å; A86-V124 HydrophobicContact CB-CG2 3.64Å
87T98.3Very high96.6Very high13 Ų1339.6 Ų39.68%0.0822%0.219CC..Hα-helixtrans-61.6-45.8178.1-57.80000111.4F31 I83 I84 L85 C90 C91F31-T87 HydrophobicContact CD1-CG2 4.15Å; F31-T87 HydrophobicContact CD2-CG2 4.41Å; F31-T87 HydrophobicContact CE1-CG2 3.81Å; F31-T87 HydrophobicContact CE2-CG2 4.08Å; F31-T87 HydrophobicContact CG-CG2 4.43Å; F31-T87 HydrophobicContact CZ-CG2 3.77Å; I83-T87 PolarHBondContact O-N 2.95Å; I83-T87 PolarHBondContact O-OG1 3.25Å; I83-T87 VanDerWaalsContact O-OG1 3.13Å; I84-T87 PolarHBondContact O-N 3.4Å; L85-T87 PolarHBondContact O-N 3.4Å; T87-C90 PolarHBondContact O-N 3.4Å; T87-C91 PolarHBondContact O-N 3.47Å; T87-C91 PolarHBondContact O-SG 2.93Å; T87-C91 VanDerWaalsContact O-SG 3.35Å
88I98.4Very high96.2Very high93 Ų9338.6 Ų38.648%0.47722%0.215SC..Hα-helixtrans-60.7-50.4177.7-67.9169.6000110.6I84 L85 C90 C91 V92I84-I88 HydrophobicContact CG2-CD1 3.72Å; I84-I88 HydrophobicContact CG2-CG1 4.39Å; I84-I88 WeakPolarHBondContact O-CG1 3.23Å; I84-I88 PolarHBondContact O-N 3.08Å; L85-I88 PolarHBondContact O-N 2.9Å; I88-C90 VanDerWaalsContact C-N 3.32Å; I88-C90 PolarHBondContact O-N 3.47Å; I88-C91 PolarHBondContact O-N 3.06Å; I88-V92 HydrophobicContact CG2-CG2 4.25Å; I88-V92 WeakPolarHBondContact O-CG2 3.38Å; I88-V92 PolarHBondContact O-N 2.93Å
89L98.4Very high95.8Very high27 Ų2741.1 Ų41.114%0.14122%0.223CC..Hα-helixtrans-62.5-39.2-179.6-69.2172.5000111.7L85 A86 V92 S93 I116 L119 A120L85-L89 HydrophobicContact CD1-CD1 4.04Å; L85-L89 HydrophobicContact CD1-CG 4.02Å; L85-L89 HydrophobicContact CG-CD1 3.83Å; L85-L89 HydrophobicContact CG-CG 4.27Å; L85-L89 WeakPolarHBondContact O-CB 3.37Å; L85-L89 WeakPolarHBondContact O-CG 3.29Å; L85-L89 PolarHBondContact O-N 3.32Å; A86-L89 PolarHBondContact O-N 3.18Å; L89-V92 PolarHBondContact O-N 3.34Å; L89-S93 VanDerWaalsContact O-CB 3.31Å; L89-S93 WeakPolarHBondContact O-CB 3.43Å; L89-S93 PolarHBondContact O-N 3.16Å; L89-I116 HydrophobicContact CB-CG2 4Å; L89-I116 HydrophobicContact CD2-CG2 3.97Å; L89-I116 VanDerWaalsContact O-CG2 3.22Å; L89-I116 WeakPolarHBondContact O-CG2 3.45Å; L89-L119 HydrophobicContact CD1-CB 4.19Å; L89-L119 HydrophobicContact CD1-CD2 3.77Å; L89-L119 HydrophobicContact CD1-CG 3.67Å; L89-L119 HydrophobicContact CD2-CD2 4.48Å; L89-A120 HydrophobicContact CB-CB 3.74Å
90C98.1Very high95.2Very high1 Ų142.1 Ų42.11%0.00723%0.227CC..Hα-helixtrans-61.2-44.8174.7-171.90000111.4H23 L30 A86 T87 I88 S93 F94 A120H23-C90 PolarHBondContact NE2-O 2.99Å; L30-C90 HydrophobicContact CD1-CB 3.76Å; A86-C90 VanDerWaalsContact O-CB 3.3Å; A86-C90 WeakPolarHBondContact O-CB 3.31Å; A86-C90 PolarHBondContact O-N 2.91Å; T87-C90 PolarHBondContact O-N 3.4Å; I88-C90 VanDerWaalsContact C-N 3.32Å; I88-C90 PolarHBondContact O-N 3.47Å; C90-S93 PolarHBondContact O-N 3.13Å; C90-F94 PolarHBondContact O-N 3.36Å; C90-A120 HydrophobicContact CB-CB 4.36Å
91C97.3Very high94.4Very high50 Ų5044 Ų4434%0.33824%0.237SC..Hα-helixtrans-64.6-44.1176-70.70000112.6T87 I88 F94 F95T87-C91 PolarHBondContact O-N 3.47Å; T87-C91 PolarHBondContact O-SG 2.93Å; T87-C91 VanDerWaalsContact O-SG 3.35Å; I88-C91 PolarHBondContact O-N 3.06Å; C91-F94 WeakPolarHBondContact O-CB 3.39Å; C91-F94 PolarHBondContact O-N 3.14Å; C91-F95 PolarHBondContact O-N 2.78Å
92V96.8Very high93.5Very high62 Ų6249 Ų4938%0.37625%0.249SC..Hα-helixtrans-62.1-45.2176.8171.20000110.6I88 L89 F94 F95 V96 I116I88-V92 HydrophobicContact CG2-CG2 4.25Å; I88-V92 WeakPolarHBondContact O-CG2 3.38Å; I88-V92 PolarHBondContact O-N 2.93Å; L89-V92 PolarHBondContact O-N 3.34Å; V92-F94 VanDerWaalsContact C-N 3.3Å; V92-F94 PolarHBondContact O-N 3.41Å; V92-F95 PolarHBondContact O-N 2.91Å; V92-V96 HydrophobicContact CG1-CG2 4.25Å; V92-V96 WeakPolarHBondContact O-CB 3.43Å; V92-V96 VanDerWaalsContact O-CG2 3.29Å; V92-V96 WeakPolarHBondContact O-CG2 3.49Å; V92-V96 PolarHBondContact O-N 3.4Å; V92-I116 HydrophobicContact CG1-CD1 4.24Å
93S95.5Very high92.1Very high0 Ų050.3 Ų50.30%026%0.259CS..Hα-helixtrans-59.4-42.5176.4-174.90000111.3H23 L89 C90 V96 F97 T113H23-S93 PolarHBondContact CE1-OG 3.39Å; L89-S93 VanDerWaalsContact O-CB 3.31Å; L89-S93 WeakPolarHBondContact O-CB 3.43Å; L89-S93 PolarHBondContact O-N 3.16Å; C90-S93 PolarHBondContact O-N 3.13Å; S93-V96 PolarHBondContact O-N 3.25Å; S93-F97 VanDerWaalsContact O-CB 3.3Å; S93-F97 WeakPolarHBondContact O-CB 3.32Å; S93-F97 PolarHBondContact O-N 3.3Å; S93-T113 VanDerWaalsContact OG-CG2 3.29Å; S93-T113 WeakPolarHBondContact OG-CG2 3.46Å; S93-T113 PolarHBondContact OG-O 2.95Å
94F93.6Very high90.2Very high65 Ų6557.3 Ų57.329%0.28530%0.295SS..Hα-helixtrans-61.4-47.3176.3-172.3-114.6000112.1H23 C90 C91 V92 F97 M98H23-F94 HydrophobicContact CB-CD2 4.15Å; H23-F94 AromaticContact CD2-CD2 3.63Å; H23-F94 AromaticContact CD2-CG 3.95Å; H23-F94 AromaticContact CG-CD2 3.9Å; H23-F94 WeakPolarHBondContact NE2-CB 3.26Å; H23-F94 PolarHBondContact NE2-N 2.87Å; C90-F94 PolarHBondContact O-N 3.36Å; C91-F94 WeakPolarHBondContact O-CB 3.39Å; C91-F94 PolarHBondContact O-N 3.14Å; V92-F94 VanDerWaalsContact C-N 3.3Å; V92-F94 PolarHBondContact O-N 3.41Å; F94-F97 WeakPolarHBondContact O-CB 3.49Å; F94-F97 PolarHBondContact O-N 2.98Å; F94-M98 HydrophobicContact CD1-CG 4.42Å; F94-M98 HydrophobicContact CD2-CE 4.26Å; F94-M98 HydrophobicContact CE1-CG 4.11Å; F94-M98 HydrophobicContact CE2-CE 3.66Å; F94-M98 HydrophobicContact CE2-SD 4.43Å; F94-M98 HydrophobicContact CZ-CE 3.91Å; F94-M98 HydrophobicContact CZ-CG 4.17Å; F94-M98 HydrophobicContact CZ-SD 4.08Å; F94-M98 WeakPolarHBondContact O-CG 3.39Å; F94-M98 PolarHBondContact O-N 3.47Å
95F93.1Very high88.2Confident131 Ų13160.8 Ų60.858%0.57531%0.309SS*.Hα-helixtrans-62.5-47.2179.7178.3-103.9000111.8C91 V92 F97 M98 L99C91-F95 PolarHBondContact O-N 2.78Å; V92-F95 PolarHBondContact O-N 2.91Å; F95-F97 VanDerWaalsContact C-N 3.27Å; F95-F97 PolarHBondContact O-N 2.88Å; F95-M98 PolarHBondContact O-N 3.42Å; F95-L99 HydrophobicContact CD1-CD1 4.01Å; F95-L99 HydrophobicContact CD1-CG 4.49Å; F95-L99 HydrophobicContact CE1-CD1 3.44Å; F95-L99 VanDerWaalsContact CE1-CD1 3.44Å; F95-L99 HydrophobicContact CE1-CG 4.11Å; F95-L99 HydrophobicContact CZ-CD1 3.83Å; F95-L99 HydrophobicContact CZ-CD2 4.21Å; F95-L99 HydrophobicContact CZ-CG 4.15Å; F95-L99 WeakPolarHBondContact O-CG 3.39Å; F95-L99 PolarHBondContact O-N 3.5Å
96V91.7Very high86.4Confident26 Ų2661.7 Ų61.716%0.15831%0.311CS..Hα-helixtrans-59.4-41.6176.1171.30000110.8V92 S93 L99 Q100 F112 T113V92-V96 HydrophobicContact CG1-CG2 4.25Å; V92-V96 WeakPolarHBondContact O-CB 3.43Å; V92-V96 VanDerWaalsContact O-CG2 3.29Å; V92-V96 WeakPolarHBondContact O-CG2 3.49Å; V92-V96 PolarHBondContact O-N 3.4Å; S93-V96 PolarHBondContact O-N 3.25Å; V96-L99 PolarHBondContact O-N 2.61Å; V96-Q100 VanDerWaalsContact O-CG 3.26Å; V96-Q100 WeakPolarHBondContact O-CG 3.47Å; V96-Q100 PolarHBondContact O-N 3.3Å; V96-F112 HydrophobicContact CG1-CD1 4.03Å; V96-F112 HydrophobicContact CG1-CE1 4.39Å; V96-F112 HydrophobicContact CG2-CE1 4.39Å; V96-T113 WeakPolarHBondContact CG1-OG1 3.45Å
97F89.1Confident84.3Confident0 Ų063.2 Ų63.20%033%0.328CS..Hα-helixtrans-60.6-45.7175.4176.3-130000112.4L16 I19 I20 S93 F94 F95 L99 Q100 L101 F110 T113 Y169L16-F97 HydrophobicContact CD1-CE1 4.23Å; L16-F97 HydrophobicContact CD1-CE2 4.18Å; L16-F97 HydrophobicContact CD1-CZ 3.39Å; I19-F97 HydrophobicContact CB-CZ 4.37Å; I19-F97 HydrophobicContact CG2-CD1 4.28Å; I19-F97 HydrophobicContact CG2-CE1 3.58Å; I19-F97 HydrophobicContact CG2-CE2 4.28Å; I19-F97 HydrophobicContact CG2-CZ 3.54Å; I20-F97 HydrophobicContact CG1-CE1 3.72Å; I20-F97 HydrophobicContact CG1-CZ 4.39Å; S93-F97 VanDerWaalsContact O-CB 3.3Å; S93-F97 WeakPolarHBondContact O-CB 3.32Å; S93-F97 PolarHBondContact O-N 3.3Å; F94-F97 WeakPolarHBondContact O-CB 3.49Å; F94-F97 PolarHBondContact O-N 2.98Å; F95-F97 VanDerWaalsContact C-N 3.27Å; F95-F97 PolarHBondContact O-N 2.88Å; F97-L99 VanDerWaalsContact C-N 3.33Å; F97-L99 PolarHBondContact O-N 3.36Å; F97-Q100 WeakPolarHBondContact O-CB 3.49Å; F97-Q100 PolarHBondContact O-N 2.9Å; F97-Q100 VanDerWaalsContact O-N 3.08Å; F97-L101 HydrophobicContact CD1-CD1 4.43Å; F97-L101 HydrophobicContact CD2-CG 4.34Å; F97-L101 HydrophobicContact CE1-CD1 3.99Å; F97-L101 HydrophobicContact CE2-CD1 4.36Å; F97-L101 HydrophobicContact CE2-CD2 3.78Å; F97-L101 HydrophobicContact CE2-CG 4.02Å; F97-L101 HydrophobicContact CZ-CD1 3.99Å; F97-L101 HydrophobicContact CZ-CD2 3.94Å; F97-L101 HydrophobicContact CZ-CG 4.14Å; F97-L101 WeakPolarHBondContact O-CG 3.42Å; F97-L101 PolarHBondContact O-N 3.19Å; F97-F110 HydrophobicContact CD2-CD1 4.34Å; F97-F110 AromaticContact CD2-CE1 3.96Å; F97-F110 HydrophobicContact CD2-CE1 3.96Å; F97-F110 HydrophobicContact CE2-CD1 4.44Å; F97-F110 AromaticContact CE2-CE1 3.87Å; F97-F110 HydrophobicContact CE2-CE1 3.87Å; F97-T113 HydrophobicContact CB-CG2 3.81Å; F97-Y169 HydrophobicContact CB-CE1 4.15Å; F97-Y169 HydrophobicContact CD1-CE1 4.02Å; F97-Y169 WeakPolarHBondContact CD1-OH 3.39Å; F97-Y169 HydrophobicContact CD2-CD1 4.24Å; F97-Y169 AromaticContact CD2-CE1 3.43Å; F97-Y169 HydrophobicContact CD2-CE1 3.43Å; F97-Y169 VanDerWaalsContact CD2-CE1 3.43Å; F97-Y169 HydrophobicContact CE1-CE1 4.21Å; F97-Y169 HydrophobicContact CE2-CD1 4.32Å; F97-Y169 AromaticContact CE2-CE1 3.63Å; F97-Y169 HydrophobicContact CE2-CE1 3.63Å; F97-Y169 AromaticContact CG-CE1 3.6Å; F97-Y169 HydrophobicContact CG-CE1 3.6Å; F97-Y169 AromaticContact CG-CZ 3.98Å; F97-Y169 WeakPolarHBondContact CG-OH 3.41Å; F97-Y169 AromaticContact CZ-CE1 3.99Å; F97-Y169 HydrophobicContact CZ-CE1 3.99Å
98M88.8Confident82.5Confident46 Ų4669.1 Ų69.123%0.22735%0.354CS..Hα-helixtrans-58.3-44.4176.1-68.1-61.3106.900111.7I20 F94 F95 Q100 L101 F102I20-M98 HydrophobicContact CG1-CE 4.32Å; F94-M98 HydrophobicContact CD1-CG 4.42Å; F94-M98 HydrophobicContact CD2-CE 4.26Å; F94-M98 HydrophobicContact CE1-CG 4.11Å; F94-M98 HydrophobicContact CE2-CE 3.66Å; F94-M98 HydrophobicContact CE2-SD 4.43Å; F94-M98 HydrophobicContact CZ-CE 3.91Å; F94-M98 HydrophobicContact CZ-CG 4.17Å; F94-M98 HydrophobicContact CZ-SD 4.08Å; F94-M98 WeakPolarHBondContact O-CG 3.39Å; F94-M98 PolarHBondContact O-N 3.47Å; F95-M98 PolarHBondContact O-N 3.42Å; M98-Q100 VanDerWaalsContact C-N 3.27Å; M98-Q100 PolarHBondContact O-N 2.95Å; M98-L101 HydrophobicContact CE-CD1 3.65Å; M98-L101 PolarHBondContact O-N 3.22Å; M98-L101 VanDerWaalsContact O-N 3.16Å; M98-L101 HydrophobicContact SD-CD1 4.21Å; M98-F102 WeakPolarHBondContact O-CD2 3.27Å; M98-F102 PolarHBondContact O-N 3.26Å
99L88.1Confident80.9Confident89 Ų8969.9 Ų69.947%0.46635%0.351SS..Hα-helixtrans-61.1-35.8175.5-65.7-179.6000112.7F95 V96 F97 F102 S103F95-L99 HydrophobicContact CD1-CD1 4.01Å; F95-L99 HydrophobicContact CD1-CG 4.49Å; F95-L99 HydrophobicContact CE1-CD1 3.44Å; F95-L99 VanDerWaalsContact CE1-CD1 3.44Å; F95-L99 HydrophobicContact CE1-CG 4.11Å; F95-L99 HydrophobicContact CZ-CD1 3.83Å; F95-L99 HydrophobicContact CZ-CD2 4.21Å; F95-L99 HydrophobicContact CZ-CG 4.15Å; F95-L99 WeakPolarHBondContact O-CG 3.39Å; F95-L99 PolarHBondContact O-N 3.5Å; V96-L99 PolarHBondContact O-N 2.61Å; F97-L99 VanDerWaalsContact C-N 3.33Å; F97-L99 PolarHBondContact O-N 3.36Å; L99-F102 PolarHBondContact O-N 2.87Å; L99-S103 WeakPolarHBondContact O-CB 3.41Å; L99-S103 PolarHBondContact O-N 2.63Å; L99-S103 VanDerWaalsContact O-N 3.14Å; L99-S103 PolarHBondContact O-OG 2.67Å
100Q85.2Confident79.9Confident21 Ų2169.6 Ų69.610%0.09835%0.349CS..Hα-helixtrans-70.1-30.7176.6-71169.2-3.800112.9V96 F97 M98 F102 S103 R109 F110 T113V96-Q100 VanDerWaalsContact O-CG 3.26Å; V96-Q100 WeakPolarHBondContact O-CG 3.47Å; V96-Q100 PolarHBondContact O-N 3.3Å; F97-Q100 WeakPolarHBondContact O-CB 3.49Å; F97-Q100 PolarHBondContact O-N 2.9Å; F97-Q100 VanDerWaalsContact O-N 3.08Å; M98-Q100 VanDerWaalsContact C-N 3.27Å; M98-Q100 PolarHBondContact O-N 2.95Å; Q100-F102 VanDerWaalsContact C-N 3.33Å; Q100-S103 PolarHBondContact O-N 3.02Å; Q100-S103 VanDerWaalsContact O-O 3.13Å; Q100-R109 HydrophobicContact CG-CB 4.1Å; Q100-R109 PolarHBondContact NE2-O 3.43Å; Q100-F110 HydrophobicContact CB-CE1 4.14Å; Q100-F110 VanDerWaalsContact OE1-CD1 3.29Å; Q100-T113 PolarHBondContact NE2-OG1 2.96Å; Q100-T113 PolarHBondContact OE1-OG1 3.4Å
101L81.1Confident79.2Confident62 Ų6272.4 Ų72.433%0.32536%0.363SS..Hα-helixtrans-65.9-35.7175.9-68.5177.5000112.4L16 I20 F97 M98L16-L101 HydrophobicContact CD1-CD1 4.23Å; L16-L101 HydrophobicContact CD1-CD2 3.58Å; L16-L101 HydrophobicContact CD2-CD2 4.21Å; I20-L101 HydrophobicContact CD1-CD1 4.5Å; F97-L101 HydrophobicContact CD1-CD1 4.43Å; F97-L101 HydrophobicContact CD2-CG 4.34Å; F97-L101 HydrophobicContact CE1-CD1 3.99Å; F97-L101 HydrophobicContact CE2-CD1 4.36Å; F97-L101 HydrophobicContact CE2-CD2 3.78Å; F97-L101 HydrophobicContact CE2-CG 4.02Å; F97-L101 HydrophobicContact CZ-CD1 3.99Å; F97-L101 HydrophobicContact CZ-CD2 3.94Å; F97-L101 HydrophobicContact CZ-CG 4.14Å; F97-L101 WeakPolarHBondContact O-CG 3.42Å; F97-L101 PolarHBondContact O-N 3.19Å; M98-L101 HydrophobicContact CE-CD1 3.65Å; M98-L101 PolarHBondContact O-N 3.22Å; M98-L101 VanDerWaalsContact O-N 3.16Å; M98-L101 HydrophobicContact SD-CD1 4.21Å
102F78Confident78.8Confident166 Ų16676.1 Ų76.173%0.72837%0.374SS*.Hα-helixtrans-81.7-25.7176.5-60.1-64.6000113M98 L99 Q100 I104M98-F102 WeakPolarHBondContact O-CD2 3.27Å; M98-F102 PolarHBondContact O-N 3.26Å; L99-F102 PolarHBondContact O-N 2.87Å; Q100-F102 VanDerWaalsContact C-N 3.33Å; F102-I104 PolarHBondContact O-N 3.29Å
103S69.6Low78.6Confident53 Ų5373.2 Ų73.237%0.37136%0.356SS..SBendtrans-91.693179.1-65.10000111.7L99 Q100 Q105L99-S103 WeakPolarHBondContact O-CB 3.41Å; L99-S103 PolarHBondContact O-N 2.63Å; L99-S103 VanDerWaalsContact O-N 3.14Å; L99-S103 PolarHBondContact O-OG 2.67Å; Q100-S103 PolarHBondContact O-N 3.02Å; Q100-S103 VanDerWaalsContact O-O 3.13Å; S103-Q105 PolarHBondContact O-N 2.93Å
104I58.7Low78.5Confident146 Ų14673.2 Ų73.275%0.74936%0.356SS*.  trans-59.67.5-172.7-64.3171.1000116F102 Q106F102-I104 PolarHBondContact O-N 3.29Å; I104-Q106 PolarHBondContact O-N 3.48Å
105Q54.8Low78.6Confident145 Ų14572.7 Ų72.768%0.67836%0.364SS*.  trans-9185.4176.3-71.3-171.7-10.700111.8S103 G107S103-Q105 PolarHBondContact O-N 2.93Å; Q105-G107 PolarHBondContact O-N 2.88Å
106Q61Low78.8Confident99 Ų9967.4 Ų67.446%0.46334%0.341SS..  trans-84.614.6-156.5-102.5171.3-10.800118.1I104 K176I104-Q106 PolarHBondContact O-N 3.48Å; Q106-K176 WeakPolarHBondContact O-CE 3.07Å; Q106-K176 PolarHBondContact O-NZ 2.79Å
107G55Low79Confident33 Ų3366.2 Ų66.234%0.3433%0.334SS..SBendtrans-86.7-58-165.500000116.6Q105Q105-G107 PolarHBondContact O-N 2.88Å
108E59.4Low79.4Confident136 Ų13668.4 Ų68.464%0.63635%0.346SS*.SBendtrans-121.1-11.4-164-60.8-139.6112.100114.6F110 I111 R173E108-F110 PolarHBondContact O-N 3.5Å; E108-I111 PolarHBondContact O-N 2.98Å; E108-R173 IonicContact OE1-NH2 3.46Å; E108-R173 PolarHBondContact OE1-NH2 2.88Å
109R65.3Low79.9Confident109 Ų10970.1 Ų70.141%0.41136%0.355SS..THydrogen-bonded Turntrans-70.3-28.8-168.3-62-178.4-179-178.12.1114Q100 I111 F112Q100-R109 HydrophobicContact CG-CB 4.1Å; Q100-R109 PolarHBondContact NE2-O 3.43Å; R109-I111 PolarHBondContact O-N 3.25Å; R109-F112 PolarHBondContact O-N 3.29Å
110F76.9Confident80.4Confident21 Ų2165.9 Ų65.99%0.09233%0.333CS..Hα-helixtrans-66.5-18.6-178.4-64.1-67.4000113.8F97 Q100 E108 F112 T113 A114 Y169F97-F110 HydrophobicContact CD2-CD1 4.34Å; F97-F110 AromaticContact CD2-CE1 3.96Å; F97-F110 HydrophobicContact CD2-CE1 3.96Å; F97-F110 HydrophobicContact CE2-CD1 4.44Å; F97-F110 AromaticContact CE2-CE1 3.87Å; F97-F110 HydrophobicContact CE2-CE1 3.87Å; Q100-F110 HydrophobicContact CB-CE1 4.14Å; Q100-F110 VanDerWaalsContact OE1-CD1 3.29Å; E108-F110 PolarHBondContact O-N 3.5Å; F110-F112 VanDerWaalsContact C-N 3.33Å; F110-F112 PolarHBondContact O-N 3.47Å; F110-T113 PolarHBondContact O-N 2.93Å; F110-A114 VanDerWaalsContact O-CB 3.26Å; F110-A114 WeakPolarHBondContact O-CB 3.31Å; F110-A114 PolarHBondContact O-N 3.45Å; F110-Y169 HydrophobicContact CD1-CD1 4.48Å
111I85.1Confident81Confident60 Ų6065 Ų6531%0.30833%0.329SS..Hα-helixtrans-64.8-40.2176.1-56.3169.6000110.6E108 R109 A114 A115E108-I111 PolarHBondContact O-N 2.98Å; R109-I111 PolarHBondContact O-N 3.25Å; I111-A114 PolarHBondContact O-N 2.94Å; I111-A115 WeakPolarHBondContact O-CB 3.3Å; I111-A115 PolarHBondContact O-N 2.89Å
112F88.3Confident81.8Confident129 Ų12965.6 Ų65.657%0.56633%0.332SS*.Hα-helixtrans-64.5-47.2179.9-177.7-110.7000111V96 R109 F110 A114 A115 I116V96-F112 HydrophobicContact CG1-CD1 4.03Å; V96-F112 HydrophobicContact CG1-CE1 4.39Å; V96-F112 HydrophobicContact CG2-CE1 4.39Å; R109-F112 PolarHBondContact O-N 3.29Å; F110-F112 VanDerWaalsContact C-N 3.33Å; F110-F112 PolarHBondContact O-N 3.47Å; F112-A114 VanDerWaalsContact C-N 3.35Å; F112-A114 PolarHBondContact O-N 3.45Å; F112-A115 PolarHBondContact O-N 3.37Å; F112-I116 HydrophobicContact CD1-CD1 3.91Å; F112-I116 HydrophobicContact CE1-CD1 3.47Å; F112-I116 VanDerWaalsContact CE1-CD1 3.47Å; F112-I116 HydrophobicContact CE2-CD1 4.15Å; F112-I116 HydrophobicContact CG-CD1 4.42Å; F112-I116 HydrophobicContact CZ-CD1 3.61Å; F112-I116 WeakPolarHBondContact O-CG1 3.22Å; F112-I116 PolarHBondContact O-N 3.41Å
113T92.7Very high82.8Confident0 Ų058.1 Ų58.10%030%0.3CS..Hα-helixtrans-58.4-45.2173.6-52.50000111.9S93 V96 F97 Q100 F110 I116 Q117 Y169S93-T113 VanDerWaalsContact OG-CG2 3.29Å; S93-T113 WeakPolarHBondContact OG-CG2 3.46Å; S93-T113 PolarHBondContact OG-O 2.95Å; V96-T113 WeakPolarHBondContact CG1-OG1 3.45Å; F97-T113 HydrophobicContact CB-CG2 3.81Å; Q100-T113 PolarHBondContact NE2-OG1 2.96Å; Q100-T113 PolarHBondContact OE1-OG1 3.4Å; F110-T113 PolarHBondContact O-N 2.93Å; T113-I116 PolarHBondContact O-N 3.43Å; T113-Q117 WeakPolarHBondContact O-CB 3.48Å; T113-Q117 PolarHBondContact O-N 3.27Å; T113-Y169 HydrophobicContact CG2-CD1 4Å; T113-Y169 HydrophobicContact CG2-CD2 4.11Å; T113-Y169 HydrophobicContact CG2-CE1 3.74Å; T113-Y169 HydrophobicContact CG2-CE2 3.86Å; T113-Y169 HydrophobicContact CG2-CG 4.19Å
114A93.3Very high84.2Confident1 Ų155.7 Ų55.71%0.00828%0.283CS..Hα-helixtrans-61.1-45.9176.900000111.8F110 I111 F112 I116 Q117 L118 L170F110-A114 VanDerWaalsContact O-CB 3.26Å; F110-A114 WeakPolarHBondContact O-CB 3.31Å; F110-A114 PolarHBondContact O-N 3.45Å; I111-A114 PolarHBondContact O-N 2.94Å; F112-A114 VanDerWaalsContact C-N 3.35Å; F112-A114 PolarHBondContact O-N 3.45Å; A114-I116 PolarHBondContact O-N 3.04Å; A114-Q117 PolarHBondContact O-N 3.14Å; A114-L118 WeakPolarHBondContact O-CB 3.22Å; A114-L118 VanDerWaalsContact O-CG 3.24Å; A114-L118 WeakPolarHBondContact O-CG 3.37Å; A114-L118 PolarHBondContact O-N 3.41Å; A114-L170 HydrophobicContact CB-CD2 3.55Å; A114-L170 HydrophobicContact CB-CG 3.83Å
115A95.1Very high86.1Confident54 Ų5451.8 Ų51.845%0.44626%0.263SS..Hα-helixtrans-61.7-45.3-179.900000111.6I111 F112 Q117 L118 L119I111-A115 WeakPolarHBondContact O-CB 3.3Å; I111-A115 PolarHBondContact O-N 2.89Å; F112-A115 PolarHBondContact O-N 3.37Å; A115-Q117 VanDerWaalsContact C-N 3.33Å; A115-Q117 PolarHBondContact O-N 3.02Å; A115-L118 PolarHBondContact O-N 2.84Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 PolarHBondContact O-N 3.39Å
116I96.9Very high88.2Confident20 Ų2048 Ų4810%0.10325%0.247CC..Hα-helixtrans-61.6-43.2175.6-64170.3000110.6L89 V92 F112 T113 A114 L119 A120L89-I116 HydrophobicContact CB-CG2 4Å; L89-I116 HydrophobicContact CD2-CG2 3.97Å; L89-I116 VanDerWaalsContact O-CG2 3.22Å; L89-I116 WeakPolarHBondContact O-CG2 3.45Å; V92-I116 HydrophobicContact CG1-CD1 4.24Å; F112-I116 HydrophobicContact CD1-CD1 3.91Å; F112-I116 HydrophobicContact CE1-CD1 3.47Å; F112-I116 VanDerWaalsContact CE1-CD1 3.47Å; F112-I116 HydrophobicContact CE2-CD1 4.15Å; F112-I116 HydrophobicContact CG-CD1 4.42Å; F112-I116 HydrophobicContact CZ-CD1 3.61Å; F112-I116 WeakPolarHBondContact O-CG1 3.22Å; F112-I116 PolarHBondContact O-N 3.41Å; T113-I116 PolarHBondContact O-N 3.43Å; A114-I116 PolarHBondContact O-N 3.04Å; I116-L119 PolarHBondContact O-N 2.86Å; I116-A120 PolarHBondContact O-N 2.97Å
117Q97.1Very high90Very high0 Ų043.4 Ų43.40%023%0.225CC..Hα-helixtrans-67.8-38.8-179.6-168.864.15.200112.5H23 T113 A114 A115 A120 S121 Y169H23-Q117 PolarHBondContact CE1-OE1 3.41Å; H23-Q117 PolarHBondContact NE2-OE1 3.47Å; T113-Q117 WeakPolarHBondContact O-CB 3.48Å; T113-Q117 PolarHBondContact O-N 3.27Å; A114-Q117 PolarHBondContact O-N 3.14Å; A115-Q117 VanDerWaalsContact C-N 3.33Å; A115-Q117 PolarHBondContact O-N 3.02Å; Q117-A120 WeakPolarHBondContact O-CB 3.42Å; Q117-A120 PolarHBondContact O-N 3.26Å; Q117-S121 PolarHBondContact O-N 2.82Å; Q117-Y169 HydrophobicContact CB-CD2 4.31Å; Q117-Y169 HydrophobicContact CB-CE2 4.26Å; Q117-Y169 HydrophobicContact CG-CD2 4.48Å; Q117-Y169 HydrophobicContact CG-CE2 4.21Å
118L97.6Very high92Very high47 Ų4741.8 Ų41.825%0.24621%0.209CC..Hα-helixtrans-67.5-36.8174.6-70171.8000111.5A114 A115 S121 L122 L163 L170A114-L118 WeakPolarHBondContact O-CB 3.22Å; A114-L118 VanDerWaalsContact O-CG 3.24Å; A114-L118 WeakPolarHBondContact O-CG 3.37Å; A114-L118 PolarHBondContact O-N 3.41Å; A115-L118 PolarHBondContact O-N 2.84Å; L118-S121 WeakPolarHBondContact O-CB 3.15Å; L118-S121 PolarHBondContact O-N 2.91Å; L118-L122 PolarHBondContact O-N 3.31Å; L118-L163 HydrophobicContact CD2-CD1 3.78Å; L118-L170 HydrophobicContact CD1-CD1 4.27Å
119L98.4Very high93.9Very high82 Ų8237.8 Ų37.843%0.42920%0.195SC..Hα-helixtrans-65.4-41.6172.9-175.161.7000111.4L89 A115 I116 S121 L122 C123L89-L119 HydrophobicContact CD1-CB 4.19Å; L89-L119 HydrophobicContact CD1-CD2 3.77Å; L89-L119 HydrophobicContact CD1-CG 3.67Å; L89-L119 HydrophobicContact CD2-CD2 4.48Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 PolarHBondContact O-N 3.39Å; I116-L119 PolarHBondContact O-N 2.86Å; L119-S121 VanDerWaalsContact C-N 3.31Å; L119-S121 PolarHBondContact O-N 3.05Å; L119-L122 HydrophobicContact CD1-CD2 4.31Å; L119-L122 WeakPolarHBondContact O-CB 3.32Å; L119-L122 PolarHBondContact O-N 2.97Å; L119-C123 PolarHBondContact O-N 3.43Å; L119-C123 PolarHBondContact O-SG 3.07Å
120A98.4Very high95.4Very high0 Ų034.6 Ų34.60%019%0.186CC..Hα-helixtrans-56.3-48.3172.100000110.7L89 C90 I116 Q117 L122 C123 V124L89-A120 HydrophobicContact CB-CB 3.74Å; C90-A120 HydrophobicContact CB-CB 4.36Å; I116-A120 PolarHBondContact O-N 2.97Å; Q117-A120 WeakPolarHBondContact O-CB 3.42Å; Q117-A120 PolarHBondContact O-N 3.26Å; A120-L122 PolarHBondContact O-N 3.2Å; A120-C123 WeakPolarHBondContact O-CB 3.46Å; A120-C123 PolarHBondContact O-N 3.01Å; A120-C123 VanDerWaalsContact O-N 3.14Å; A120-V124 WeakPolarHBondContact O-CG2 3.46Å; A120-V124 PolarHBondContact O-N 3.15Å
121S98.6Very high96.4Very high1 Ų133.6 Ų33.61%0.00718%0.182CC..Hα-helixtrans-58.5-43.1177.2-172.80000113.1Q117 L118 L119 C123 V124 M125 F159 T162 L163Q117-S121 PolarHBondContact O-N 2.82Å; L118-S121 WeakPolarHBondContact O-CB 3.15Å; L118-S121 PolarHBondContact O-N 2.91Å; L119-S121 VanDerWaalsContact C-N 3.31Å; L119-S121 PolarHBondContact O-N 3.05Å; S121-C123 VanDerWaalsContact C-N 3.35Å; S121-C123 PolarHBondContact O-N 3.26Å; S121-V124 PolarHBondContact O-N 3.33Å; S121-M125 PolarHBondContact O-N 2.88Å; S121-F159 VanDerWaalsContact OG-CD2 3.3Å; S121-F159 WeakPolarHBondContact OG-CD2 3.42Å; S121-F159 WeakPolarHBondContact OG-CE2 3.39Å; S121-F159 PolarHBondContact OG-O 3Å; S121-T162 WeakPolarHBondContact CA-OG1 3.47Å; S121-T162 VanDerWaalsContact CB-OG1 3.25Å; S121-T162 WeakPolarHBondContact CB-OG1 3.04Å; S121-T162 PolarHBondContact OG-OG1 2.81Å; S121-L163 WeakPolarHBondContact OG-CA 3.49Å; S121-L163 WeakPolarHBondContact OG-CB 3.31Å; S121-L163 PolarHBondContact OG-N 3.23Å
122L98.6Very high97Very high76 Ų7633 Ų3340%0.39818%0.181SC..Hα-helixtrans-60.3-44.1174.5176.760.1000111.5L118 L119 A120 V124 M125 I126L118-L122 PolarHBondContact O-N 3.31Å; L119-L122 HydrophobicContact CD1-CD2 4.31Å; L119-L122 WeakPolarHBondContact O-CB 3.32Å; L119-L122 PolarHBondContact O-N 2.97Å; A120-L122 PolarHBondContact O-N 3.2Å; L122-V124 VanDerWaalsContact C-N 3.35Å; L122-V124 PolarHBondContact O-N 3.44Å; L122-M125 HydrophobicContact CD1-CE 3.53Å; L122-M125 PolarHBondContact O-N 2.83Å; L122-I126 HydrophobicContact CD1-CD1 3.92Å; L122-I126 HydrophobicContact CD1-CG1 4.17Å; L122-I126 HydrophobicContact CG-CD1 3.84Å; L122-I126 VanDerWaalsContact O-CG1 3.28Å; L122-I126 WeakPolarHBondContact O-CG1 3.35Å; L122-I126 PolarHBondContact O-N 3.39Å
123C98.7Very high97.4Very high9 Ų930.4 Ų30.46%0.06118%0.183CC..Hα-helixtrans-61.1-40.7176.7-68.60000112.5T82 A86 L119 A120 S121 I126 S127T82-C123 WeakPolarHBondContact O-CB 3.43Å; A86-C123 HydrophobicContact CB-CB 3.72Å; L119-C123 PolarHBondContact O-N 3.43Å; L119-C123 PolarHBondContact O-SG 3.07Å; A120-C123 WeakPolarHBondContact O-CB 3.46Å; A120-C123 PolarHBondContact O-N 3.01Å; A120-C123 VanDerWaalsContact O-N 3.14Å; S121-C123 VanDerWaalsContact C-N 3.35Å; S121-C123 PolarHBondContact O-N 3.26Å; C123-I126 PolarHBondContact O-N 2.83Å; C123-S127 WeakPolarHBondContact O-CB 3.16Å; C123-S127 PolarHBondContact O-N 2.82Å
124V98.6Very high97.5Very high1 Ų132.2 Ų32.21%0.00619%0.192CC..Hα-helixtrans-60.9-49174-178.50000111L30 A86 A120 S121 L122 I126 S127 A128 A155 S158 F159L30-V124 HydrophobicContact CD1-CG2 4.48Å; L30-V124 HydrophobicContact CD2-CG1 4.44Å; L30-V124 HydrophobicContact CD2-CG2 3.43Å; L30-V124 VanDerWaalsContact CD2-CG2 3.43Å; A86-V124 HydrophobicContact CB-CG2 3.64Å; A120-V124 WeakPolarHBondContact O-CG2 3.46Å; A120-V124 PolarHBondContact O-N 3.15Å; S121-V124 PolarHBondContact O-N 3.33Å; L122-V124 VanDerWaalsContact C-N 3.35Å; L122-V124 PolarHBondContact O-N 3.44Å; V124-I126 VanDerWaalsContact C-N 3.31Å; V124-I126 PolarHBondContact O-N 2.77Å; V124-S127 WeakPolarHBondContact O-CB 3.46Å; V124-S127 PolarHBondContact O-N 3.48Å; V124-A128 PolarHBondContact O-N 3.38Å; V124-A155 VanDerWaalsContact CG1-O 3.29Å; V124-A155 WeakPolarHBondContact CG1-O 3.33Å; V124-S158 VanDerWaalsContact CG1-OG 3.31Å; V124-S158 WeakPolarHBondContact CG1-OG 3.41Å; V124-F159 HydrophobicContact CB-CB 4.49Å; V124-F159 HydrophobicContact CG1-CB 3.94Å
125M98.5Very high97.3Very high65 Ų6532.4 Ų32.432%0.3219%0.193SC..Hα-helixtrans-59.7-43.3-179.4-175.6178.661.100111.2S121 L122 S129 F159S121-M125 PolarHBondContact O-N 2.88Å; L122-M125 HydrophobicContact CD1-CE 3.53Å; L122-M125 PolarHBondContact O-N 2.83Å; M125-S129 WeakPolarHBondContact O-CB 3.17Å; M125-S129 PolarHBondContact O-N 3.32Å; M125-S129 PolarHBondContact O-OG 3.41Å; M125-F159 HydrophobicContact CB-CD2 3.75Å; M125-F159 HydrophobicContact CB-CE2 3.82Å; M125-F159 HydrophobicContact CB-CG 4.31Å; M125-F159 HydrophobicContact CB-CZ 4.41Å; M125-F159 HydrophobicContact CG-CD2 4.41Å; M125-F159 HydrophobicContact CG-CE2 4.17Å; M125-F159 HydrophobicContact CG-CZ 4.28Å; M125-F159 HydrophobicContact SD-CE1 4.34Å; M125-F159 HydrophobicContact SD-CE2 3.87Å; M125-F159 HydrophobicContact SD-CZ 3.67Å
126I98.6Very high97Very high66 Ų6635.5 Ų35.534%0.33820%0.196SC..Hα-helixtrans-61.7-50176.3-69167000110.4T82 L122 C123 V124 A128 S129 I130T82-I126 HydrophobicContact CG2-CG2 4.02Å; L122-I126 HydrophobicContact CD1-CD1 3.92Å; L122-I126 HydrophobicContact CD1-CG1 4.17Å; L122-I126 HydrophobicContact CG-CD1 3.84Å; L122-I126 VanDerWaalsContact O-CG1 3.28Å; L122-I126 WeakPolarHBondContact O-CG1 3.35Å; L122-I126 PolarHBondContact O-N 3.39Å; C123-I126 PolarHBondContact O-N 2.83Å; V124-I126 VanDerWaalsContact C-N 3.31Å; V124-I126 PolarHBondContact O-N 2.77Å; I126-A128 PolarHBondContact O-N 3.02Å; I126-S129 PolarHBondContact O-N 2.92Å; I126-I130 HydrophobicContact CG2-CD1 3.59Å; I126-I130 HydrophobicContact CG2-CG1 4.26Å; I126-I130 WeakPolarHBondContact O-CB 3.38Å; I126-I130 VanDerWaalsContact O-CG1 3.32Å; I126-I130 WeakPolarHBondContact O-CG1 3.35Å; I126-I130 PolarHBondContact O-N 3.39Å
127S98.3Very high96.6Very high1 Ų139.5 Ų39.51%0.00722%0.218CC..Hα-helixtrans-55.4-53.4179.2-175.20000111.9V79 T82 C123 V124 S129 I130 Y131V79-S127 WeakPolarHBondContact CG1-OG 3.28Å; V79-S127 PolarHBondContact O-OG 3.44Å; V79-S127 VanDerWaalsContact O-OG 3.07Å; T82-S127 WeakPolarHBondContact OG1-CA 3.17Å; T82-S127 VanDerWaalsContact OG1-CB 3.27Å; T82-S127 WeakPolarHBondContact OG1-CB 3.33Å; C123-S127 WeakPolarHBondContact O-CB 3.16Å; C123-S127 PolarHBondContact O-N 2.82Å; V124-S127 WeakPolarHBondContact O-CB 3.46Å; V124-S127 PolarHBondContact O-N 3.48Å; S127-S129 PolarHBondContact O-N 3.24Å; S127-I130 PolarHBondContact O-N 2.69Å; S127-Y131 WeakPolarHBondContact O-CB 3.34Å; S127-Y131 PolarHBondContact O-N 3.46Å
128A98.1Very high96.2Very high0 Ų040.2 Ų40.20%022%0.221CC..Hα-helixtrans-65.5-37.8-179.300000112.2V124 I126 Y131 T132 W156V124-A128 PolarHBondContact O-N 3.38Å; I126-A128 PolarHBondContact O-N 3.02Å; A128-Y131 PolarHBondContact O-N 3.36Å; A128-T132 WeakPolarHBondContact O-CB 3.33Å; A128-T132 PolarHBondContact O-N 2.94Å; A128-T132 PolarHBondContact O-OG1 3.06Å; A128-W156 HydrophobicContact CB-CD2 3.88Å; A128-W156 HydrophobicContact CB-CE3 4.38Å; A128-W156 HydrophobicContact CB-CG 4.29Å; A128-W156 HydrophobicContact CB-CH2 4.3Å; A128-W156 HydrophobicContact CB-CZ2 3.79Å
129S98.4Very high95.8Very high51 Ų5138.3 Ų38.336%0.35721%0.211SC..Hα-helixtrans-68.3-45.4178.8-590000112.4M125 I126 S127 Y131 T132 A133M125-S129 WeakPolarHBondContact O-CB 3.17Å; M125-S129 PolarHBondContact O-N 3.32Å; M125-S129 PolarHBondContact O-OG 3.41Å; I126-S129 PolarHBondContact O-N 2.92Å; S127-S129 PolarHBondContact O-N 3.24Å; S129-Y131 VanDerWaalsContact C-N 3.35Å; S129-T132 WeakPolarHBondContact O-CB 3.25Å; S129-T132 PolarHBondContact O-N 2.9Å; S129-A133 PolarHBondContact O-N 2.86Å
130I98.2Very high95.3Very high42 Ų4235.5 Ų35.522%0.21520%0.2CC..Hα-helixtrans-61.2-46.9175.3-67.4173.1000109.4Y75 A78 V79 I126 S127 T132 A133 E134Y75-I130 HydrophobicContact CD1-CG2 4.26Å; A78-I130 HydrophobicContact CB-CD1 4.14Å; V79-I130 HydrophobicContact CG2-CB 3.89Å; V79-I130 HydrophobicContact CG2-CG2 3.64Å; I126-I130 HydrophobicContact CG2-CD1 3.59Å; I126-I130 HydrophobicContact CG2-CG1 4.26Å; I126-I130 WeakPolarHBondContact O-CB 3.38Å; I126-I130 VanDerWaalsContact O-CG1 3.32Å; I126-I130 WeakPolarHBondContact O-CG1 3.35Å; I126-I130 PolarHBondContact O-N 3.39Å; S127-I130 PolarHBondContact O-N 2.69Å; I130-T132 PolarHBondContact O-N 2.93Å; I130-A133 PolarHBondContact O-N 3Å; I130-E134 HydrophobicContact CG2-CB 4.36Å; I130-E134 HydrophobicContact CG2-CG 4.18Å; I130-E134 VanDerWaalsContact O-CB 3.27Å; I130-E134 WeakPolarHBondContact O-CB 3.27Å; I130-E134 WeakPolarHBondContact O-CG 3.46Å; I130-E134 PolarHBondContact O-N 2.83Å
131Y97.3Very high94.8Very high0 Ų041.5 Ų41.50%023%0.231CC..Hα-helixtrans-58.5-40.2177.5-163-85.1000112W39 W40 L54 V79 S127 A128 S129 S135 F138 H139 Y148 Y152W39-Y131 HydrophobicContact CB-CE1 4.26Å; W39-Y131 HydrophobicContact CB-CE2 4.22Å; W39-Y131 WeakPolarHBondContact CB-OH 3.4Å; W39-Y131 HydrophobicContact CD2-CE2 4.36Å; W39-Y131 AromaticContact CE3-CD1 3.72Å; W39-Y131 HydrophobicContact CE3-CD1 3.72Å; W39-Y131 AromaticContact CE3-CD2 3.59Å; W39-Y131 HydrophobicContact CE3-CD2 3.59Å; W39-Y131 AromaticContact CE3-CE1 3.9Å; W39-Y131 HydrophobicContact CE3-CE1 3.9Å; W39-Y131 AromaticContact CE3-CE2 3.75Å; W39-Y131 HydrophobicContact CE3-CE2 3.75Å; W39-Y131 AromaticContact CE3-CG 3.56Å; W39-Y131 HydrophobicContact CE3-CG 3.56Å; W39-Y131 AromaticContact CE3-CZ 3.92Å; W39-Y131 HydrophobicContact CZ3-CD1 4.15Å; W39-Y131 AromaticContact CZ3-CD2 3.93Å; W39-Y131 HydrophobicContact CZ3-CD2 3.93Å; W39-Y131 AromaticContact CZ3-CG 3.71Å; W39-Y131 HydrophobicContact CZ3-CG 3.71Å; W40-Y131 WeakPolarHBondContact CB-OH 3.36Å; W40-Y131 HydrophobicContact CE3-CE1 4.42Å; L54-Y131 HydrophobicContact CD2-CD2 3.83Å; L54-Y131 HydrophobicContact CD2-CE2 3.64Å; V79-Y131 HydrophobicContact CG1-CD2 4Å; V79-Y131 HydrophobicContact CG2-CD2 4.35Å; S127-Y131 WeakPolarHBondContact O-CB 3.34Å; S127-Y131 PolarHBondContact O-N 3.46Å; A128-Y131 PolarHBondContact O-N 3.36Å; S129-Y131 VanDerWaalsContact C-N 3.35Å; Y131-S135 WeakPolarHBondContact O-CA 3.47Å; Y131-S135 WeakPolarHBondContact O-CB 3.47Å; Y131-S135 PolarHBondContact O-N 2.98Å; Y131-S135 PolarHBondContact O-OG 3.01Å; Y131-F138 HydrophobicContact CD2-CE1 4.47Å; Y131-F138 AromaticContact CD2-CZ 3.7Å; Y131-F138 HydrophobicContact CD2-CZ 3.7Å; Y131-F138 AromaticContact CE2-CE2 3.97Å; Y131-F138 HydrophobicContact CE2-CE2 3.97Å; Y131-F138 AromaticContact CE2-CZ 3.46Å; Y131-F138 HydrophobicContact CE2-CZ 3.46Å; Y131-F138 VanDerWaalsContact CE2-CZ 3.46Å; Y131-F138 HydrophobicContact CG-CZ 4.5Å; Y131-H139 PolarHBondContact OH-NE2 3.33Å; Y131-Y148 HydrophobicContact CD1-CD1 4.2Å; Y131-Y148 HydrophobicContact CD1-CE1 4.01Å; Y131-Y148 HydrophobicContact CE1-CD1 4.13Å; Y131-Y148 HydrophobicContact CE1-CE1 4.2Å; Y131-Y152 AromaticContact CD1-CD2 3.71Å; Y131-Y152 HydrophobicContact CD1-CD2 3.71Å; Y131-Y152 HydrophobicContact CD1-CE2 4.05Å; Y131-Y152 HydrophobicContact CE1-CD2 4.37Å; Y131-Y152 HydrophobicContact CG-CD2 4.41Å
132T96.7Very high94.3Very high49 Ų4946.1 Ų46.130%0.30126%0.264SS..Hα-helixtrans-59.2-51.3176.6-53.50000111.1A128 S129 I130 Y148 Y152A128-T132 WeakPolarHBondContact O-CB 3.33Å; A128-T132 PolarHBondContact O-N 2.94Å; A128-T132 PolarHBondContact O-OG1 3.06Å; S129-T132 WeakPolarHBondContact O-CB 3.25Å; S129-T132 PolarHBondContact O-N 2.9Å; I130-T132 PolarHBondContact O-N 2.93Å; T132-Y148 WeakPolarHBondContact CA-OH 3.48Å; T132-Y148 PolarHBondContact O-OH 2.96Å; T132-Y152 WeakPolarHBondContact OG1-CE2 3.48Å; T132-Y152 PolarHBondContact OG1-OH 2.91Å
133A96.7Very high93.8Very high73 Ų7343.1 Ų43.160%0.60325%0.248SC*.Hα-helixtrans-71.5-36.7-176.200000113.2S129 I130S129-A133 PolarHBondContact O-N 2.86Å; I130-A133 PolarHBondContact O-N 3Å
134E94.8Very high93.4Very high39 Ų3946 Ų4618%0.18226%0.26CS..Hα-helixtrans-114.7-0.1-162-58.2-65.5149.800113.8Y75 I130 K136 N137 F138Y75-E134 HydrophobicContact CD1-CB 4.07Å; Y75-E134 HydrophobicContact CD1-CG 3.49Å; Y75-E134 VanDerWaalsContact CD1-CG 3.49Å; Y75-E134 HydrophobicContact CD2-CB 4.12Å; Y75-E134 HydrophobicContact CD2-CG 4.19Å; Y75-E134 WeakPolarHBondContact CD2-OE2 3.44Å; Y75-E134 HydrophobicContact CE1-CG 3.82Å; Y75-E134 HydrophobicContact CE2-CG 4.5Å; Y75-E134 VanDerWaalsContact CE2-OE2 3.23Å; Y75-E134 WeakPolarHBondContact CE2-OE2 3.45Å; Y75-E134 HydrophobicContact CG-CB 3.7Å; Y75-E134 HydrophobicContact CG-CG 3.66Å; I130-E134 HydrophobicContact CG2-CB 4.36Å; I130-E134 HydrophobicContact CG2-CG 4.18Å; I130-E134 VanDerWaalsContact O-CB 3.27Å; I130-E134 WeakPolarHBondContact O-CB 3.27Å; I130-E134 WeakPolarHBondContact O-CG 3.46Å; I130-E134 PolarHBondContact O-N 2.83Å; E134-K136 PolarHBondContact O-N 3.49Å; E134-N137 WeakPolarHBondContact O-CB 3.5Å; E134-N137 PolarHBondContact O-N 3.07Å; E134-N137 PolarHBondContact OE2-ND2 3.41Å; E134-F138 VanDerWaalsContact O-CD1 3.25Å; E134-F138 WeakPolarHBondContact O-CD1 3.31Å; E134-F138 WeakPolarHBondContact O-CE1 3.21Å
135S89.5Confident93.1Very high4 Ų453 Ų533%0.02830%0.297CS..Hα-helixtrans-45.5-42.7179.948.60000113.6Y131 N137 H139Y131-S135 WeakPolarHBondContact O-CA 3.47Å; Y131-S135 WeakPolarHBondContact O-CB 3.47Å; Y131-S135 PolarHBondContact O-N 2.98Å; Y131-S135 PolarHBondContact O-OG 3.01Å; S135-N137 VanDerWaalsContact C-N 3.29Å; S135-N137 PolarHBondContact O-N 3.07Å; S135-H139 WeakPolarHBondContact O-CB 3.38Å; S135-H139 PolarHBondContact O-CD2 3.21Å; S135-H139 PolarHBondContact O-N 3.13Å
136K88.8Confident92.8Very high120 Ų12051.1 Ų51.152%0.52229%0.294SS..Hα-helixtrans-72.8-14.8-179.2-64.2-173.1177.2-172.10114.7E134 K144E134-K136 PolarHBondContact O-N 3.49Å; K136-K144 WeakPolarHBondContact O-CE 3.34Å
137N88.3Confident92.7Very high104 Ų10451.3 Ų51.356%0.55630%0.301SS*.Hα-helixtrans-85.9-25.4-176.2-75.8-31.6000113.4Y75 E134 S135Y75-N137 HydrophobicContact CD2-CB 4.38Å; E134-N137 WeakPolarHBondContact O-CB 3.5Å; E134-N137 PolarHBondContact O-N 3.07Å; E134-N137 PolarHBondContact OE2-ND2 3.41Å; S135-N137 VanDerWaalsContact C-N 3.29Å; S135-N137 PolarHBondContact O-N 3.07Å
138F88.4Confident92.6Very high14 Ų1455.4 Ų55.46%0.06132%0.317CS..Hα-helixtrans-111.4-11.1178.761.3-101.4000113.9A73 L76 Y131 E134A73-F138 HydrophobicContact CB-CB 4.39Å; L76-F138 HydrophobicContact CB-CB 4.22Å; L76-F138 HydrophobicContact CB-CD1 4.08Å; L76-F138 HydrophobicContact CB-CD2 4.02Å; L76-F138 HydrophobicContact CB-CE1 4.45Å; L76-F138 HydrophobicContact CB-CE2 4.42Å; L76-F138 HydrophobicContact CB-CG 3.84Å; L76-F138 HydrophobicContact CD1-CD2 4.21Å; L76-F138 HydrophobicContact CD1-CE2 3.92Å; L76-F138 HydrophobicContact CD1-CZ 4.23Å; L76-F138 HydrophobicContact CD2-CD2 4.18Å; L76-F138 HydrophobicContact CG-CD2 4.36Å; Y131-F138 HydrophobicContact CD2-CE1 4.47Å; Y131-F138 AromaticContact CD2-CZ 3.7Å; Y131-F138 HydrophobicContact CD2-CZ 3.7Å; Y131-F138 AromaticContact CE2-CE2 3.97Å; Y131-F138 HydrophobicContact CE2-CE2 3.97Å; Y131-F138 AromaticContact CE2-CZ 3.46Å; Y131-F138 HydrophobicContact CE2-CZ 3.46Å; Y131-F138 VanDerWaalsContact CE2-CZ 3.46Å; Y131-F138 HydrophobicContact CG-CZ 4.5Å; E134-F138 VanDerWaalsContact O-CD1 3.25Å; E134-F138 WeakPolarHBondContact O-CD1 3.31Å; E134-F138 WeakPolarHBondContact O-CE1 3.21Å
139H90.3Very high92.5Very high8 Ų855.8 Ų55.84%0.03732%0.32CS..SBendtrans-76.3137.1170.1-78-48.8000110.6W40 Y131 S135 L143 K144W40-H139 AromaticContact CD1-CD2 3.86Å; W40-H139 AromaticContact CD1-CE1 3.94Å; W40-H139 AromaticContact CD1-NE2 3.61Å; W40-H139 AromaticContact CD2-NE2 3.8Å; W40-H139 AromaticContact CG-CD2 3.94Å; W40-H139 AromaticContact CG-CE1 3.97Å; W40-H139 AromaticContact CG-NE2 3.39Å; W40-H139 AromaticContact NE1-CD2 3.89Å; Y131-H139 PolarHBondContact OH-NE2 3.33Å; S135-H139 WeakPolarHBondContact O-CB 3.38Å; S135-H139 PolarHBondContact O-CD2 3.21Å; S135-H139 PolarHBondContact O-N 3.13Å; H139-L143 HydrophobicContact CB-CB 4.19Å; H139-K144 VanDerWaalsContact O-CE 3.3Å; H139-K144 WeakPolarHBondContact O-CE 3.33Å
140A88Confident92.4Very high23 Ų2356.7 Ų56.719%0.1933%0.327CS..  trans-54.8151.7172.200000111E66 S142 L143 K144E66-A140 WeakPolarHBondContact OE2-CB 3.23Å; A140-S142 PolarHBondContact O-N 2.87Å; A140-S142 VanDerWaalsContact O-N 3.1Å; A140-L143 HydrophobicContact CB-CD1 4.39Å; A140-L143 HydrophobicContact CB-CG 4.48Å; A140-L143 WeakPolarHBondContact O-CA 3.45Å; A140-L143 WeakPolarHBondContact O-CB 3.48Å; A140-L143 PolarHBondContact O-N 2.96Å; A140-K144 PolarHBondContact O-N 3.35Å
141D88.2Confident92.4Very high125 Ų12554.8 Ų54.867%0.66832%0.317SS*.G310 helixtrans-53.9-37.1-175.4-75.7-30.2000113.2L143 K144D141-L143 PolarHBondContact O-N 3.06Å; D141-K144 PolarHBondContact O-N 2.65Å; D141-K144 WeakPolarHBondContact OD1-CE 3.29Å; D141-K144 IonicContact OD1-NZ 2.65Å; D141-K144 PolarHBondContact OD1-NZ 3.25Å
142S86.7Confident92.4Very high98 Ų9855.6 Ų55.669%0.68532%0.321SS*.G310 helixtrans-66.5-16177.159.40000114.4A140A140-S142 PolarHBondContact O-N 2.87Å; A140-S142 VanDerWaalsContact O-N 3.1Å
143L89.8Confident92.5Very high14 Ų1457.6 Ų57.67%0.07333%0.328CS..G310 helixtrans-106.9-6.9-177.8-57.4177.6000113.2W40 V42 I50 T57 H139 A140 D141 D145 G146W40-L143 PolarHBondContact NE1-O 3.36Å; V42-L143 HydrophobicContact CB-CD2 4.4Å; V42-L143 HydrophobicContact CG2-CB 4.14Å; V42-L143 HydrophobicContact CG2-CD2 3.96Å; V42-L143 WeakPolarHBondContact CG2-O 3.26Å; I50-L143 HydrophobicContact CB-CD2 4.42Å; I50-L143 HydrophobicContact CD1-CD2 4.02Å; I50-L143 HydrophobicContact CG2-CD2 3.96Å; T57-L143 HydrophobicContact CG2-CD1 4.12Å; H139-L143 HydrophobicContact CB-CB 4.19Å; A140-L143 HydrophobicContact CB-CD1 4.39Å; A140-L143 HydrophobicContact CB-CG 4.48Å; A140-L143 WeakPolarHBondContact O-CA 3.45Å; A140-L143 WeakPolarHBondContact O-CB 3.48Å; A140-L143 PolarHBondContact O-N 2.96Å; D141-L143 PolarHBondContact O-N 3.06Å; L143-D145 VanDerWaalsContact C-N 3.26Å; L143-D145 PolarHBondContact O-N 3.5Å; L143-G146 PolarHBondContact O-N 2.69Å
144K90.3Very high92.5Very high70 Ų7055.6 Ų55.630%0.30431%0.308SS..SBendtrans-65.3-27.5-175.7-70.9-178.7-177.31760113.8K136 H139 A140 D141 G146K136-K144 WeakPolarHBondContact O-CE 3.34Å; H139-K144 VanDerWaalsContact O-CE 3.3Å; H139-K144 WeakPolarHBondContact O-CE 3.33Å; A140-K144 PolarHBondContact O-N 3.35Å; D141-K144 PolarHBondContact O-N 2.65Å; D141-K144 WeakPolarHBondContact OD1-CE 3.29Å; D141-K144 IonicContact OD1-NZ 2.65Å; D141-K144 PolarHBondContact OD1-NZ 3.25Å; K144-G146 PolarHBondContact O-N 2.98Å; K144-G146 VanDerWaalsContact O-N 3.15Å
145D91Very high92.7Very high148 Ų14853.8 Ų53.879%0.79130%0.3SS*.SBendtrans-87.647.5176-67.2-28.6000112L143L143-D145 VanDerWaalsContact C-N 3.26Å; L143-D145 PolarHBondContact O-N 3.5Å
146G92.8Very high93.1Very high24 Ų2457.4 Ų57.425%0.24731%0.313CS..  trans-108.7-168.817500000113.6W40 V41 L143 K144W40-G146 VanDerWaalsContact CE2-CA 3.49Å; W40-G146 WeakPolarHBondContact CH2-O 3.49Å; W40-G146 VanDerWaalsContact CZ2-CA 3.41Å; W40-G146 WeakPolarHBondContact CZ2-O 3.46Å; V41-G146 CarbonylContact O-C 3.57Å; V41-G146 WeakPolarHBondContact O-CA 3.39Å; L143-G146 PolarHBondContact O-N 2.69Å; K144-G146 PolarHBondContact O-N 2.98Å; K144-G146 VanDerWaalsContact O-N 3.15Å
147S95.3Very high93.5Very high70 Ų7055 Ų5549%0.4931%0.309SS..EExtended strand (participates in β ladder)trans-141.6158.2-179.260.80000111W40 V41 G149W40-S147 CarbonylContact C-O 3.01Å; W40-S147 WeakPolarHBondContact CA-O 3.21Å; V41-S147 PolarHBondContact N-O 2.97Å; V41-S147 PolarHBondContact O-N 3.34Å; V41-S147 PolarHBondContact O-OG 3.41Å; S147-G149 PolarHBondContact O-N 2.91Å
148Y96.8Very high94Very high88 Ų8850.1 Ų50.135%0.34528%0.282SS..EExtended strand (participates in β ladder)trans-66.6130.9178.7-59.9-71.4000111.5W40 Y131 T132 Y152W40-Y148 AromaticContact CE3-CD1 3.96Å; W40-Y148 HydrophobicContact CE3-CD1 3.96Å; W40-Y148 HydrophobicContact CE3-CE1 4.26Å; W40-Y148 HydrophobicContact CE3-CG 4.48Å; W40-Y148 AromaticContact CZ3-CD1 3.78Å; W40-Y148 HydrophobicContact CZ3-CD1 3.78Å; W40-Y148 AromaticContact CZ3-CE1 3.77Å; W40-Y148 HydrophobicContact CZ3-CE1 3.77Å; W40-Y148 HydrophobicContact CZ3-CG 4.18Å; Y131-Y148 HydrophobicContact CD1-CD1 4.2Å; Y131-Y148 HydrophobicContact CD1-CE1 4.01Å; Y131-Y148 HydrophobicContact CE1-CD1 4.13Å; Y131-Y148 HydrophobicContact CE1-CE1 4.2Å; T132-Y148 WeakPolarHBondContact CA-OH 3.48Å; T132-Y148 PolarHBondContact O-OH 2.96Å; Y148-Y152 VanDerWaalsContact CB-CD1 3.45Å; Y148-Y152 AromaticContact CD1-CD1 3.82Å; Y148-Y152 HydrophobicContact CD1-CD1 3.82Å; Y148-Y152 AromaticContact CD1-CD2 3.81Å; Y148-Y152 HydrophobicContact CD1-CD2 3.81Å; Y148-Y152 AromaticContact CD1-CE1 3.76Å; Y148-Y152 HydrophobicContact CD1-CE1 3.76Å; Y148-Y152 AromaticContact CD1-CE2 3.77Å; Y148-Y152 HydrophobicContact CD1-CE2 3.77Å; Y148-Y152 AromaticContact CD1-CG 3.81Å; Y148-Y152 HydrophobicContact CD1-CG 3.81Å; Y148-Y152 AromaticContact CD1-CZ 3.71Å; Y148-Y152 HydrophobicContact CD2-CE1 4.07Å; Y148-Y152 HydrophobicContact CE1-CD2 4.31Å; Y148-Y152 HydrophobicContact CE1-CE1 4.38Å; Y148-Y152 AromaticContact CE1-CE2 3.89Å; Y148-Y152 HydrophobicContact CE1-CE2 3.89Å; Y148-Y152 AromaticContact CE1-CZ 3.91Å; Y148-Y152 AromaticContact CG-CD1 3.71Å; Y148-Y152 HydrophobicContact CG-CD1 3.71Å; Y148-Y152 AromaticContact CG-CE1 3.6Å; Y148-Y152 HydrophobicContact CG-CE1 3.6Å; Y148-Y152 HydrophobicContact CG-CE2 4.45Å; Y148-Y152 HydrophobicContact CG-CG 4.16Å; Y148-Y152 AromaticContact CG-CZ 3.98Å
149G96.5Very high94.4Very high7 Ų751.4 Ų51.47%0.07229%0.288CS..  trans-90.1-179.6179.300000113.9A38 W39 S147 S151 Y152 I153A38-G149 CarbonylContact O-C 3.5Å; A38-G149 WeakPolarHBondContact O-CA 3.43Å; W39-G149 PolarHBondContact O-N 2.89Å; S147-G149 PolarHBondContact O-N 2.91Å; G149-S151 PolarHBondContact O-N 2.91Å; G149-Y152 PolarHBondContact O-N 2.76Å; G149-I153 PolarHBondContact O-N 2.85Å
150S96.4Very high94.8Very high71 Ų7153.6 Ų53.650%0.49730%0.303SS..Hα-helixtrans-62.6-37.5-175.656.90000113.9A38 Y152 I153 V154A38-S150 WeakPolarHBondContact CB-OG 3.4Å; A38-S150 PolarHBondContact O-N 2.84Å; S150-Y152 VanDerWaalsContact C-N 3.3Å; S150-Y152 PolarHBondContact O-N 3.29Å; S150-I153 PolarHBondContact O-N 2.79Å; S150-I153 VanDerWaalsContact O-N 3.16Å; S150-V154 VanDerWaalsContact O-CG2 3.29Å; S150-V154 WeakPolarHBondContact O-CG2 3.41Å; S150-V154 PolarHBondContact O-N 3.18Å
151S97.6Very high95.1Very high1 Ų154.3 Ų54.31%0.00730%0.303CS..Hα-helixtrans-65.5-34.7-179.3-59.30000111.9H36 A38 G149 V154 A155H36-S151 PolarHBondContact O-OG 3.41Å; A38-S151 WeakPolarHBondContact O-CB 3.26Å; A38-S151 PolarHBondContact O-N 2.82Å; G149-S151 PolarHBondContact O-N 2.91Å; S151-V154 PolarHBondContact O-N 3.38Å; S151-A155 PolarHBondContact O-N 3.33Å
152Y97.8Very high95.5Very high18 Ų1848.4 Ų48.47%0.07127%0.271CS..Hα-helixtrans-64.3-42.9172.3167.4-90.7000111.6W39 Y131 T132 Y148 G149 S150 V154 A155 W156W39-Y152 AromaticContact CE3-CD2 3.88Å; W39-Y152 HydrophobicContact CE3-CD2 3.88Å; W39-Y152 HydrophobicContact CE3-CG 4.38Å; W39-Y152 AromaticContact CZ3-CD2 3.85Å; W39-Y152 HydrophobicContact CZ3-CD2 3.85Å; Y131-Y152 AromaticContact CD1-CD2 3.71Å; Y131-Y152 HydrophobicContact CD1-CD2 3.71Å; Y131-Y152 HydrophobicContact CD1-CE2 4.05Å; Y131-Y152 HydrophobicContact CE1-CD2 4.37Å; Y131-Y152 HydrophobicContact CG-CD2 4.41Å; T132-Y152 WeakPolarHBondContact OG1-CE2 3.48Å; T132-Y152 PolarHBondContact OG1-OH 2.91Å; Y148-Y152 VanDerWaalsContact CB-CD1 3.45Å; Y148-Y152 AromaticContact CD1-CD1 3.82Å; Y148-Y152 HydrophobicContact CD1-CD1 3.82Å; Y148-Y152 AromaticContact CD1-CD2 3.81Å; Y148-Y152 HydrophobicContact CD1-CD2 3.81Å; Y148-Y152 AromaticContact CD1-CE1 3.76Å; Y148-Y152 HydrophobicContact CD1-CE1 3.76Å; Y148-Y152 AromaticContact CD1-CE2 3.77Å; Y148-Y152 HydrophobicContact CD1-CE2 3.77Å; Y148-Y152 AromaticContact CD1-CG 3.81Å; Y148-Y152 HydrophobicContact CD1-CG 3.81Å; Y148-Y152 AromaticContact CD1-CZ 3.71Å; Y148-Y152 HydrophobicContact CD2-CE1 4.07Å; Y148-Y152 HydrophobicContact CE1-CD2 4.31Å; Y148-Y152 HydrophobicContact CE1-CE1 4.38Å; Y148-Y152 AromaticContact CE1-CE2 3.89Å; Y148-Y152 HydrophobicContact CE1-CE2 3.89Å; Y148-Y152 AromaticContact CE1-CZ 3.91Å; Y148-Y152 AromaticContact CG-CD1 3.71Å; Y148-Y152 HydrophobicContact CG-CD1 3.71Å; Y148-Y152 AromaticContact CG-CE1 3.6Å; Y148-Y152 HydrophobicContact CG-CE1 3.6Å; Y148-Y152 HydrophobicContact CG-CE2 4.45Å; Y148-Y152 HydrophobicContact CG-CG 4.16Å; Y148-Y152 AromaticContact CG-CZ 3.98Å; G149-Y152 PolarHBondContact O-N 2.76Å; S150-Y152 VanDerWaalsContact C-N 3.3Å; S150-Y152 PolarHBondContact O-N 3.29Å; Y152-V154 VanDerWaalsContact C-N 3.34Å; Y152-A155 WeakPolarHBondContact O-CB 3.43Å; Y152-A155 PolarHBondContact O-N 2.85Å; Y152-W156 AromaticContact CE1-CD1 3.48Å; Y152-W156 VanDerWaalsContact CE1-CD1 3.48Å; Y152-W156 AromaticContact CE1-NE1 3.65Å; Y152-W156 AromaticContact CE2-CD1 3.88Å; Y152-W156 AromaticContact CE2-NE1 3.51Å; Y152-W156 AromaticContact CZ-CD1 3.41Å; Y152-W156 VanDerWaalsContact CZ-CD1 3.41Å; Y152-W156 AromaticContact CZ-NE1 3.07Å; Y152-W156 PolarHBondContact O-N 2.86Å; Y152-W156 VanDerWaalsContact O-N 3.13Å; Y152-W156 PolarHBondContact OH-NE1 2.97Å
153I97.8Very high96Very high91 Ų9146.2 Ų46.247%0.46725%0.251SS..Hα-helixtrans-64.3-41.8175.5-57.8-60.4000110.8G149 S150 A155 W156 V157G149-I153 PolarHBondContact O-N 2.85Å; S150-I153 PolarHBondContact O-N 2.79Å; S150-I153 VanDerWaalsContact O-N 3.16Å; I153-A155 VanDerWaalsContact C-N 3.29Å; I153-A155 PolarHBondContact O-N 3.34Å; I153-W156 PolarHBondContact O-N 2.91Å; I153-W156 VanDerWaalsContact O-N 3.14Å; I153-V157 HydrophobicContact CG2-CG2 4.45Å; I153-V157 WeakPolarHBondContact O-CG2 3.3Å; I153-V157 PolarHBondContact O-N 3.19Å
154V98Very high96.3Very high30 Ų3049.3 Ų49.318%0.18227%0.267CS..Hα-helixtrans-59.9-39.5175.5171.10000111.1L29 V32 A33 S150 S151 Y152 V157 S158L29-V154 HydrophobicContact CB-CG1 3.9Å; L29-V154 HydrophobicContact CD2-CG1 3.86Å; L29-V154 HydrophobicContact CG-CG1 4.45Å; L29-V154 VanDerWaalsContact O-CG1 3.25Å; L29-V154 WeakPolarHBondContact O-CG1 3.5Å; V32-V154 HydrophobicContact CB-CG1 4.38Å; V32-V154 HydrophobicContact CG1-CG1 4.28Å; A33-V154 HydrophobicContact CB-CG1 4.1Å; S150-V154 VanDerWaalsContact O-CG2 3.29Å; S150-V154 WeakPolarHBondContact O-CG2 3.41Å; S150-V154 PolarHBondContact O-N 3.18Å; S151-V154 PolarHBondContact O-N 3.38Å; Y152-V154 VanDerWaalsContact C-N 3.34Å; V154-V157 PolarHBondContact O-N 2.73Å; V154-S158 WeakPolarHBondContact O-CB 3.44Å; V154-S158 PolarHBondContact O-N 3.13Å
155A98.1Very high96.4Very high1 Ų146 Ų461%0.00825%0.253CS..Hα-helixtrans-59.6-47.5173.400000111.5A33 W39 V124 S151 Y152 I153 V157 S158 F159A33-A155 HydrophobicContact CB-CB 4.06Å; W39-A155 HydrophobicContact CH2-CB 3.6Å; W39-A155 HydrophobicContact CZ2-CB 3.78Å; W39-A155 HydrophobicContact CZ3-CB 4.5Å; V124-A155 VanDerWaalsContact CG1-O 3.29Å; V124-A155 WeakPolarHBondContact CG1-O 3.33Å; S151-A155 PolarHBondContact O-N 3.33Å; Y152-A155 WeakPolarHBondContact O-CB 3.43Å; Y152-A155 PolarHBondContact O-N 2.85Å; I153-A155 VanDerWaalsContact C-N 3.29Å; I153-A155 PolarHBondContact O-N 3.34Å; A155-V157 VanDerWaalsContact C-N 3.32Å; A155-V157 PolarHBondContact O-N 2.65Å; A155-S158 PolarHBondContact O-N 2.85Å; A155-S158 VanDerWaalsContact O-N 3.13Å; A155-S158 PolarHBondContact O-OG 3.34Å; A155-F159 PolarHBondContact O-N 3.48Å
156W98.2Very high96.5Very high81 Ų8138.9 Ų38.931%0.30722%0.215SC..Hα-helixtrans-63.7-31.9175.7-85.6117.6000114.3A128 Y152 I153 F159 P160A128-W156 HydrophobicContact CB-CD2 3.88Å; A128-W156 HydrophobicContact CB-CE3 4.38Å; A128-W156 HydrophobicContact CB-CG 4.29Å; A128-W156 HydrophobicContact CB-CH2 4.3Å; A128-W156 HydrophobicContact CB-CZ2 3.79Å; Y152-W156 AromaticContact CE1-CD1 3.48Å; Y152-W156 VanDerWaalsContact CE1-CD1 3.48Å; Y152-W156 AromaticContact CE1-NE1 3.65Å; Y152-W156 AromaticContact CE2-CD1 3.88Å; Y152-W156 AromaticContact CE2-NE1 3.51Å; Y152-W156 AromaticContact CZ-CD1 3.41Å; Y152-W156 VanDerWaalsContact CZ-CD1 3.41Å; Y152-W156 AromaticContact CZ-NE1 3.07Å; Y152-W156 PolarHBondContact O-N 2.86Å; Y152-W156 VanDerWaalsContact O-N 3.13Å; Y152-W156 PolarHBondContact OH-NE1 2.97Å; I153-W156 PolarHBondContact O-N 2.91Å; I153-W156 VanDerWaalsContact O-N 3.14Å; W156-F159 HydrophobicContact CE3-CD1 4.31Å; W156-F159 HydrophobicContact CZ3-CD1 4.26Å; W156-P160 WeakPolarHBondContact O-CD 3.27Å
157V98Very high96.5Very high70 Ų7042.9 Ų42.942%0.42423%0.226SC..Hα-helixtrans-72.6-35.5173.2174.20000111.1L29 I153 V154 A155 F159 P160 M161L29-V157 HydrophobicContact CD1-CG1 4.06Å; I153-V157 HydrophobicContact CG2-CG2 4.45Å; I153-V157 WeakPolarHBondContact O-CG2 3.3Å; I153-V157 PolarHBondContact O-N 3.19Å; V154-V157 PolarHBondContact O-N 2.73Å; A155-V157 VanDerWaalsContact C-N 3.32Å; A155-V157 PolarHBondContact O-N 2.65Å; V157-F159 VanDerWaalsContact C-N 3.28Å; V157-F159 PolarHBondContact O-N 3.37Å; V157-P160 WeakPolarHBondContact O-CD 3.46Å; V157-P160 WeakPolarHBondContact O-CG 3.17Å; V157-M161 HydrophobicContact CG1-SD 4.42Å; V157-M161 WeakPolarHBondContact O-CG 3.29Å
158S97.7Very high96.3Very high0 Ų041 Ų410%021%0.21CC..Hα-helixtrans-67.1-27.517877.60000112.9L30 V124 V154 A155 M161 T162L30-S158 WeakPolarHBondContact CD2-OG 3.16Å; V124-S158 VanDerWaalsContact CG1-OG 3.31Å; V124-S158 WeakPolarHBondContact CG1-OG 3.41Å; V154-S158 WeakPolarHBondContact O-CB 3.44Å; V154-S158 PolarHBondContact O-N 3.13Å; A155-S158 PolarHBondContact O-N 2.85Å; A155-S158 VanDerWaalsContact O-N 3.13Å; A155-S158 PolarHBondContact O-OG 3.34Å; S158-M161 PolarHBondContact O-N 2.89Å; S158-T162 WeakPolarHBondContact O-CB 3.49Å; S158-T162 WeakPolarHBondContact O-CG2 3.13Å; S158-T162 PolarHBondContact O-N 3.26Å; S158-T162 PolarHBondContact O-OG1 3.49Å
159F98Very high95.9Very high42 Ų4236.9 Ų36.918%0.18419%0.193CC..Hα-helixtrans-58.3-60.7176.7163.9-119.8000113.6S121 V124 M125 A155 W156 V157 M161 T162 L163S121-F159 VanDerWaalsContact OG-CD2 3.3Å; S121-F159 WeakPolarHBondContact OG-CD2 3.42Å; S121-F159 WeakPolarHBondContact OG-CE2 3.39Å; S121-F159 PolarHBondContact OG-O 3Å; V124-F159 HydrophobicContact CB-CB 4.49Å; V124-F159 HydrophobicContact CG1-CB 3.94Å; M125-F159 HydrophobicContact CB-CD2 3.75Å; M125-F159 HydrophobicContact CB-CE2 3.82Å; M125-F159 HydrophobicContact CB-CG 4.31Å; M125-F159 HydrophobicContact CB-CZ 4.41Å; M125-F159 HydrophobicContact CG-CD2 4.41Å; M125-F159 HydrophobicContact CG-CE2 4.17Å; M125-F159 HydrophobicContact CG-CZ 4.28Å; M125-F159 HydrophobicContact SD-CE1 4.34Å; M125-F159 HydrophobicContact SD-CE2 3.87Å; M125-F159 HydrophobicContact SD-CZ 3.67Å; A155-F159 PolarHBondContact O-N 3.48Å; W156-F159 HydrophobicContact CE3-CD1 4.31Å; W156-F159 HydrophobicContact CZ3-CD1 4.26Å; V157-F159 VanDerWaalsContact C-N 3.28Å; V157-F159 PolarHBondContact O-N 3.37Å; F159-M161 VanDerWaalsContact C-N 3.26Å; F159-M161 PolarHBondContact O-N 3.34Å; F159-T162 PolarHBondContact O-N 2.84Å; F159-T162 PolarHBondContact O-OG1 3.18Å; F159-L163 HydrophobicContact CE2-CB 4.44Å; F159-L163 HydrophobicContact CE2-CD2 4.18Å; F159-L163 HydrophobicContact CZ-CD2 3.94Å; F159-L163 WeakPolarHBondContact O-CB 3.24Å; F159-L163 PolarHBondContact O-N 2.95Å
160P97.2Very high95.4Very high53 Ų5339.2 Ų39.234%0.34420%0.204SC..Hα-helixtrans-64.6-31.3178.626.3-34.5000111.9W156 V157 L163 I164W156-P160 WeakPolarHBondContact O-CD 3.27Å; V157-P160 WeakPolarHBondContact O-CD 3.46Å; V157-P160 WeakPolarHBondContact O-CG 3.17Å; P160-L163 PolarHBondContact O-N 3Å; P160-I164 VanDerWaalsContact O-CB 3.31Å; P160-I164 WeakPolarHBondContact O-CB 3.5Å; P160-I164 WeakPolarHBondContact O-CD1 3.42Å; P160-I164 WeakPolarHBondContact O-CG1 3.02Å; P160-I164 PolarHBondContact O-N 3.44Å
161M95.7Very high94.8Very high39 Ų3938.7 Ų38.719%0.19220%0.198CC..Hα-helixtrans-64.4-46.8176.1-67.7-161.678.300112.2F22 A25 S26 L29 V157 S158 F159 S165F22-M161 HydrophobicContact CD1-CB 4.46Å; F22-M161 HydrophobicContact CD1-CE 3.69Å; F22-M161 HydrophobicContact CE1-CE 4.06Å; F22-M161 HydrophobicContact CG-CE 4.43Å; A25-M161 HydrophobicContact CB-CE 3.51Å; A25-M161 HydrophobicContact CB-SD 4.38Å; S26-M161 WeakPolarHBondContact OG-CB 3.46Å; L29-M161 HydrophobicContact CD1-SD 3.36Å; L29-M161 WeakPolarHBondContact CD1-SD 3.32Å; V157-M161 HydrophobicContact CG1-SD 4.42Å; V157-M161 WeakPolarHBondContact O-CG 3.29Å; S158-M161 PolarHBondContact O-N 2.89Å; F159-M161 VanDerWaalsContact C-N 3.26Å; F159-M161 PolarHBondContact O-N 3.34Å; M161-S165 VanDerWaalsContact O-CB 3.29Å; M161-S165 WeakPolarHBondContact O-CB 3.18Å; M161-S165 PolarHBondContact O-N 2.78Å
162T96.7Very high93.8Very high0 Ų040 Ų400%020%0.204CC..Hα-helixtrans-64.9-39.7175.450.30000111.6S26 L30 S121 S158 F159 S165 G166S26-T162 PolarHBondContact OG-N 3.33Å; L30-T162 HydrophobicContact CD1-CG2 4.07Å; S121-T162 WeakPolarHBondContact CA-OG1 3.47Å; S121-T162 VanDerWaalsContact CB-OG1 3.25Å; S121-T162 WeakPolarHBondContact CB-OG1 3.04Å; S121-T162 PolarHBondContact OG-OG1 2.81Å; S158-T162 WeakPolarHBondContact O-CB 3.49Å; S158-T162 WeakPolarHBondContact O-CG2 3.13Å; S158-T162 PolarHBondContact O-N 3.26Å; S158-T162 PolarHBondContact O-OG1 3.49Å; F159-T162 PolarHBondContact O-N 2.84Å; F159-T162 PolarHBondContact O-OG1 3.18Å; T162-S165 WeakPolarHBondContact O-CB 3.47Å; T162-S165 PolarHBondContact O-N 2.79Å; T162-G166 PolarHBondContact O-N 2.73Å
163L96.9Very high92.5Very high52 Ų5244.5 Ų44.527%0.27222%0.221SC..Hα-helixtrans-63.4-52.1178.7-173.762.9000112L118 S121 F159 P160 S165 G166 F167L118-L163 HydrophobicContact CD2-CD1 3.78Å; S121-L163 WeakPolarHBondContact OG-CA 3.49Å; S121-L163 WeakPolarHBondContact OG-CB 3.31Å; S121-L163 PolarHBondContact OG-N 3.23Å; F159-L163 HydrophobicContact CE2-CB 4.44Å; F159-L163 HydrophobicContact CE2-CD2 4.18Å; F159-L163 HydrophobicContact CZ-CD2 3.94Å; F159-L163 WeakPolarHBondContact O-CB 3.24Å; F159-L163 PolarHBondContact O-N 2.95Å; P160-L163 PolarHBondContact O-N 3Å; L163-S165 VanDerWaalsContact C-N 3.28Å; L163-S165 PolarHBondContact O-N 3.1Å; L163-G166 PolarHBondContact O-N 2.98Å; L163-G166 VanDerWaalsContact O-N 3.14Å; L163-F167 HydrophobicContact CD1-CD2 4.2Å; L163-F167 HydrophobicContact CD1-CE2 3.58Å; L163-F167 HydrophobicContact CD1-CZ 4.25Å; L163-F167 HydrophobicContact CD2-CE2 4.21Å; L163-F167 HydrophobicContact CG-CD2 3.99Å; L163-F167 HydrophobicContact CG-CE2 3.63Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.19Å; L163-F167 PolarHBondContact O-N 2.94Å
164I95.1Very high90.7Very high79 Ų7948.9 Ų48.941%0.40524%0.237SC..Hα-helixtrans-60.8-42.2178.4-67.9165.9000109.5F22 P160 G166 F167 M168F22-I164 HydrophobicContact CE1-CG2 4.39Å; P160-I164 VanDerWaalsContact O-CB 3.31Å; P160-I164 WeakPolarHBondContact O-CB 3.5Å; P160-I164 WeakPolarHBondContact O-CD1 3.42Å; P160-I164 WeakPolarHBondContact O-CG1 3.02Å; P160-I164 PolarHBondContact O-N 3.44Å; I164-G166 VanDerWaalsContact C-N 3.34Å; I164-G166 PolarHBondContact O-N 2.84Å; I164-F167 PolarHBondContact O-N 2.04Å; I164-M168 HydrophobicContact CG2-CE 4.13Å; I164-M168 HydrophobicContact CG2-CG 4.32Å; I164-M168 HydrophobicContact CG2-SD 4.35Å; I164-M168 WeakPolarHBondContact O-CG 3.37Å; I164-M168 PolarHBondContact O-N 2.75Å
165S92.9Very high88.9Confident0 Ų055 Ų550%026%0.256CS..Hα-helixtrans-57.3-45.7174.2-165.70000112.3M161 T162 L163 F167 M168 Y169M161-S165 VanDerWaalsContact O-CB 3.29Å; M161-S165 WeakPolarHBondContact O-CB 3.18Å; M161-S165 PolarHBondContact O-N 2.78Å; T162-S165 WeakPolarHBondContact O-CB 3.47Å; T162-S165 PolarHBondContact O-N 2.79Å; L163-S165 VanDerWaalsContact C-N 3.28Å; L163-S165 PolarHBondContact O-N 3.1Å; S165-F167 PolarHBondContact O-N 3.17Å; S165-M168 PolarHBondContact O-N 3.41Å; S165-Y169 WeakPolarHBondContact O-CD2 3.3Å; S165-Y169 PolarHBondContact O-N 3.28Å
166G93.4Very high86.5Confident0 Ų063.4 Ų63.40%029%0.293CS..Hα-helixtrans-56.7-46.3174.400000113T162 L163 I164 Y169 L170T162-G166 PolarHBondContact O-N 2.73Å; L163-G166 PolarHBondContact O-N 2.98Å; L163-G166 VanDerWaalsContact O-N 3.14Å; I164-G166 VanDerWaalsContact C-N 3.34Å; I164-G166 PolarHBondContact O-N 2.84Å; G166-Y169 WeakPolarHBondContact O-CB 3.42Å; G166-Y169 PolarHBondContact O-N 2.73Å; G166-L170 PolarHBondContact O-N 3.15Å
167F93.1Very high85.9Confident108 Ų10862.5 Ų62.547%0.47429%0.292SS..Hα-helixtrans-67.1-36.8176.8-74.3-58.9000113.3L163 I164 S165 Y169 L170 V171L163-F167 HydrophobicContact CD1-CD2 4.2Å; L163-F167 HydrophobicContact CD1-CE2 3.58Å; L163-F167 HydrophobicContact CD1-CZ 4.25Å; L163-F167 HydrophobicContact CD2-CE2 4.21Å; L163-F167 HydrophobicContact CG-CD2 3.99Å; L163-F167 HydrophobicContact CG-CE2 3.63Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.19Å; L163-F167 PolarHBondContact O-N 2.94Å; I164-F167 PolarHBondContact O-N 2.04Å; S165-F167 PolarHBondContact O-N 3.17Å; F167-Y169 VanDerWaalsContact C-N 3.28Å; F167-Y169 PolarHBondContact O-N 2.72Å; F167-L170 HydrophobicContact CD1-CD1 4.14Å; F167-L170 WeakPolarHBondContact O-CA 3.16Å; F167-L170 WeakPolarHBondContact O-CB 3.37Å; F167-L170 PolarHBondContact O-N 2.89Å; F167-V171 PolarHBondContact O-N 3.16Å
168M90.1Very high85.3Confident31 Ų3162.1 Ų62.115%0.15329%0.285CS..Hα-helixtrans-61.4-36.7176.7-71.9-170.4-66.300111.9F18 I19 F22 I164 S165 L170 V171 L172F18-M168 HydrophobicContact CB-SD 4.05Å; I19-M168 HydrophobicContact CD1-CB 3.96Å; I19-M168 HydrophobicContact CG1-CB 3.51Å; I19-M168 HydrophobicContact CG1-CE 4.18Å; I19-M168 HydrophobicContact CG1-CG 4.46Å; I19-M168 HydrophobicContact CG1-SD 4.25Å; F22-M168 HydrophobicContact CB-CE 3.66Å; F22-M168 HydrophobicContact CD1-CE 4.43Å; F22-M168 HydrophobicContact CD2-CE 3.6Å; F22-M168 HydrophobicContact CD2-SD 4.43Å; F22-M168 HydrophobicContact CE2-CE 4.34Å; F22-M168 HydrophobicContact CG-CE 3.64Å; I164-M168 HydrophobicContact CG2-CE 4.13Å; I164-M168 HydrophobicContact CG2-CG 4.32Å; I164-M168 HydrophobicContact CG2-SD 4.35Å; I164-M168 WeakPolarHBondContact O-CG 3.37Å; I164-M168 PolarHBondContact O-N 2.75Å; S165-M168 PolarHBondContact O-N 3.41Å; M168-L170 VanDerWaalsContact C-N 3.28Å; M168-L170 PolarHBondContact O-N 3.03Å; M168-V171 PolarHBondContact O-N 3.5Å; M168-L172 PolarHBondContact O-N 3.05Å
169Y87.8Confident84.6Confident0 Ų065.6 Ų65.60%030%0.301CS..Hα-helixtrans-60-36.8171.6-71.8-59.4000112.8I19 H23 F97 F110 T113 Q117 S165 G166 F167I19-Y169 HydrophobicContact CD1-CD1 4.31Å; I19-Y169 HydrophobicContact CG2-CD1 4Å; I19-Y169 HydrophobicContact CG2-CE1 3.25Å; I19-Y169 HydrophobicContact CG2-CE2 4.28Å; I19-Y169 VanDerWaalsContact CG2-CZ 3.41Å; I19-Y169 WeakPolarHBondContact CG2-OH 3.5Å; H23-Y169 AromaticContact CE1-CE2 3.89Å; H23-Y169 PolarHBondContact CE1-OH 3.12Å; H23-Y169 AromaticContact ND1-CE2 3.49Å; H23-Y169 WeakPolarHBondContact ND1-CE2 3.42Å; H23-Y169 AromaticContact ND1-CZ 3.53Å; H23-Y169 PolarHBondContact ND1-OH 3.33Å; F97-Y169 HydrophobicContact CB-CE1 4.15Å; F97-Y169 HydrophobicContact CD1-CE1 4.02Å; F97-Y169 WeakPolarHBondContact CD1-OH 3.39Å; F97-Y169 HydrophobicContact CD2-CD1 4.24Å; F97-Y169 AromaticContact CD2-CE1 3.43Å; F97-Y169 HydrophobicContact CD2-CE1 3.43Å; F97-Y169 VanDerWaalsContact CD2-CE1 3.43Å; F97-Y169 HydrophobicContact CE1-CE1 4.21Å; F97-Y169 HydrophobicContact CE2-CD1 4.32Å; F97-Y169 AromaticContact CE2-CE1 3.63Å; F97-Y169 HydrophobicContact CE2-CE1 3.63Å; F97-Y169 AromaticContact CG-CE1 3.6Å; F97-Y169 HydrophobicContact CG-CE1 3.6Å; F97-Y169 AromaticContact CG-CZ 3.98Å; F97-Y169 WeakPolarHBondContact CG-OH 3.41Å; F97-Y169 AromaticContact CZ-CE1 3.99Å; F97-Y169 HydrophobicContact CZ-CE1 3.99Å; F110-Y169 HydrophobicContact CD1-CD1 4.48Å; T113-Y169 HydrophobicContact CG2-CD1 4Å; T113-Y169 HydrophobicContact CG2-CD2 4.11Å; T113-Y169 HydrophobicContact CG2-CE1 3.74Å; T113-Y169 HydrophobicContact CG2-CE2 3.86Å; T113-Y169 HydrophobicContact CG2-CG 4.19Å; Q117-Y169 HydrophobicContact CB-CD2 4.31Å; Q117-Y169 HydrophobicContact CB-CE2 4.26Å; Q117-Y169 HydrophobicContact CG-CD2 4.48Å; Q117-Y169 HydrophobicContact CG-CE2 4.21Å; S165-Y169 WeakPolarHBondContact O-CD2 3.3Å; S165-Y169 PolarHBondContact O-N 3.28Å; G166-Y169 WeakPolarHBondContact O-CB 3.42Å; G166-Y169 PolarHBondContact O-N 2.73Å; F167-Y169 VanDerWaalsContact C-N 3.28Å; F167-Y169 PolarHBondContact O-N 2.72Å
170L87.4Confident83.8Confident57 Ų5766.9 Ų66.930%0.29831%0.308SS..Hα-helixtrans-71.4-33.6175.7-61.7177.3000112.5A114 L118 G166 F167 M168 R173 K174A114-L170 HydrophobicContact CB-CD2 3.55Å; A114-L170 HydrophobicContact CB-CG 3.83Å; L118-L170 HydrophobicContact CD1-CD1 4.27Å; G166-L170 PolarHBondContact O-N 3.15Å; F167-L170 HydrophobicContact CD1-CD1 4.14Å; F167-L170 WeakPolarHBondContact O-CA 3.16Å; F167-L170 WeakPolarHBondContact O-CB 3.37Å; F167-L170 PolarHBondContact O-N 2.89Å; M168-L170 VanDerWaalsContact C-N 3.28Å; M168-L170 PolarHBondContact O-N 3.03Å; L170-R173 WeakPolarHBondContact O-CB 3.23Å; L170-R173 PolarHBondContact O-N 2.89Å; L170-K174 PolarHBondContact O-N 3.26Å
171V84.1Confident83Confident60 Ų6067.8 Ų67.836%0.36431%0.306SS..Hα-helixtrans-66.6-37.1177.5173.20000111.6I15 F167 M168 R173 K174 R175I15-V171 HydrophobicContact CD1-CG1 4.36Å; F167-V171 PolarHBondContact O-N 3.16Å; M168-V171 PolarHBondContact O-N 3.5Å; V171-R173 PolarHBondContact O-N 3.17Å; V171-K174 PolarHBondContact O-N 2.99Å; V171-K174 VanDerWaalsContact O-N 3.08Å; V171-R175 PolarHBondContact O-N 3.47Å
172L74.9Confident82.2Confident28 Ų2869.7 Ų69.715%0.14731%0.313CS..Hα-helixtrans-58.1-31.1174.3-76.5-177.1000112.6M12 I15 I19 M168M12-L172 HydrophobicContact CG-CD2 4.44Å; I15-L172 HydrophobicContact CB-CD2 4.09Å; I15-L172 HydrophobicContact CG2-CD2 3.54Å; I15-L172 HydrophobicContact CG2-CG 3.9Å; I19-L172 HydrophobicContact CD1-CD1 3.31Å; I19-L172 HydrophobicContact CD1-CD2 4.5Å; I19-L172 HydrophobicContact CD1-CG 3.72Å; M168-L172 PolarHBondContact O-N 3.05Å
173R71.5Confident81.1Confident113 Ų11374.7 Ų74.743%0.42634%0.336SS..Hα-helixtrans-69-45173.6-174.2-171.1-178.6-1675.7112E108 L170 V171 R175 K176E108-R173 IonicContact OE1-NH2 3.46Å; E108-R173 PolarHBondContact OE1-NH2 2.88Å; L170-R173 WeakPolarHBondContact O-CB 3.23Å; L170-R173 PolarHBondContact O-N 2.89Å; V171-R173 PolarHBondContact O-N 3.17Å; R173-R175 PolarHBondContact O-N 2.79Å; R173-K176 PolarHBondContact O-N 3Å
174K60.3Low79.9Confident182 Ų18276.5 Ų76.579%0.79134%0.341SS*.Hα-helixtrans-68.4-18.6-172.9-74.4-167.9177-174.60114.4L170 V171 K176L170-K174 PolarHBondContact O-N 3.26Å; V171-K174 PolarHBondContact O-N 2.99Å; V171-K174 VanDerWaalsContact O-N 3.08Å; K174-K176 VanDerWaalsContact C-N 3.29Å; K174-K176 PolarHBondContact O-N 2.8Å
175R58.8Low78.6Confident158 Ų15876.3 Ų76.360%0.59634%0.335SS*.THydrogen-bonded Turntrans-92.220.3-179.1-66.9-160.4-179.4-136.15.9114V171 R173V171-R175 PolarHBondContact O-N 3.47Å; R173-R175 PolarHBondContact O-N 2.79Å
176K49.3Very low77.3Confident178 Ų17883.2 Ų83.277%0.77437%0.366SS*.  trans-950165.7-83-170.1157.3-158.40111.3Q106 R173 K174Q106-K176 WeakPolarHBondContact O-CE 3.07Å; Q106-K176 PolarHBondContact O-NZ 2.79Å; R173-K176 PolarHBondContact O-N 3Å; K174-K176 VanDerWaalsContact C-N 3.29Å; K174-K176 PolarHBondContact O-N 2.8Å

Retrieved 176 of 176 residues in 338 ms (Link to these results)

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