A0A087YRR2_POEFO Loading...

Transmembrane protein 60

AlphaFold DB , UniProt , Accession A0A087YRR2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 134 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
1M47.3Very low68.9Low221 Ų221114.4 Ų114.4100%1.08957%0.574SS**  0107.30-94.51586100109.6M3M1-M3 PolarHBondContact O-N 2.8Å
2K50.3Low69.1Low218 Ų218107.6 Ų107.695%0.94855%0.546SS*.  trans-72.2107.2169.4-84.2176.8175.1174.30107.6S4K2-S4 PolarHBondContact O-N 3.36Å
3M58.7Low69.5Low76 Ų76113.3 Ų113.337%0.37456%0.557SS.*  trans-62.8122.3171.1-69.7-85.3179.800108.1M1 L5 Q7 R8M1-M3 PolarHBondContact O-N 2.8Å; M3-L5 PolarHBondContact O-N 3.43Å; M3-Q7 PolarHBondContact SD-NE2 3.49Å; M3-R8 HydrophobicContact CB-CG 4.1Å
4S75.7Confident70Confident67 Ų67112.5 Ų112.547%0.46955%0.554SS.*  trans-55.7138.3175.7172.30000110.1K2 A6 Q7 R8K2-S4 PolarHBondContact O-N 3.36Å; S4-A6 PolarHBondContact O-N 2.94Å; S4-A6 PolarHBondContact OG-N 3.39Å; S4-Q7 WeakPolarHBondContact O-CB 3.45Å; S4-Q7 PolarHBondContact O-N 2.78Å; S4-R8 PolarHBondContact O-N 3.3Å; S4-R8 VanDerWaalsContact O-N 3.1Å
5L71.7Confident70.2Confident140 Ų140109.5 Ų109.573%0.73354%0.537SS*.Hα-helixtrans-52.9-39.5175.7-78.5166.4000111M3 Q7 R8 V9M3-L5 PolarHBondContact O-N 3.43Å; L5-Q7 PolarHBondContact O-N 3.03Å; L5-R8 PolarHBondContact O-N 2.75Å; L5-V9 VanDerWaalsContact O-CG2 3.28Å; L5-V9 WeakPolarHBondContact O-CG2 3.42Å; L5-V9 PolarHBondContact O-N 2.71Å
6A75.3Confident70.1Confident50 Ų50105 Ų10541%0.41352%0.523SS..Hα-helixtrans-59.7-45.9176.100000111.6S4 R8 V9 F10S4-A6 PolarHBondContact O-N 2.94Å; S4-A6 PolarHBondContact OG-N 3.39Å; A6-R8 PolarHBondContact O-N 3.42Å; A6-V9 PolarHBondContact O-N 3.28Å; A6-F10 HydrophobicContact CB-CD2 4.46Å; A6-F10 HydrophobicContact CB-CE2 4.43Å; A6-F10 WeakPolarHBondContact O-CD2 3.21Å; A6-F10 PolarHBondContact O-N 3.43Å
7Q76.3Confident70.2Confident98 Ų98104.7 Ų104.746%0.45852%0.523SS..Hα-helixtrans-63.8-40.9-179.4-173.5175.3-3900111.8M3 S4 L5 V9 F10 L11M3-Q7 PolarHBondContact SD-NE2 3.49Å; S4-Q7 WeakPolarHBondContact O-CB 3.45Å; S4-Q7 PolarHBondContact O-N 2.78Å; L5-Q7 PolarHBondContact O-N 3.03Å; Q7-V9 VanDerWaalsContact C-N 3.32Å; Q7-V9 PolarHBondContact O-N 2.85Å; Q7-F10 PolarHBondContact O-N 3.26Å; Q7-L11 WeakPolarHBondContact O-CB 3.32Å; Q7-L11 PolarHBondContact O-N 2.65Å
8R73.2Confident70.5Confident98 Ų98102.5 Ų102.537%0.3752%0.516SS..Hα-helixtrans-61.3-43.2175.2-70.1-179.2168.3-170.1-2.6111.6M3 S4 L5 A6 S12 M52M3-R8 HydrophobicContact CB-CG 4.1Å; S4-R8 PolarHBondContact O-N 3.3Å; S4-R8 VanDerWaalsContact O-N 3.1Å; L5-R8 PolarHBondContact O-N 2.75Å; A6-R8 PolarHBondContact O-N 3.42Å; R8-S12 WeakPolarHBondContact O-CB 3.49Å; R8-S12 PolarHBondContact O-N 3.48Å; R8-S12 PolarHBondContact O-OG 3.43Å; R8-M52 PolarHBondContact NH2-SD 2.99Å; R8-M52 VanDerWaalsContact NH2-SD 3.41Å
9V75.2Confident70.5Confident75 Ų7597.7 Ų97.746%0.45549%0.491SS..Hα-helixtrans-62.6-55.8177.61730000109.5L5 A6 Q7 L11 S12 W13L5-V9 VanDerWaalsContact O-CG2 3.28Å; L5-V9 WeakPolarHBondContact O-CG2 3.42Å; L5-V9 PolarHBondContact O-N 2.71Å; A6-V9 PolarHBondContact O-N 3.28Å; Q7-V9 VanDerWaalsContact C-N 3.32Å; Q7-V9 PolarHBondContact O-N 2.85Å; V9-L11 VanDerWaalsContact C-N 3.3Å; V9-L11 PolarHBondContact O-N 2.9Å; V9-S12 WeakPolarHBondContact O-CA 3.45Å; V9-S12 VanDerWaalsContact O-CB 3.3Å; V9-S12 WeakPolarHBondContact O-CB 3.38Å; V9-S12 PolarHBondContact O-N 3.49Å; V9-W13 VanDerWaalsContact CG1-CD1 3.41Å; V9-W13 PolarHBondContact O-N 2.92Å
10F78.9Confident70.3Confident138 Ų13898.5 Ų98.561%0.60550%0.496SS*.Hα-helixtrans-54.8-44.5178.5-78.6-66.3000112.7A6 Q7 S12 W13 I14A6-F10 HydrophobicContact CB-CD2 4.46Å; A6-F10 HydrophobicContact CB-CE2 4.43Å; A6-F10 WeakPolarHBondContact O-CD2 3.21Å; A6-F10 PolarHBondContact O-N 3.43Å; Q7-F10 PolarHBondContact O-N 3.26Å; F10-S12 VanDerWaalsContact C-N 3.33Å; F10-S12 PolarHBondContact O-N 3.28Å; F10-W13 PolarHBondContact O-N 3.38Å; F10-I14 WeakPolarHBondContact O-CB 3.31Å; F10-I14 WeakPolarHBondContact O-CD1 3.35Å; F10-I14 WeakPolarHBondContact O-CG1 3.27Å; F10-I14 PolarHBondContact O-N 3.36Å
11L74.8Confident70.5Confident77 Ų7797.9 Ų97.940%0.40349%0.494SS..Hα-helixtrans-60.1-44.8177.1-144.9105.4000111.2Q7 V9 W13 I14 F15 F45Q7-L11 WeakPolarHBondContact O-CB 3.32Å; Q7-L11 PolarHBondContact O-N 2.65Å; V9-L11 VanDerWaalsContact C-N 3.3Å; V9-L11 PolarHBondContact O-N 2.9Å; L11-W13 VanDerWaalsContact C-N 3.33Å; L11-W13 PolarHBondContact O-N 2.94Å; L11-I14 PolarHBondContact O-N 2.9Å; L11-F15 HydrophobicContact CD2-CD2 3.99Å; L11-F15 HydrophobicContact CD2-CE2 3.76Å; L11-F15 HydrophobicContact CG-CD2 4.1Å; L11-F15 HydrophobicContact CG-CE2 4.08Å; L11-F15 WeakPolarHBondContact O-CB 3.39Å; L11-F15 WeakPolarHBondContact O-CD2 3.28Å; L11-F15 PolarHBondContact O-N 3.29Å; L11-F45 HydrophobicContact CD2-CE2 4.32Å
12S72.3Confident71.5Confident33 Ų3391.1 Ų91.123%0.23146%0.46CS..Hα-helixtrans-59.4-43.7177-520000111.9R8 V9 F10 A16 F45R8-S12 WeakPolarHBondContact O-CB 3.49Å; R8-S12 PolarHBondContact O-N 3.48Å; R8-S12 PolarHBondContact O-OG 3.43Å; V9-S12 WeakPolarHBondContact O-CA 3.45Å; V9-S12 VanDerWaalsContact O-CB 3.3Å; V9-S12 WeakPolarHBondContact O-CB 3.38Å; V9-S12 PolarHBondContact O-N 3.49Å; F10-S12 VanDerWaalsContact C-N 3.33Å; F10-S12 PolarHBondContact O-N 3.28Å; S12-A16 VanDerWaalsContact O-CB 3.3Å; S12-A16 WeakPolarHBondContact O-CB 3.3Å; S12-A16 PolarHBondContact O-N 2.88Å; S12-F45 WeakPolarHBondContact OG-CZ 3.3Å
13W73.8Confident72.4Confident182 Ų18281.2 Ų81.269%0.68942%0.418SS*.Hα-helixtrans-66-44.4178.5-80.198.8000111.4V9 F10 L11 A16 L17V9-W13 VanDerWaalsContact CG1-CD1 3.41Å; V9-W13 PolarHBondContact O-N 2.92Å; F10-W13 PolarHBondContact O-N 3.38Å; L11-W13 VanDerWaalsContact C-N 3.33Å; L11-W13 PolarHBondContact O-N 2.94Å; W13-A16 PolarHBondContact O-N 3.43Å; W13-L17 WeakPolarHBondContact O-CB 3.42Å; W13-L17 PolarHBondContact O-N 3.16Å
14I76.7Confident72.8Confident102 Ų10280.2 Ų80.252%0.52342%0.422SS..Hα-helixtrans-62.7-47.2178.3-66159.8000110.5F10 L11 A16 L17 V18F10-I14 WeakPolarHBondContact O-CB 3.31Å; F10-I14 WeakPolarHBondContact O-CD1 3.35Å; F10-I14 WeakPolarHBondContact O-CG1 3.27Å; F10-I14 PolarHBondContact O-N 3.36Å; L11-I14 PolarHBondContact O-N 2.9Å; I14-A16 VanDerWaalsContact C-N 3.33Å; I14-A16 PolarHBondContact O-N 2.99Å; I14-L17 WeakPolarHBondContact O-CB 3.44Å; I14-L17 PolarHBondContact O-N 3.12Å; I14-L17 VanDerWaalsContact O-N 3.15Å; I14-V18 HydrophobicContact CG2-CG2 4.48Å; I14-V18 WeakPolarHBondContact O-CG2 3.48Å; I14-V18 PolarHBondContact O-N 2.93Å
15F72.6Confident72.4Confident67 Ų6781 Ų8129%0.29442%0.42SS..Hα-helixtrans-61.8-39.8176.5-92-83.7000112.3L11 L17 F19 P41 F45L11-F15 HydrophobicContact CD2-CD2 3.99Å; L11-F15 HydrophobicContact CD2-CE2 3.76Å; L11-F15 HydrophobicContact CG-CD2 4.1Å; L11-F15 HydrophobicContact CG-CE2 4.08Å; L11-F15 WeakPolarHBondContact O-CB 3.39Å; L11-F15 WeakPolarHBondContact O-CD2 3.28Å; L11-F15 PolarHBondContact O-N 3.29Å; F15-L17 VanDerWaalsContact C-N 3.33Å; F15-F19 WeakPolarHBondContact O-CB 2.92Å; F15-F19 PolarHBondContact O-N 2.94Å; F15-P41 HydrophobicContact CD1-CB 3.8Å; F15-P41 HydrophobicContact CE1-CB 4.15Å; F15-F45 HydrophobicContact CD2-CD2 4.29Å; F15-F45 HydrophobicContact CG-CD2 4.45Å
16A69.1Low72.2Confident38 Ų3876 Ų7631%0.31439%0.393SS..Hα-helixtrans-64-38.4174.200000112.1S12 W13 I14 F19 L20S12-A16 VanDerWaalsContact O-CB 3.3Å; S12-A16 WeakPolarHBondContact O-CB 3.3Å; S12-A16 PolarHBondContact O-N 2.88Å; W13-A16 PolarHBondContact O-N 3.43Å; I14-A16 VanDerWaalsContact C-N 3.33Å; I14-A16 PolarHBondContact O-N 2.99Å; A16-F19 PolarHBondContact O-N 3.27Å; A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 2.97Å
17L70.9Confident71.5Confident100 Ų10077.8 Ų77.852%0.52439%0.394SS..Hα-helixtrans-69.2-43.8179-142.2163000111.2W13 I14 F15 F19 L20 I21W13-L17 WeakPolarHBondContact O-CB 3.42Å; W13-L17 PolarHBondContact O-N 3.16Å; I14-L17 WeakPolarHBondContact O-CB 3.44Å; I14-L17 PolarHBondContact O-N 3.12Å; I14-L17 VanDerWaalsContact O-N 3.15Å; F15-L17 VanDerWaalsContact C-N 3.33Å; L17-F19 VanDerWaalsContact C-N 3.33Å; L17-F19 PolarHBondContact O-N 3.01Å; L17-L20 WeakPolarHBondContact O-CB 3.05Å; L17-L20 PolarHBondContact O-N 2.73Å; L17-I21 HydrophobicContact CD2-CD1 3.42Å; L17-I21 VanDerWaalsContact CD2-CD1 3.42Å; L17-I21 HydrophobicContact CD2-CG1 3.97Å; L17-I21 VanDerWaalsContact O-CG1 3.27Å; L17-I21 WeakPolarHBondContact O-CG1 3.28Å; L17-I21 PolarHBondContact O-N 3.33Å
18V75.7Confident71.1Confident65 Ų6578.1 Ų78.139%0.39440%0.4SS..Hα-helixtrans-61.1-43174.2172.50000111.1I14 I21 M22I14-V18 HydrophobicContact CG2-CG2 4.48Å; I14-V18 WeakPolarHBondContact O-CG2 3.48Å; I14-V18 PolarHBondContact O-N 2.93Å; V18-I21 PolarHBondContact O-N 3.35Å; V18-M22 PolarHBondContact O-N 2.84Å
19F71.5Confident70.6Confident12 Ų1278.5 Ų78.55%0.05342%0.417CS..Hα-helixtrans-59.2-47.6173.6172.3-99.5000111.7F15 A16 L17 I21 M22 L23 I38 F39 V42 C91F15-F19 WeakPolarHBondContact O-CB 2.92Å; F15-F19 PolarHBondContact O-N 2.94Å; A16-F19 PolarHBondContact O-N 3.27Å; L17-F19 VanDerWaalsContact C-N 3.33Å; L17-F19 PolarHBondContact O-N 3.01Å; F19-I21 VanDerWaalsContact C-N 3.32Å; F19-I21 PolarHBondContact O-N 2.84Å; F19-M22 PolarHBondContact O-N 3.21Å; F19-L23 HydrophobicContact CE1-CD2 4.25Å; F19-L23 HydrophobicContact CZ-CD2 4.5Å; F19-L23 VanDerWaalsContact O-CB 3.25Å; F19-L23 WeakPolarHBondContact O-CB 3.33Å; F19-L23 PolarHBondContact O-N 2.83Å; F19-I38 HydrophobicContact CD2-CG2 4.25Å; F19-I38 VanDerWaalsContact CD2-O 3.24Å; F19-I38 WeakPolarHBondContact CD2-O 3.15Å; F19-I38 HydrophobicContact CE2-CG2 3.95Å; F19-F39 AromaticContact CE2-CD1 3.53Å; F19-F39 HydrophobicContact CE2-CD1 3.53Å; F19-F39 AromaticContact CE2-CE1 3.63Å; F19-F39 HydrophobicContact CE2-CE1 3.63Å; F19-F39 HydrophobicContact CE2-CG 4.16Å; F19-F39 HydrophobicContact CE2-CZ 4.33Å; F19-F39 AromaticContact CZ-CD1 3.93Å; F19-F39 HydrophobicContact CZ-CD1 3.93Å; F19-F39 AromaticContact CZ-CE1 3.53Å; F19-F39 HydrophobicContact CZ-CE1 3.53Å; F19-F39 HydrophobicContact CZ-CZ 4.13Å; F19-V42 HydrophobicContact CB-CG2 4.14Å; F19-V42 HydrophobicContact CD1-CG2 4.43Å; F19-V42 HydrophobicContact CD2-CG2 3.52Å; F19-V42 HydrophobicContact CE2-CG2 4.02Å; F19-V42 HydrophobicContact CG-CG2 3.76Å; F19-C91 HydrophobicContact CE1-CB 4.21Å; F19-C91 HydrophobicContact CZ-CB 4.17Å
20L66.9Low69.9Low112 Ų11282.6 Ų82.659%0.58643%0.429SS*.Hα-helixtrans-59.9-42178.1-164.792.6000111.7A16 L17 L23 A24A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 2.97Å; L17-L20 WeakPolarHBondContact O-CB 3.05Å; L17-L20 PolarHBondContact O-N 2.73Å; L20-L23 PolarHBondContact O-N 3.45Å; L20-A24 WeakPolarHBondContact O-CB 3.32Å; L20-A24 PolarHBondContact O-N 3.48Å
21I72.8Confident69.1Low87 Ų8778.8 Ų78.845%0.44641%0.414SS..Hα-helixtrans-65.1-51177.3-69.5165.5000110.4L17 V18 F19 L23 A24 L25L17-I21 HydrophobicContact CD2-CD1 3.42Å; L17-I21 VanDerWaalsContact CD2-CD1 3.42Å; L17-I21 HydrophobicContact CD2-CG1 3.97Å; L17-I21 VanDerWaalsContact O-CG1 3.27Å; L17-I21 WeakPolarHBondContact O-CG1 3.28Å; L17-I21 PolarHBondContact O-N 3.33Å; V18-I21 PolarHBondContact O-N 3.35Å; F19-I21 VanDerWaalsContact C-N 3.32Å; F19-I21 PolarHBondContact O-N 2.84Å; I21-L23 PolarHBondContact O-N 2.86Å; I21-A24 PolarHBondContact O-N 3.23Å; I21-A24 VanDerWaalsContact O-N 3.15Å; I21-L25 HydrophobicContact CG2-CD1 3.64Å; I21-L25 WeakPolarHBondContact O-CD1 3.44Å; I21-L25 PolarHBondContact O-N 2.88Å
22M69.8Low68.5Low78 Ų7884.3 Ų84.338%0.38444%0.438SS..Hα-helixtrans-57.8-38.3176.7-80.8-170.1152.200112V18 F19 K26 I38V18-M22 PolarHBondContact O-N 2.84Å; F19-M22 PolarHBondContact O-N 3.21Å; M22-K26 WeakPolarHBondContact O-CB 3.35Å; M22-K26 PolarHBondContact O-N 3.42Å; M22-I38 HydrophobicContact CB-CG2 4.21Å
23L68Low68.3Low11 Ų1189.7 Ų89.76%0.05845%0.453CS..Hα-helixtrans-65.7-45.5175.9-175.468.5000111.8F19 L20 I21 K26 L27 W35 I38 C95F19-L23 HydrophobicContact CE1-CD2 4.25Å; F19-L23 HydrophobicContact CZ-CD2 4.5Å; F19-L23 VanDerWaalsContact O-CB 3.25Å; F19-L23 WeakPolarHBondContact O-CB 3.33Å; F19-L23 PolarHBondContact O-N 2.83Å; L20-L23 PolarHBondContact O-N 3.45Å; I21-L23 PolarHBondContact O-N 2.86Å; L23-K26 WeakPolarHBondContact O-CB 3.38Å; L23-K26 PolarHBondContact O-N 2.96Å; L23-L27 PolarHBondContact O-N 3.48Å; L23-W35 HydrophobicContact CD1-CZ3 3.91Å; L23-I38 HydrophobicContact CB-CG2 4.37Å; L23-I38 HydrophobicContact CD1-CG2 4.42Å; L23-C95 VanDerWaalsContact CD1-SG 3.53Å
24A67.6Low67.9Low55 Ų5586.8 Ų86.846%0.45545%0.451SS..Hα-helixtrans-62.5-42.1176.700000111.9L20 I21 K26 L27 D28L20-A24 WeakPolarHBondContact O-CB 3.32Å; L20-A24 PolarHBondContact O-N 3.48Å; I21-A24 PolarHBondContact O-N 3.23Å; I21-A24 VanDerWaalsContact O-N 3.15Å; A24-K26 VanDerWaalsContact C-N 3.32Å; A24-K26 PolarHBondContact O-N 3.45Å; A24-L27 WeakPolarHBondContact O-CB 3.46Å; A24-L27 PolarHBondContact O-N 3.42Å; A24-L27 VanDerWaalsContact O-N 3.16Å; A24-D28 PolarHBondContact O-N 3.31Å
25L68.4Low67.4Low83 Ų8385 Ų8544%0.43544%0.438SS..Hα-helixtrans-65-35.2176-89.978000112.6I21 L27 I31I21-L25 HydrophobicContact CG2-CD1 3.64Å; I21-L25 WeakPolarHBondContact O-CD1 3.44Å; I21-L25 PolarHBondContact O-N 2.88Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-I31 HydrophobicContact CB-CD1 4.15Å; L25-I31 HydrophobicContact CD2-CD1 4.09Å
26K67.4Low67Low36 Ų3687.9 Ų87.916%0.15745%0.451CS..Hα-helixtrans-65.6-40.3172.5179.264.7175.5-177.60111.3M22 L23 A24 D28 S29 I31 Q32 W33 W35 I38M22-K26 WeakPolarHBondContact O-CB 3.35Å; M22-K26 PolarHBondContact O-N 3.42Å; L23-K26 WeakPolarHBondContact O-CB 3.38Å; L23-K26 PolarHBondContact O-N 2.96Å; A24-K26 VanDerWaalsContact C-N 3.32Å; A24-K26 PolarHBondContact O-N 3.45Å; K26-D28 VanDerWaalsContact C-N 3.32Å; K26-S29 PolarHBondContact O-N 2.87Å; K26-S29 VanDerWaalsContact O-N 3.12Å; K26-I31 WeakPolarHBondContact CD-O 3.25Å; K26-I31 WeakPolarHBondContact CE-O 3.47Å; K26-I31 PolarHBondContact NZ-O 3.27Å; K26-Q32 VanDerWaalsContact NZ-C 3.28Å; K26-W33 WeakPolarHBondContact CE-O 3.31Å; K26-W33 PolarHBondContact NZ-O 2.9Å; K26-W35 HydrophobicContact CG-CH2 4.09Å; K26-W35 HydrophobicContact CG-CZ2 4.32Å; K26-W35 HydrophobicContact CG-CZ3 4.34Å; K26-I38 HydrophobicContact CB-CD1 3.56Å; K26-I38 HydrophobicContact CD-CD1 3.87Å; K26-I38 HydrophobicContact CG-CD1 3.43Å; K26-I38 VanDerWaalsContact CG-CD1 3.43Å
27L60.6Low67Low86 Ų8689.7 Ų89.745%0.4546%0.455SS..Hα-helixtrans-67.2-34.1-179.5-163.669.5000112.7L23 A24 L25 S29 L98L23-L27 PolarHBondContact O-N 3.48Å; A24-L27 WeakPolarHBondContact O-CB 3.46Å; A24-L27 PolarHBondContact O-N 3.42Å; A24-L27 VanDerWaalsContact O-N 3.16Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 2.87Å; L27-L98 HydrophobicContact CB-CD2 4.36Å; L27-L98 HydrophobicContact CD1-CB 3.49Å; L27-L98 VanDerWaalsContact CD1-CB 3.49Å; L27-L98 HydrophobicContact CD1-CD2 3.58Å; L27-L98 HydrophobicContact CD1-CG 3.38Å; L27-L98 HydrophobicContact CD2-CD1 4.45Å; L27-L98 HydrophobicContact CD2-CD2 3.5Å; L27-L98 VanDerWaalsContact CD2-CD2 3.5Å; L27-L98 HydrophobicContact CD2-CG 3.55Å; L27-L98 HydrophobicContact CG-CD2 3.97Å; L27-L98 HydrophobicContact CG-CG 4.04Å
28D67.8Low66.9Low106 Ų10685.3 Ų85.357%0.56743%0.432SS*.THydrogen-bonded Turntrans-65.74.3172.7-151.9-104.1000112.8A24 K26 K30A24-D28 PolarHBondContact O-N 3.31Å; K26-D28 VanDerWaalsContact C-N 3.32Å; D28-K30 HydrophobicContact CB-CG 3.88Å; D28-K30 PolarHBondContact O-N 3.47Å; D28-K30 WeakPolarHBondContact OD1-CE 3.39Å; D28-K30 WeakPolarHBondContact OD1-CG 3.49Å
29S62.4Low66.6Low106 Ų10683.3 Ų83.374%0.74142%0.418SS*.THydrogen-bonded Turntrans54.814.5-176.3-71.60000114.5K26 L27 I31K26-S29 PolarHBondContact O-N 2.87Å; K26-S29 VanDerWaalsContact O-N 3.12Å; L27-S29 PolarHBondContact O-N 2.87Å; S29-I31 PolarHBondContact O-N 3.11Å
30K60.3Low66.9Low161 Ų16186.6 Ų86.670%0.744%0.436SS*.  trans-68.8-22.2178.6-67-81.4-178173.60112.5D28D28-K30 HydrophobicContact CB-CG 3.88Å; D28-K30 PolarHBondContact O-N 3.47Å; D28-K30 WeakPolarHBondContact OD1-CE 3.39Å; D28-K30 WeakPolarHBondContact OD1-CG 3.49Å
31I61.8Low67.1Low58 Ų5882 Ų8230%0.29741%0.412SS..  trans-137.3118.3-167.1-54.9-178000111.4L25 K26 S29 W33L25-I31 HydrophobicContact CB-CD1 4.15Å; L25-I31 HydrophobicContact CD2-CD1 4.09Å; K26-I31 WeakPolarHBondContact CD-O 3.25Å; K26-I31 WeakPolarHBondContact CE-O 3.47Å; K26-I31 PolarHBondContact NZ-O 3.27Å; S29-I31 PolarHBondContact O-N 3.11Å; I31-W33 HydrophobicContact CG2-CB 3.7Å; I31-W33 HydrophobicContact CG2-CD2 3.86Å; I31-W33 HydrophobicContact CG2-CG 3.28Å; I31-W33 PolarHBondContact O-N 3.27Å
32Q62Low67Low193 Ų19378.8 Ų78.890%0.90240%0.397SS*.  trans-84.123.5177.2-67.8-127.8-6.300114.3K26K26-Q32 VanDerWaalsContact NZ-C 3.28Å
33W68Low67.1Low145 Ų14581.9 Ų81.955%0.54940%0.404SS..  trans-69.2152.3-175.6-74.220000112.8K26 I31 L37K26-W33 WeakPolarHBondContact CE-O 3.31Å; K26-W33 PolarHBondContact NZ-O 2.9Å; I31-W33 HydrophobicContact CG2-CB 3.7Å; I31-W33 HydrophobicContact CG2-CD2 3.86Å; I31-W33 HydrophobicContact CG2-CG 3.28Å; I31-W33 PolarHBondContact O-N 3.27Å; W33-L37 HydrophobicContact CD2-CD2 4.09Å; W33-L37 HydrophobicContact CE3-CB 4.23Å; W33-L37 HydrophobicContact CE3-CD2 3.27Å; W33-L37 HydrophobicContact CE3-CG 4.34Å; W33-L37 HydrophobicContact CH2-CD2 4.28Å; W33-L37 HydrophobicContact CZ3-CD2 3.4Å
34N65.6Low67.6Low121 Ų12185 Ų8565%0.64742%0.42SS*.  trans-65.1139.9179.3-149.4-5.4000110.2F36 L37N34-F36 PolarHBondContact O-N 3.45Å; N34-F36 VanDerWaalsContact O-N 3.09Å; N34-L37 PolarHBondContact O-N 2.91Å
35W65.6Low67.9Low65 Ų6583.3 Ų83.325%0.24640%0.403CS..Hα-helixtrans-56.8-31.2-177.8-73.195.2000112.3L23 K26 L37 I38 F39 C95 Q99L23-W35 HydrophobicContact CD1-CZ3 3.91Å; K26-W35 HydrophobicContact CG-CH2 4.09Å; K26-W35 HydrophobicContact CG-CZ2 4.32Å; K26-W35 HydrophobicContact CG-CZ3 4.34Å; W35-L37 PolarHBondContact O-N 3.02Å; W35-I38 HydrophobicContact CE3-CD1 4.01Å; W35-I38 HydrophobicContact CZ3-CD1 4.34Å; W35-I38 PolarHBondContact O-N 3.15Å; W35-I38 VanDerWaalsContact O-N 3.13Å; W35-F39 VanDerWaalsContact O-CD2 3.24Å; W35-F39 WeakPolarHBondContact O-CD2 3.48Å; W35-F39 PolarHBondContact O-N 2.88Å; W35-C95 HydrophobicContact CZ3-CB 4.27Å; W35-Q99 HydrophobicContact CZ2-CG 4.16Å
36F64.4Low68.1Low127 Ų12780 Ų8056%0.55739%0.385SS*.Hα-helixtrans-55.8-35.7175-145.1-92000113.6N34 F39 L40N34-F36 PolarHBondContact O-N 3.45Å; N34-F36 VanDerWaalsContact O-N 3.09Å; F36-F39 PolarHBondContact O-N 3.29Å; F36-L40 PolarHBondContact O-N 3.42Å
37L70.4Confident68.6Low77 Ų7782.1 Ų82.140%0.40340%0.401SS..Hα-helixtrans-72.3-32.1179.5-116.176.2000112.7W33 N34 W35 F39 L40W33-L37 HydrophobicContact CD2-CD2 4.09Å; W33-L37 HydrophobicContact CE3-CB 4.23Å; W33-L37 HydrophobicContact CE3-CD2 3.27Å; W33-L37 HydrophobicContact CE3-CG 4.34Å; W33-L37 HydrophobicContact CH2-CD2 4.28Å; W33-L37 HydrophobicContact CZ3-CD2 3.4Å; N34-L37 PolarHBondContact O-N 2.91Å; W35-L37 PolarHBondContact O-N 3.02Å; L37-F39 VanDerWaalsContact C-N 3.3Å; L37-L40 VanDerWaalsContact O-CB 3.27Å; L37-L40 WeakPolarHBondContact O-CB 3.24Å; L37-L40 PolarHBondContact O-N 2.88Å
38I69Low69.5Low8 Ų881.8 Ų81.84%0.04140%0.399CS..Hα-helixtrans-69-36.1176.4-58.8168.1000109.6F19 M22 L23 K26 W35 P41F19-I38 HydrophobicContact CD2-CG2 4.25Å; F19-I38 VanDerWaalsContact CD2-O 3.24Å; F19-I38 WeakPolarHBondContact CD2-O 3.15Å; F19-I38 HydrophobicContact CE2-CG2 3.95Å; M22-I38 HydrophobicContact CB-CG2 4.21Å; L23-I38 HydrophobicContact CB-CG2 4.37Å; L23-I38 HydrophobicContact CD1-CG2 4.42Å; K26-I38 HydrophobicContact CB-CD1 3.56Å; K26-I38 HydrophobicContact CD-CD1 3.87Å; K26-I38 HydrophobicContact CG-CD1 3.43Å; K26-I38 VanDerWaalsContact CG-CD1 3.43Å; W35-I38 HydrophobicContact CE3-CD1 4.01Å; W35-I38 HydrophobicContact CZ3-CD1 4.34Å; W35-I38 PolarHBondContact O-N 3.15Å; W35-I38 VanDerWaalsContact O-N 3.13Å; I38-P41 WeakPolarHBondContact O-CD 3.45Å; I38-P41 WeakPolarHBondContact O-CG 3.44Å
39F68.8Low69.7Low22 Ų2279.9 Ų79.910%0.09639%0.388CS..Hα-helixtrans-80.8-15.8177.8-76.2-73.8000114F19 W35 F36 L37 V42 W43 C91 L92F19-F39 AromaticContact CE2-CD1 3.53Å; F19-F39 HydrophobicContact CE2-CD1 3.53Å; F19-F39 AromaticContact CE2-CE1 3.63Å; F19-F39 HydrophobicContact CE2-CE1 3.63Å; F19-F39 HydrophobicContact CE2-CG 4.16Å; F19-F39 HydrophobicContact CE2-CZ 4.33Å; F19-F39 AromaticContact CZ-CD1 3.93Å; F19-F39 HydrophobicContact CZ-CD1 3.93Å; F19-F39 AromaticContact CZ-CE1 3.53Å; F19-F39 HydrophobicContact CZ-CE1 3.53Å; F19-F39 HydrophobicContact CZ-CZ 4.13Å; W35-F39 VanDerWaalsContact O-CD2 3.24Å; W35-F39 WeakPolarHBondContact O-CD2 3.48Å; W35-F39 PolarHBondContact O-N 2.88Å; F36-F39 PolarHBondContact O-N 3.29Å; L37-F39 VanDerWaalsContact C-N 3.3Å; F39-V42 WeakPolarHBondContact O-CA 3.46Å; F39-V42 WeakPolarHBondContact O-CB 3.18Å; F39-V42 PolarHBondContact O-N 3.24Å; F39-W43 VanDerWaalsContact O-CD1 3.3Å; F39-W43 PolarHBondContact O-N 3.25Å; F39-C91 HydrophobicContact CE1-CB 4.1Å; F39-L92 HydrophobicContact CE2-CD2 4.5Å; F39-L92 HydrophobicContact CZ-CD2 4.11Å
40L78.2Confident70.3Confident82 Ų8278 Ų7843%0.42937%0.37SS..Hα-helixtrans-45.9-49.4179.3-165111.7000114.6F36 L37 V42 W43 I44F36-L40 PolarHBondContact O-N 3.42Å; L37-L40 VanDerWaalsContact O-CB 3.27Å; L37-L40 WeakPolarHBondContact O-CB 3.24Å; L37-L40 PolarHBondContact O-N 2.88Å; L40-V42 VanDerWaalsContact C-N 3.26Å; L40-V42 PolarHBondContact O-N 3.13Å; L40-W43 PolarHBondContact O-N 3.09Å; L40-I44 HydrophobicContact CD2-CD1 3.83Å; L40-I44 HydrophobicContact CG-CD1 4.06Å; L40-I44 WeakPolarHBondContact O-CG1 3.32Å; L40-I44 PolarHBondContact O-N 3.39Å
41P69.7Low71.3Confident14 Ų1475.4 Ų75.49%0.09136%0.363CS..Hα-helixtrans-59.5-33.3176.118.4-31.2000113.9F15 I38 F45F15-P41 HydrophobicContact CD1-CB 3.8Å; F15-P41 HydrophobicContact CE1-CB 4.15Å; I38-P41 WeakPolarHBondContact O-CD 3.45Å; I38-P41 WeakPolarHBondContact O-CG 3.44Å; P41-F45 WeakPolarHBondContact O-CB 3.34Å; P41-F45 PolarHBondContact O-N 3.47Å
42V72.3Confident71.9Confident20 Ų2075.9 Ų75.912%0.12136%0.364CS..Hα-helixtrans-73.1-46.6176.5178.80000110.3F19 F39 L40 I44 F45 D46 L88F19-V42 HydrophobicContact CB-CG2 4.14Å; F19-V42 HydrophobicContact CD1-CG2 4.43Å; F19-V42 HydrophobicContact CD2-CG2 3.52Å; F19-V42 HydrophobicContact CE2-CG2 4.02Å; F19-V42 HydrophobicContact CG-CG2 3.76Å; F39-V42 WeakPolarHBondContact O-CA 3.46Å; F39-V42 WeakPolarHBondContact O-CB 3.18Å; F39-V42 PolarHBondContact O-N 3.24Å; L40-V42 VanDerWaalsContact C-N 3.26Å; L40-V42 PolarHBondContact O-N 3.13Å; V42-I44 VanDerWaalsContact C-N 3.31Å; V42-I44 PolarHBondContact O-N 2.79Å; V42-F45 PolarHBondContact O-N 3.44Å; V42-F45 VanDerWaalsContact O-N 3.13Å; V42-D46 WeakPolarHBondContact O-CB 3.48Å; V42-D46 PolarHBondContact O-N 2.92Å; V42-D46 VanDerWaalsContact O-OD2 3.09Å; V42-L88 HydrophobicContact CG1-CD2 3.95Å
43W71.9Confident72.2Confident143 Ų14368.2 Ų68.254%0.54233%0.329SS..Hα-helixtrans-57.6-43.2178.5-84.179.6000112.7F39 L40 T47F39-W43 VanDerWaalsContact O-CD1 3.3Å; F39-W43 PolarHBondContact O-N 3.25Å; L40-W43 PolarHBondContact O-N 3.09Å; W43-T47 WeakPolarHBondContact O-CB 3.47Å; W43-T47 PolarHBondContact O-N 2.85Å; W43-T47 PolarHBondContact O-OG1 2.95Å
44I77.8Confident72.5Confident76 Ų7664.7 Ų64.739%0.3932%0.32SS..Hα-helixtrans-64.4-44177.5-67.4171.1000110.4L40 V42 T47 I48L40-I44 HydrophobicContact CD2-CD1 3.83Å; L40-I44 HydrophobicContact CG-CD1 4.06Å; L40-I44 WeakPolarHBondContact O-CG1 3.32Å; L40-I44 PolarHBondContact O-N 3.39Å; V42-I44 VanDerWaalsContact C-N 3.31Å; V42-I44 PolarHBondContact O-N 2.79Å; I44-T47 WeakPolarHBondContact CA-OG1 3.34Å; I44-T47 PolarHBondContact O-N 3.12Å; I44-T47 PolarHBondContact O-OG1 2.85Å; I44-I48 HydrophobicContact CG2-CD1 3.76Å; I44-I48 WeakPolarHBondContact O-CD1 3.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.43Å; I44-I48 PolarHBondContact O-N 3Å
45F73.3Confident73Confident21 Ų2163.3 Ų63.39%0.09232%0.315CS..Hα-helixtrans-64.3-45.4179.6-174.3-98.8000112.1L11 S12 F15 P41 V42 I48 L49L11-F45 HydrophobicContact CD2-CE2 4.32Å; S12-F45 WeakPolarHBondContact OG-CZ 3.3Å; F15-F45 HydrophobicContact CD2-CD2 4.29Å; F15-F45 HydrophobicContact CG-CD2 4.45Å; P41-F45 WeakPolarHBondContact O-CB 3.34Å; P41-F45 PolarHBondContact O-N 3.47Å; V42-F45 PolarHBondContact O-N 3.44Å; V42-F45 VanDerWaalsContact O-N 3.13Å; F45-I48 PolarHBondContact O-N 2.94Å; F45-L49 HydrophobicContact CD1-CD1 3.94Å; F45-L49 HydrophobicContact CD1-CG 4.44Å; F45-L49 HydrophobicContact CE1-CD1 3.34Å; F45-L49 HydrophobicContact CE1-CG 3.98Å; F45-L49 HydrophobicContact CZ-CD1 3.86Å; F45-L49 HydrophobicContact CZ-CD2 4.35Å; F45-L49 HydrophobicContact CZ-CG 4.11Å; F45-L49 PolarHBondContact O-N 2.84Å
46D72.4Confident73.1Confident14 Ų1465.5 Ų65.58%0.07533%0.328CS..Hα-helixtrans-60-47176.2-81.6-133.7000112.1V42 I48 L49 I50 L84V42-D46 WeakPolarHBondContact O-CB 3.48Å; V42-D46 PolarHBondContact O-N 2.92Å; V42-D46 VanDerWaalsContact O-OD2 3.09Å; D46-I48 VanDerWaalsContact C-N 3.35Å; D46-I48 PolarHBondContact O-N 3.26Å; D46-L49 PolarHBondContact O-N 2.95Å; D46-I50 WeakPolarHBondContact O-CG1 3.4Å; D46-I50 PolarHBondContact O-N 3.43Å; D46-L84 HydrophobicContact CB-CD1 4.29Å; D46-L84 HydrophobicContact CB-CD2 4.27Å; D46-L84 WeakPolarHBondContact OD1-CD1 3.41Å; D46-L84 VanDerWaalsContact OD1-CD2 3.24Å; D46-L84 WeakPolarHBondContact OD1-CD2 3.45Å; D46-L84 WeakPolarHBondContact OD1-CG 3.3Å
47T77.7Confident73.1Confident80 Ų8061.6 Ų61.649%0.49131%0.312SS..Hα-helixtrans-63.2-39.4177.8340000112.3W43 I44 I50 L51W43-T47 WeakPolarHBondContact O-CB 3.47Å; W43-T47 PolarHBondContact O-N 2.85Å; W43-T47 PolarHBondContact O-OG1 2.95Å; I44-T47 WeakPolarHBondContact CA-OG1 3.34Å; I44-T47 PolarHBondContact O-N 3.12Å; I44-T47 PolarHBondContact O-OG1 2.85Å; T47-I50 PolarHBondContact O-N 3.44Å; T47-L51 VanDerWaalsContact O-CB 3.25Å; T47-L51 WeakPolarHBondContact O-CB 3.45Å; T47-L51 PolarHBondContact O-N 2.94Å
48I79.7Confident73.1Confident78 Ų7860.8 Ų60.840%0.432%0.317SS..Hα-helixtrans-63.3-42.4175.4-69.6166.1000111.1I44 F45 D46 L51 M52I44-I48 HydrophobicContact CG2-CD1 3.76Å; I44-I48 WeakPolarHBondContact O-CD1 3.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.43Å; I44-I48 PolarHBondContact O-N 3Å; F45-I48 PolarHBondContact O-N 2.94Å; D46-I48 VanDerWaalsContact C-N 3.35Å; D46-I48 PolarHBondContact O-N 3.26Å; I48-L51 PolarHBondContact O-N 3.32Å; I48-M52 HydrophobicContact CG2-CE 4.01Å; I48-M52 WeakPolarHBondContact O-CG 2.96Å; I48-M52 PolarHBondContact O-N 3.42Å
49L73.3Confident73Confident66 Ų6663.4 Ų63.435%0.34635%0.346SS..Hα-helixtrans-63.4-46177.5-76.9179.6000112F45 D46 L51 M52 Q53F45-L49 HydrophobicContact CD1-CD1 3.94Å; F45-L49 HydrophobicContact CD1-CG 4.44Å; F45-L49 HydrophobicContact CE1-CD1 3.34Å; F45-L49 HydrophobicContact CE1-CG 3.98Å; F45-L49 HydrophobicContact CZ-CD1 3.86Å; F45-L49 HydrophobicContact CZ-CD2 4.35Å; F45-L49 HydrophobicContact CZ-CG 4.11Å; F45-L49 PolarHBondContact O-N 2.84Å; D46-L49 PolarHBondContact O-N 2.95Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L49-L51 PolarHBondContact O-N 3.44Å; L49-M52 PolarHBondContact O-N 2.92Å; L49-Q53 WeakPolarHBondContact O-CG 3.38Å; L49-Q53 PolarHBondContact O-N 3.36Å
50I74.4Confident72.5Confident68 Ų6871.2 Ų71.235%0.34938%0.375SS..Hα-helixtrans-61-45.1176.9-67.8168.3000110.1D46 T47 M52 Q53 I54 L84D46-I50 WeakPolarHBondContact O-CG1 3.4Å; D46-I50 PolarHBondContact O-N 3.43Å; T47-I50 PolarHBondContact O-N 3.44Å; I50-M52 PolarHBondContact O-N 3.44Å; I50-Q53 WeakPolarHBondContact O-CB 2.94Å; I50-Q53 PolarHBondContact O-N 3.05Å; I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.38Å; I50-I54 WeakPolarHBondContact O-CG1 3.38Å; I50-I54 PolarHBondContact O-N 3.02Å; I50-L84 HydrophobicContact CD1-CD2 4.05Å; I50-L84 HydrophobicContact CG1-CD2 4.41Å
51L80.5Confident71.4Confident106 Ų10672.6 Ų72.656%0.55539%0.39SS*.Hα-helixtrans-62.5-43.2178.8-172.966.5000111.7T47 I48 L49 Q53 I54 V55T47-L51 VanDerWaalsContact O-CB 3.25Å; T47-L51 WeakPolarHBondContact O-CB 3.45Å; T47-L51 PolarHBondContact O-N 2.94Å; I48-L51 PolarHBondContact O-N 3.32Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L49-L51 PolarHBondContact O-N 3.44Å; L51-Q53 VanDerWaalsContact C-N 3.31Å; L51-Q53 PolarHBondContact O-N 3.39Å; L51-I54 PolarHBondContact O-N 2.96Å; L51-V55 HydrophobicContact CG-CG2 4.44Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.24Å; L51-V55 PolarHBondContact O-N 2.85Å
52M75.2Confident70.9Confident67 Ų6780.2 Ų80.233%0.3342%0.422SS..Hα-helixtrans-59.9-41.2175.2-76.7-164.2-175.700112R8 I48 L49 I50 E56R8-M52 PolarHBondContact NH2-SD 2.99Å; R8-M52 VanDerWaalsContact NH2-SD 3.41Å; I48-M52 HydrophobicContact CG2-CE 4.01Å; I48-M52 WeakPolarHBondContact O-CG 2.96Å; I48-M52 PolarHBondContact O-N 3.42Å; L49-M52 PolarHBondContact O-N 2.92Å; I50-M52 PolarHBondContact O-N 3.44Å; M52-E56 WeakPolarHBondContact O-CB 3.09Å; M52-E56 PolarHBondContact O-N 3.35Å
53Q68.6Low69.9Low33 Ų3385.3 Ų85.315%0.15446%0.455CS..Hα-helixtrans-63.6-44.8175-69.6-61.9-69.700111.7L49 I50 L51 V55 E56 M57L49-Q53 WeakPolarHBondContact O-CG 3.38Å; L49-Q53 PolarHBondContact O-N 3.36Å; I50-Q53 WeakPolarHBondContact O-CB 2.94Å; I50-Q53 PolarHBondContact O-N 3.05Å; L51-Q53 VanDerWaalsContact C-N 3.31Å; L51-Q53 PolarHBondContact O-N 3.39Å; Q53-V55 PolarHBondContact O-N 3.17Å; Q53-E56 PolarHBondContact O-N 3.41Å; Q53-M57 WeakPolarHBondContact O-CG 3.35Å; Q53-M57 PolarHBondContact O-N 2.91Å
54I73.5Confident69.2Low70 Ų7085.6 Ų85.636%0.35947%0.467SS..Hα-helixtrans-63.1-42.8179.2-67.5167.8000111I50 L51 E56 M57 A58I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.38Å; I50-I54 WeakPolarHBondContact O-CG1 3.38Å; I50-I54 PolarHBondContact O-N 3.02Å; L51-I54 PolarHBondContact O-N 2.96Å; I54-E56 VanDerWaalsContact C-N 3.34Å; I54-E56 PolarHBondContact O-N 3.41Å; I54-M57 PolarHBondContact O-N 3.35Å; I54-A58 WeakPolarHBondContact O-CB 3.24Å; I54-A58 PolarHBondContact O-N 2.96Å
55V76.1Confident68.1Low92 Ų9290.1 Ų90.156%0.55849%0.485SS*.Hα-helixtrans-65.3-38.9178.2171.60000111.2L51 Q53 M57 A58 G59L51-V55 HydrophobicContact CG-CG2 4.44Å; L51-V55 VanDerWaalsContact O-CG2 3.28Å; L51-V55 WeakPolarHBondContact O-CG2 3.24Å; L51-V55 PolarHBondContact O-N 2.85Å; Q53-V55 PolarHBondContact O-N 3.17Å; V55-M57 VanDerWaalsContact C-N 3.33Å; V55-A58 PolarHBondContact O-N 3.29Å; V55-G59 PolarHBondContact O-N 3.21Å
56E69Low67.6Low111 Ų11193.3 Ų93.352%0.51950%0.502SS..Hα-helixtrans-66-36.4175.8-163.6167.2179.200111.7M52 Q53 I54M52-E56 WeakPolarHBondContact O-CB 3.09Å; M52-E56 PolarHBondContact O-N 3.35Å; Q53-E56 PolarHBondContact O-N 3.41Å; I54-E56 VanDerWaalsContact C-N 3.34Å; I54-E56 PolarHBondContact O-N 3.41Å
57M63.4Low66.9Low45 Ų4597 Ų9722%0.22253%0.528CS..Hα-helixtrans-69.7-44.8171.6-69.1-172.2-172.900112.4Q53 I54 V55 G59 R60 S73 R77Q53-M57 WeakPolarHBondContact O-CG 3.35Å; Q53-M57 PolarHBondContact O-N 2.91Å; I54-M57 PolarHBondContact O-N 3.35Å; V55-M57 VanDerWaalsContact C-N 3.33Å; M57-G59 VanDerWaalsContact C-N 3.29Å; M57-G59 PolarHBondContact O-N 2.88Å; M57-R60 WeakPolarHBondContact O-CB 3.43Å; M57-R60 PolarHBondContact O-N 3.26Å; M57-S73 WeakPolarHBondContact CE-OG 3.33Å; M57-R77 HydrophobicContact CE-CB 4.09Å; M57-R77 HydrophobicContact CE-CG 4.22Å
58A70.3Confident66Low60 Ų60102.9 Ų102.950%0.49654%0.54SS..Hα-helixtrans-65.5-33.118000000112.2I54 V55 R60 C61I54-A58 WeakPolarHBondContact O-CB 3.24Å; I54-A58 PolarHBondContact O-N 2.96Å; V55-A58 PolarHBondContact O-N 3.29Å; A58-R60 PolarHBondContact O-N 2.89Å; A58-C61 WeakPolarHBondContact O-CB 3.38Å; A58-C61 PolarHBondContact O-N 3.06Å
59G67.4Low65Low63 Ų63103 Ų10365%0.64954%0.542SS*.THydrogen-bonded Turntrans-68.4-19.5172.700000114.1V55 M57V55-G59 PolarHBondContact O-N 3.21Å; M57-G59 VanDerWaalsContact C-N 3.29Å; M57-G59 PolarHBondContact O-N 2.88Å
60R58.3Low64.3Low186 Ų186105.2 Ų105.270%0.70255%0.551SS**THydrogen-bonded Turntrans-84.4-7.9172.7-76.3-89.2-166.7153.64.7113.1M57 A58 K62 D69M57-R60 WeakPolarHBondContact O-CB 3.43Å; M57-R60 PolarHBondContact O-N 3.26Å; A58-R60 PolarHBondContact O-N 2.89Å; R60-K62 PolarHBondContact O-N 3.03Å; R60-D69 IonicContact NH1-OD2 3.6Å
61C54.7Low63.5Low111 Ų111108.2 Ų108.275%0.7556%0.563SS**  trans-70.922.9173-63.90000114.1A58A58-C61 WeakPolarHBondContact O-CB 3.38Å; A58-C61 PolarHBondContact O-N 3.06Å
62K58.4Low62.5Low175 Ų175110.2 Ų110.276%0.76157%0.567SS**SBendtrans-74.9131.8161.4-161166.8175176.60106R60 D64R60-K62 PolarHBondContact O-N 3.03Å; K62-D64 PolarHBondContact O-N 3.4Å
63P52.9Low61.8Low127 Ų127108.9 Ų108.983%0.82557%0.565SS**SBendtrans-7767.6-157.733-38.2000112.8
64D55.8Low61.4Low148 Ų148111.8 Ų111.879%0.79158%0.584SS**  trans-115.581.8160.6-152-103.7000105.6K62 D66K62-D64 PolarHBondContact O-N 3.4Å; D64-D66 PolarHBondContact O-N 2.98Å; D64-D66 VanDerWaalsContact O-N 3.14Å
65F55.9Low61Low172 Ų172111.7 Ų111.775%0.75458%0.582SS**  trans-84.882.4-169-166.9-95.6000109.1P67F65-P67 WeakPolarHBondContact O-CD 3.45Å
66D61.6Low60.3Low87 Ų87113.4 Ų113.447%0.46558%0.578SS.*  trans-95.8111174.2-156.1-45.9000110D64 R68 D69D64-D66 PolarHBondContact O-N 2.98Å; D64-D66 VanDerWaalsContact O-N 3.14Å; D66-R68 PolarHBondContact O-N 2.99Å; D66-R68 PolarHBondContact OD1-N 3.48Å; D66-D69 PolarHBondContact O-N 3.5Å; D66-D69 VanDerWaalsContact O-N 3.14Å
67P59.2Low60Low93 Ų93113.4 Ų113.460%0.60457%0.573SS**Hα-helixtrans-63.1-14.2-174.522.7-31.8000114F65F65-P67 WeakPolarHBondContact O-CD 3.45Å
68R58.4Low60.1Low202 Ų202116.4 Ų116.476%0.76259%0.589SS**Hα-helixtrans-77.4-21.6175.9-85.2-179.9168.8-159.8-4.3114.4D66D66-R68 PolarHBondContact O-N 2.99Å; D66-R68 PolarHBondContact OD1-N 3.48Å
69D58.4Low59.8Low81 Ų81118.6 Ų118.643%0.43359%0.585SS.*Hα-helixtrans-83.4-24.9-179.4-103.9-0.8000112.4R60 D66 S73R60-D69 IonicContact NH1-OD2 3.6Å; D66-D69 PolarHBondContact O-N 3.5Å; D66-D69 VanDerWaalsContact O-N 3.14Å; D69-S73 PolarHBondContact O-N 3Å
70E58.2Low59.7Low112 Ų112121.1 Ų121.152%0.52358%0.576SS.*Hα-helixtrans-65.8-40.3176.6-61.4-143.6130.500112.1K72 S73 V74E70-K72 VanDerWaalsContact C-N 3.34Å; E70-K72 PolarHBondContact O-N 3.35Å; E70-S73 WeakPolarHBondContact O-CB 3.27Å; E70-S73 PolarHBondContact O-N 3.48Å; E70-S73 VanDerWaalsContact O-N 3.15Å; E70-V74 VanDerWaalsContact O-CG2 3.32Å; E70-V74 WeakPolarHBondContact O-CG2 3.31Å; E70-V74 PolarHBondContact O-N 2.85Å
71E58.8Low59.8Low132 Ų132116.3 Ų116.362%0.61756%0.564SS**Hα-helixtrans-64.4-39.6-177.7-155.1-175.5173.500111.9V74 K75E71-V74 PolarHBondContact O-N 2.98Å; E71-K75 PolarHBondContact O-N 2.99Å
72K57.9Low60.2Low147 Ų147112.7 Ų112.764%0.63954%0.539SS*.Hα-helixtrans-67.4-38174.8-69.2177.5-176.8168.50111.9E70 R76E70-K72 VanDerWaalsContact C-N 3.34Å; E70-K72 PolarHBondContact O-N 3.35Å; K72-R76 VanDerWaalsContact O-CB 3.31Å; K72-R76 WeakPolarHBondContact O-CB 3.35Å; K72-R76 PolarHBondContact O-N 2.77Å
73S61.3Low60.6Low40 Ų40106.5 Ų106.528%0.2852%0.521SS..Hα-helixtrans-63.8-45.7176.4173.90000111.7M57 D69 E70 R76 R77M57-S73 WeakPolarHBondContact CE-OG 3.33Å; D69-S73 PolarHBondContact O-N 3Å; E70-S73 WeakPolarHBondContact O-CB 3.27Å; E70-S73 PolarHBondContact O-N 3.48Å; E70-S73 VanDerWaalsContact O-N 3.15Å; S73-R76 PolarHBondContact O-N 3.48Å; S73-R77 WeakPolarHBondContact O-CB 3.41Å; S73-R77 PolarHBondContact O-N 3.03Å
74V59.2Low61.1Low93 Ų93101.8 Ų101.856%0.56449%0.489SS*.Hα-helixtrans-66.9-44.7179.3176.90000111.2E70 E71 R76 R77 L78E70-V74 VanDerWaalsContact O-CG2 3.32Å; E70-V74 WeakPolarHBondContact O-CG2 3.31Å; E70-V74 PolarHBondContact O-N 2.85Å; E71-V74 PolarHBondContact O-N 2.98Å; V74-R76 VanDerWaalsContact C-N 3.32Å; V74-R76 PolarHBondContact O-N 3.01Å; V74-R77 WeakPolarHBondContact O-CB 3.39Å; V74-R77 PolarHBondContact O-N 3.48Å; V74-L78 WeakPolarHBondContact O-CB 3.42Å; V74-L78 PolarHBondContact O-N 2.89Å
75K65.1Low61.3Low69 Ų69100.9 Ų100.930%0.348%0.483SS..Hα-helixtrans-58.9-43.1174.7-80.4-172.2174.1-150.30112.3E71 R77 L78 W79 E123E71-K75 PolarHBondContact O-N 2.99Å; K75-R77 VanDerWaalsContact C-N 3.35Å; K75-L78 PolarHBondContact O-N 3.35Å; K75-W79 WeakPolarHBondContact O-CB 3.31Å; K75-W79 PolarHBondContact O-N 2.82Å; K75-E123 WeakPolarHBondContact CD-OE2 3.39Å; K75-E123 WeakPolarHBondContact CE-OE1 3.28Å; K75-E123 WeakPolarHBondContact CE-OE2 3.25Å; K75-E123 IonicContact NZ-OE1 3.48Å; K75-E123 PolarHBondContact NZ-OE1 2.96Å; K75-E123 IonicContact NZ-OE2 2.77Å; K75-E123 PolarHBondContact NZ-OE2 3.5Å
76R62.9Low61.6Low127 Ų12794.1 Ų94.148%0.47946%0.455SS..Hα-helixtrans-64.7-40.7177-165.2174.8-170.1-136.13111.4K72 S73 V74 W79 Y80K72-R76 VanDerWaalsContact O-CB 3.31Å; K72-R76 WeakPolarHBondContact O-CB 3.35Å; K72-R76 PolarHBondContact O-N 2.77Å; S73-R76 PolarHBondContact O-N 3.48Å; V74-R76 VanDerWaalsContact C-N 3.32Å; V74-R76 PolarHBondContact O-N 3.01Å; R76-W79 PolarHBondContact O-N 3.18Å; R76-Y80 HydrophobicContact CG-CD2 3.91Å; R76-Y80 HydrophobicContact CG-CE2 3.76Å; R76-Y80 WeakPolarHBondContact O-CD2 3.45Å; R76-Y80 PolarHBondContact O-N 3.4Å
77R61.3Low61.8Low112 Ų11294.5 Ų94.542%0.42345%0.452SS..Hα-helixtrans-63.9-42.1175.9-162.1175.7-173173.3-1.1111.6M57 S73 V74 K75 Y80 L81M57-R77 HydrophobicContact CE-CB 4.09Å; M57-R77 HydrophobicContact CE-CG 4.22Å; S73-R77 WeakPolarHBondContact O-CB 3.41Å; S73-R77 PolarHBondContact O-N 3.03Å; V74-R77 WeakPolarHBondContact O-CB 3.39Å; V74-R77 PolarHBondContact O-N 3.48Å; K75-R77 VanDerWaalsContact C-N 3.35Å; R77-Y80 PolarHBondContact O-N 2.9Å; R77-L81 HydrophobicContact CG-CD1 4.34Å; R77-L81 WeakPolarHBondContact O-CB 3.46Å; R77-L81 VanDerWaalsContact O-CG 3.25Å; R77-L81 WeakPolarHBondContact O-CG 3.4Å; R77-L81 PolarHBondContact O-N 3.39Å
78L65.4Low61.8Low107 Ų10792.3 Ų92.356%0.5644%0.435SS*.Hα-helixtrans-65-41.5175.9-167.368.7000111.2V74 K75 L81 S82V74-L78 WeakPolarHBondContact O-CB 3.42Å; V74-L78 PolarHBondContact O-N 2.89Å; K75-L78 PolarHBondContact O-N 3.35Å; L78-L81 PolarHBondContact O-N 3.35Å; L78-S82 VanDerWaalsContact O-CB 3.23Å; L78-S82 WeakPolarHBondContact O-CB 3.45Å; L78-S82 PolarHBondContact O-N 2.88Å; L78-S82 PolarHBondContact O-OG 3.47Å; L78-S82 VanDerWaalsContact O-OG 3.12Å
79W65.8Low61.8Low106 Ų10684 Ų8440%0.40241%0.41SS..Hα-helixtrans-63-41.6174.2-106.6105000113.5K75 R76 S82 A83 A120K75-W79 WeakPolarHBondContact O-CB 3.31Å; K75-W79 PolarHBondContact O-N 2.82Å; R76-W79 PolarHBondContact O-N 3.18Å; W79-S82 WeakPolarHBondContact CA-OG 3.34Å; W79-S82 PolarHBondContact O-OG 2.92Å; W79-A83 WeakPolarHBondContact O-CB 3.32Å; W79-A83 PolarHBondContact O-N 2.88Å; W79-A120 HydrophobicContact CH2-CB 3.22Å; W79-A120 HydrophobicContact CZ2-CB 3.23Å; W79-A120 HydrophobicContact CZ3-CB 4.35Å
80Y65.1Low62.1Low117 Ų11785.7 Ų85.746%0.45941%0.413SS..Hα-helixtrans-68.5-44.9175.4-87.2-67.9000111.6R76 R77 S82 A83 L84R76-Y80 HydrophobicContact CG-CD2 3.91Å; R76-Y80 HydrophobicContact CG-CE2 3.76Å; R76-Y80 WeakPolarHBondContact O-CD2 3.45Å; R76-Y80 PolarHBondContact O-N 3.4Å; R77-Y80 PolarHBondContact O-N 2.9Å; Y80-S82 VanDerWaalsContact C-N 3.3Å; Y80-S82 PolarHBondContact O-N 3.15Å; Y80-A83 PolarHBondContact O-N 2.99Å; Y80-L84 VanDerWaalsContact O-CB 3.26Å; Y80-L84 WeakPolarHBondContact O-CB 3.45Å; Y80-L84 PolarHBondContact O-N 2.89Å
81L59.3Low62.3Low85 Ų8581.5 Ų81.545%0.44540%0.396SS..Hα-helixtrans-61-40.6176.5-75.9171.4000111.5R77 L78 L84 L85R77-L81 HydrophobicContact CG-CD1 4.34Å; R77-L81 WeakPolarHBondContact O-CB 3.46Å; R77-L81 VanDerWaalsContact O-CG 3.25Å; R77-L81 WeakPolarHBondContact O-CG 3.4Å; R77-L81 PolarHBondContact O-N 3.39Å; L78-L81 PolarHBondContact O-N 3.35Å; L81-L84 WeakPolarHBondContact O-CB 3.41Å; L81-L84 PolarHBondContact O-N 3.43Å; L81-L85 VanDerWaalsContact O-CB 3.31Å; L81-L85 WeakPolarHBondContact O-CB 3.36Å; L81-L85 PolarHBondContact O-N 3.25Å
82S64.1Low62.4Low34 Ų3480 Ų8024%0.23839%0.392CS..Hα-helixtrans-69.4-41.7179.170.40000112L78 W79 Y80 L84 L85 L86 L116L78-S82 VanDerWaalsContact O-CB 3.23Å; L78-S82 WeakPolarHBondContact O-CB 3.45Å; L78-S82 PolarHBondContact O-N 2.88Å; L78-S82 PolarHBondContact O-OG 3.47Å; L78-S82 VanDerWaalsContact O-OG 3.12Å; W79-S82 WeakPolarHBondContact CA-OG 3.34Å; W79-S82 PolarHBondContact O-OG 2.92Å; Y80-S82 VanDerWaalsContact C-N 3.3Å; Y80-S82 PolarHBondContact O-N 3.15Å; S82-L84 VanDerWaalsContact C-N 3.29Å; S82-L84 PolarHBondContact O-N 2.98Å; S82-L85 PolarHBondContact O-N 3.45Å; S82-L86 WeakPolarHBondContact O-CB 3.5Å; S82-L86 PolarHBondContact O-N 2.88Å; S82-L116 VanDerWaalsContact CB-CD1 3.43Å; S82-L116 WeakPolarHBondContact OG-CD1 3.36Å
83A65.6Low62.4Low45 Ų4575 Ų7537%0.37237%0.373SS..Hα-helixtrans-61.6-38172.500000112.3W79 Y80 K87W79-A83 WeakPolarHBondContact O-CB 3.32Å; W79-A83 PolarHBondContact O-N 2.88Å; Y80-A83 PolarHBondContact O-N 2.99Å; A83-K87 WeakPolarHBondContact O-CB 3.21Å; A83-K87 PolarHBondContact O-N 3.47Å
84L63.5Low62.3Low29 Ų2976.3 Ų76.315%0.15238%0.377CS..Hα-helixtrans-67.5-49.3177.3-160.668.8000111.8D46 I50 Y80 L81 S82 L86 K87 L88D46-L84 HydrophobicContact CB-CD1 4.29Å; D46-L84 HydrophobicContact CB-CD2 4.27Å; D46-L84 WeakPolarHBondContact OD1-CD1 3.41Å; D46-L84 VanDerWaalsContact OD1-CD2 3.24Å; D46-L84 WeakPolarHBondContact OD1-CD2 3.45Å; D46-L84 WeakPolarHBondContact OD1-CG 3.3Å; I50-L84 HydrophobicContact CD1-CD2 4.05Å; I50-L84 HydrophobicContact CG1-CD2 4.41Å; Y80-L84 VanDerWaalsContact O-CB 3.26Å; Y80-L84 WeakPolarHBondContact O-CB 3.45Å; Y80-L84 PolarHBondContact O-N 2.89Å; L81-L84 WeakPolarHBondContact O-CB 3.41Å; L81-L84 PolarHBondContact O-N 3.43Å; S82-L84 VanDerWaalsContact C-N 3.29Å; S82-L84 PolarHBondContact O-N 2.98Å; L84-L86 PolarHBondContact O-N 3.13Å; L84-K87 PolarHBondContact O-N 3.03Å; L84-K87 VanDerWaalsContact O-N 3.17Å; L84-L88 WeakPolarHBondContact O-CG 3.26Å; L84-L88 PolarHBondContact O-N 3.33Å
85L60.5Low62.2Low128 Ų12872.2 Ų72.267%0.6735%0.352SS*.Hα-helixtrans-58.6-39.6176.8-150.487000110.7L81 S82 L88 A89L81-L85 VanDerWaalsContact O-CB 3.31Å; L81-L85 WeakPolarHBondContact O-CB 3.36Å; L81-L85 PolarHBondContact O-N 3.25Å; S82-L85 PolarHBondContact O-N 3.45Å; L85-L88 PolarHBondContact O-N 3.48Å; L85-A89 VanDerWaalsContact O-CB 3.32Å; L85-A89 WeakPolarHBondContact O-CB 3.32Å; L85-A89 PolarHBondContact O-N 2.97Å
86L62.2Low61.7Low31 Ų3173 Ų7316%0.16237%0.366CS..Hα-helixtrans-67.1-42.8177.8-172.465.5000112.1S82 L84 L88 A89 F90 P112 L113 L116S82-L86 WeakPolarHBondContact O-CB 3.5Å; S82-L86 PolarHBondContact O-N 2.88Å; L84-L86 PolarHBondContact O-N 3.13Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.25Å; L86-A89 PolarHBondContact O-N 2.64Å; L86-F90 WeakPolarHBondContact O-CB 3.35Å; L86-F90 PolarHBondContact O-N 3.32Å; L86-P112 HydrophobicContact CD1-CB 3.64Å; L86-P112 HydrophobicContact CD1-CG 4.16Å; L86-P112 WeakPolarHBondContact CD1-O 3.48Å; L86-L113 HydrophobicContact CD1-CB 4.28Å; L86-L113 HydrophobicContact CD2-CB 4.36Å; L86-L113 HydrophobicContact CD2-CG 4.2Å; L86-L116 HydrophobicContact CB-CD2 4.31Å; L86-L116 HydrophobicContact CD2-CB 3.91Å; L86-L116 HydrophobicContact CD2-CD2 3.31Å; L86-L116 HydrophobicContact CD2-CG 4.11Å; L86-L116 HydrophobicContact CG-CD2 4.37Å
87K66.1Low61.4Low95 Ų9571.5 Ų71.541%0.41336%0.361SS..Hα-helixtrans-62.6-40.9177-163.5-174.6-177-168.60111.4A83 L84 C91A83-K87 WeakPolarHBondContact O-CB 3.21Å; A83-K87 PolarHBondContact O-N 3.47Å; L84-K87 PolarHBondContact O-N 3.03Å; L84-K87 VanDerWaalsContact O-N 3.17Å; K87-C91 PolarHBondContact O-N 3.49Å; K87-C91 VanDerWaalsContact O-N 3.11Å; K87-C91 PolarHBondContact O-SG 3.03Å; K87-C91 VanDerWaalsContact O-SG 3.41Å
88L57.9Low61Low47 Ų4769.4 Ų69.425%0.24636%0.358CS..Hα-helixtrans-64.8-45.5174.4-72169.5000111.7V42 L84 L85 L86 F90 C91 L92V42-L88 HydrophobicContact CG1-CD2 3.95Å; L84-L88 WeakPolarHBondContact O-CG 3.26Å; L84-L88 PolarHBondContact O-N 3.33Å; L85-L88 PolarHBondContact O-N 3.48Å; L86-L88 VanDerWaalsContact C-N 3.32Å; L86-L88 PolarHBondContact O-N 3.25Å; L88-F90 PolarHBondContact O-N 3.36Å; L88-C91 PolarHBondContact O-N 3.13Å; L88-L92 WeakPolarHBondContact O-CB 3.25Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.37Å; L88-L92 PolarHBondContact O-N 3.19Å
89A60.4Low60.3Low27 Ų2769.6 Ų69.622%0.22336%0.356CS..Hα-helixtrans-62.1-42.3177.500000112.2L85 L86 L92 T93 P112L85-A89 VanDerWaalsContact O-CB 3.32Å; L85-A89 WeakPolarHBondContact O-CB 3.32Å; L85-A89 PolarHBondContact O-N 2.97Å; L86-A89 PolarHBondContact O-N 2.64Å; A89-L92 PolarHBondContact O-N 3.26Å; A89-T93 VanDerWaalsContact O-CB 3.3Å; A89-T93 WeakPolarHBondContact O-CB 3.27Å; A89-T93 PolarHBondContact O-N 3.15Å; A89-T93 PolarHBondContact O-OG1 2.9Å; A89-P112 HydrophobicContact CB-CG 4.46Å
90F63.7Low59.7Low117 Ų11772.4 Ų72.451%0.51337%0.371SS..Hα-helixtrans-60.3-46174.3-177.1-104.2000111.8L86 L88 T93 L94L86-F90 WeakPolarHBondContact O-CB 3.35Å; L86-F90 PolarHBondContact O-N 3.32Å; L88-F90 PolarHBondContact O-N 3.36Å; F90-T93 PolarHBondContact O-N 3.39Å; F90-L94 HydrophobicContact CD1-CD1 3.76Å; F90-L94 HydrophobicContact CD2-CD1 4.38Å; F90-L94 HydrophobicContact CE1-CD1 3.23Å; F90-L94 HydrophobicContact CE2-CD1 3.93Å; F90-L94 HydrophobicContact CG-CD1 4.31Å; F90-L94 HydrophobicContact CZ-CD1 3.33Å; F90-L94 WeakPolarHBondContact O-CB 3.35Å; F90-L94 PolarHBondContact O-N 3.05Å
91C62.7Low59.1Low23 Ų2375.4 Ų75.416%0.15539%0.394CS..Hα-helixtrans-64.6-43.8176.9-720000112.6F19 F39 K87 L88 T93 L94 C95F19-C91 HydrophobicContact CE1-CB 4.21Å; F19-C91 HydrophobicContact CZ-CB 4.17Å; F39-C91 HydrophobicContact CE1-CB 4.1Å; K87-C91 PolarHBondContact O-N 3.49Å; K87-C91 VanDerWaalsContact O-N 3.11Å; K87-C91 PolarHBondContact O-SG 3.03Å; K87-C91 VanDerWaalsContact O-SG 3.41Å; L88-C91 PolarHBondContact O-N 3.13Å; C91-T93 VanDerWaalsContact C-N 3.29Å; C91-T93 PolarHBondContact O-N 3.5Å; C91-L94 PolarHBondContact O-N 3.37Å; C91-C95 PolarHBondContact O-N 2.68Å
92L60.2Low58.4Low102 Ų10275.7 Ų75.753%0.53440%0.399SS..Hα-helixtrans-63.3-36177-74.1168000112F39 L88 A89 C95 S96F39-L92 HydrophobicContact CE2-CD2 4.5Å; F39-L92 HydrophobicContact CZ-CD2 4.11Å; L88-L92 WeakPolarHBondContact O-CB 3.25Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.37Å; L88-L92 PolarHBondContact O-N 3.19Å; A89-L92 PolarHBondContact O-N 3.26Å; L92-C95 WeakPolarHBondContact O-CB 3.49Å; L92-C95 PolarHBondContact O-N 2.94Å; L92-S96 WeakPolarHBondContact O-CB 3.43Å; L92-S96 PolarHBondContact O-N 3.42Å
93T57.3Low57.8Low41 Ų4181.4 Ų81.425%0.25243%0.427SS..Hα-helixtrans-73.3-40.3178.5-52.10000111.3A89 F90 C91 C95 S96 R97 V109A89-T93 VanDerWaalsContact O-CB 3.3Å; A89-T93 WeakPolarHBondContact O-CB 3.27Å; A89-T93 PolarHBondContact O-N 3.15Å; A89-T93 PolarHBondContact O-OG1 2.9Å; F90-T93 PolarHBondContact O-N 3.39Å; C91-T93 VanDerWaalsContact C-N 3.29Å; C91-T93 PolarHBondContact O-N 3.5Å; T93-C95 VanDerWaalsContact C-N 3.34Å; T93-S96 PolarHBondContact O-N 3.23Å; T93-R97 WeakPolarHBondContact O-CB 3.42Å; T93-R97 WeakPolarHBondContact O-CG 3.43Å; T93-R97 PolarHBondContact O-N 3.27Å; T93-V109 HydrophobicContact CG2-CB 4.19Å; T93-V109 HydrophobicContact CG2-CG1 3.77Å; T93-V109 HydrophobicContact CG2-CG2 3.86Å
94L60.6Low57.3Low68 Ų6884 Ų8436%0.35643%0.434SS..Hα-helixtrans-59.6-43.9169.9-108.8132.6000111.6F90 C91 R97 L98F90-L94 HydrophobicContact CD1-CD1 3.76Å; F90-L94 HydrophobicContact CD2-CD1 4.38Å; F90-L94 HydrophobicContact CE1-CD1 3.23Å; F90-L94 HydrophobicContact CE2-CD1 3.93Å; F90-L94 HydrophobicContact CG-CD1 4.31Å; F90-L94 HydrophobicContact CZ-CD1 3.33Å; F90-L94 WeakPolarHBondContact O-CB 3.35Å; F90-L94 PolarHBondContact O-N 3.05Å; C91-L94 PolarHBondContact O-N 3.37Å; L94-R97 PolarHBondContact O-N 3.02Å; L94-L98 WeakPolarHBondContact O-CB 3.21Å; L94-L98 PolarHBondContact O-N 3.32Å
95C57.1Low56.8Low7 Ų792 Ų925%0.04746%0.462CS..Hα-helixtrans-59.9-46.6173.4-800000112.3L23 W35 C91 L92 T93 R97 L98 Q99L23-C95 VanDerWaalsContact CD1-SG 3.53Å; W35-C95 HydrophobicContact CZ3-CB 4.27Å; C91-C95 PolarHBondContact O-N 2.68Å; L92-C95 WeakPolarHBondContact O-CB 3.49Å; L92-C95 PolarHBondContact O-N 2.94Å; T93-C95 VanDerWaalsContact C-N 3.34Å; C95-R97 VanDerWaalsContact C-N 3.31Å; C95-R97 PolarHBondContact O-N 2.88Å; C95-L98 PolarHBondContact O-N 3.3Å; C95-Q99 VanDerWaalsContact O-CB 3.31Å; C95-Q99 WeakPolarHBondContact O-CB 3.49Å; C95-Q99 PolarHBondContact O-N 3.42Å
96S54.6Low56.4Low85 Ų8590.6 Ų90.659%0.59446%0.458SS*.Hα-helixtrans-64.3-36.3-179.7-178.30000112.3L92 T93 Q99L92-S96 WeakPolarHBondContact O-CB 3.43Å; L92-S96 PolarHBondContact O-N 3.42Å; T93-S96 PolarHBondContact O-N 3.23Å; S96-Q99 PolarHBondContact O-N 2.97Å
97R55.8Low55.9Low95 Ų9593 Ų9336%0.35848%0.478SS..Hα-helixtrans-68.3-40.8174.6-71-71.8-103.4-170.6-13.6112.7T93 L94 C95 Q99 T102 I104T93-R97 WeakPolarHBondContact O-CB 3.42Å; T93-R97 WeakPolarHBondContact O-CG 3.43Å; T93-R97 PolarHBondContact O-N 3.27Å; L94-R97 PolarHBondContact O-N 3.02Å; C95-R97 VanDerWaalsContact C-N 3.31Å; C95-R97 PolarHBondContact O-N 2.88Å; R97-Q99 VanDerWaalsContact C-N 3.29Å; R97-Q99 PolarHBondContact O-N 2.91Å; R97-T102 PolarHBondContact NH1-O 3.22Å; R97-I104 PolarHBondContact NH1-O 3.41Å; R97-I104 PolarHBondContact NH2-O 3.22Å
98L53.8Low55.3Low68 Ų6893.2 Ų93.236%0.35649%0.487SS..Hα-helixtrans-69.3-27.8177.9-103.956.6000112.6L27 L94 C95L27-L98 HydrophobicContact CB-CD2 4.36Å; L27-L98 HydrophobicContact CD1-CB 3.49Å; L27-L98 VanDerWaalsContact CD1-CB 3.49Å; L27-L98 HydrophobicContact CD1-CD2 3.58Å; L27-L98 HydrophobicContact CD1-CG 3.38Å; L27-L98 HydrophobicContact CD2-CD1 4.45Å; L27-L98 HydrophobicContact CD2-CD2 3.5Å; L27-L98 VanDerWaalsContact CD2-CD2 3.5Å; L27-L98 HydrophobicContact CD2-CG 3.55Å; L27-L98 HydrophobicContact CG-CD2 3.97Å; L27-L98 HydrophobicContact CG-CG 4.04Å; L94-L98 WeakPolarHBondContact O-CB 3.21Å; L94-L98 PolarHBondContact O-N 3.32Å; C95-L98 PolarHBondContact O-N 3.3Å
99Q51.3Low55.1Low112 Ų11292.9 Ų92.952%0.52349%0.487SS..Hα-helixtrans-86.6-9.8-173.6-157162.1-6.400114.5W35 C95 S96 R97W35-Q99 HydrophobicContact CZ2-CG 4.16Å; C95-Q99 VanDerWaalsContact O-CB 3.31Å; C95-Q99 WeakPolarHBondContact O-CB 3.49Å; C95-Q99 PolarHBondContact O-N 3.42Å; S96-Q99 PolarHBondContact O-N 2.97Å; R97-Q99 VanDerWaalsContact C-N 3.29Å; R97-Q99 PolarHBondContact O-N 2.91Å
100K53.3Low54.8Low164 Ų16493.8 Ų93.871%0.71349%0.491SS*.  trans-168.5113.3170.8-114.3169.8-175.5177.90115.6T102K100-T102 VanDerWaalsContact C-N 3.29Å; K100-T102 PolarHBondContact O-N 2.93Å
101L50.5Low54.7Low181 Ų18191.7 Ų91.795%0.94849%0.488SS*.  33.222.3119.9-116.192000122.9
102T46.2Very low54.3Low90 Ų9092.9 Ų92.955%0.55250%0.495SS*.  trans-133.8129.6-178.1-530000114.3R97 K100 I104R97-T102 PolarHBondContact NH1-O 3.22Å; K100-T102 VanDerWaalsContact C-N 3.29Å; K100-T102 PolarHBondContact O-N 2.93Å; T102-I104 HydrophobicContact CG2-CD1 4.35Å; T102-I104 HydrophobicContact CG2-CG1 4.03Å; T102-I104 PolarHBondContact O-N 2.94Å
103D51.6Low54Low155 Ų15592 Ų9283%0.82949%0.491SS*.  trans-62.256.6-179.7-142-62000113.4
104I54.8Low54.1Low100 Ų10098.9 Ų98.951%0.51351%0.512SS..  trans-90.5134.1177-60.3175000109R97 T102R97-I104 PolarHBondContact NH1-O 3.41Å; R97-I104 PolarHBondContact NH2-O 3.22Å; T102-I104 HydrophobicContact CG2-CD1 4.35Å; T102-I104 HydrophobicContact CG2-CG1 4.03Å; T102-I104 PolarHBondContact O-N 2.94Å
105W51.7Low54.3Low195 Ų195100.5 Ų100.574%0.73952%0.524SS*.  trans-65.4136.8-175.2-84.243000112.9S107 V108W105-S107 PolarHBondContact O-N 2.88Å; W105-V108 PolarHBondContact O-N 3.48Å
106V53.8Low54.4Low99 Ų99102.1 Ų102.160%0.653%0.532SS*.Hα-helixtrans-55.7-22.1179.4-177.60000112.5V108 V109V106-V108 PolarHBondContact O-N 3.34Å; V106-V109 VanDerWaalsContact O-CB 3.32Å; V106-V109 WeakPolarHBondContact O-CB 3.36Å; V106-V109 PolarHBondContact O-N 3.06Å
107S51.4Low54.9Low81 Ų81103.1 Ų103.157%0.56653%0.53SS*.Hα-helixtrans-66.1-31.8-178.7-62.80000114.6W105 V109 C110W105-S107 PolarHBondContact O-N 2.88Å; S107-V109 VanDerWaalsContact C-N 3.31Å; S107-C110 PolarHBondContact O-N 2.89Å
108V52.8Low55.8Low100 Ų100100.1 Ų100.161%0.60653%0.529SS*.Hα-helixtrans-74.1-27177.4-177.30000111.4W105 V106 C110 V111W105-V108 PolarHBondContact O-N 3.48Å; V106-V108 PolarHBondContact O-N 3.34Å; V108-C110 VanDerWaalsContact C-N 3.29Å; V108-C110 PolarHBondContact O-N 3.49Å; V108-V111 WeakPolarHBondContact O-CB 3.04Å; V108-V111 WeakPolarHBondContact O-CG2 3.47Å; V108-V111 PolarHBondContact O-N 3.44Å
109V53.8Low56.6Low41 Ų4198.6 Ų98.625%0.24853%0.53CS..Hα-helixtrans-67.2-30.7177.8178.90000111.8T93 V106 S107T93-V109 HydrophobicContact CG2-CB 4.19Å; T93-V109 HydrophobicContact CG2-CG1 3.77Å; T93-V109 HydrophobicContact CG2-CG2 3.86Å; V106-V109 VanDerWaalsContact O-CB 3.32Å; V106-V109 WeakPolarHBondContact O-CB 3.36Å; V106-V109 PolarHBondContact O-N 3.06Å; S107-V109 VanDerWaalsContact C-N 3.31Å
110C53.8Low57.2Low46 Ų4694 Ų9431%0.31151%0.511SS..THydrogen-bonded Turntrans-87.1-12.3178.4-64.40000113S107 V108 L113 W114S107-C110 PolarHBondContact O-N 2.89Å; V108-C110 VanDerWaalsContact C-N 3.29Å; V108-C110 PolarHBondContact O-N 3.49Å; C110-L113 CarbonylContact O-C 3.53Å; C110-L113 WeakPolarHBondContact O-CA 3.45Å; C110-L113 VanDerWaalsContact O-CB 3.27Å; C110-L113 WeakPolarHBondContact O-CB 3.31Å; C110-L113 PolarHBondContact O-N 3.4Å; C110-W114 PolarHBondContact O-N 2.89Å
111V61.7Low58.1Low73 Ų7392 Ų9244%0.44251%0.508SS..Hα-helixtrans-50.9-48.5-176.9172.60000113.7V108 L113 W114 V115V108-V111 WeakPolarHBondContact O-CB 3.04Å; V108-V111 WeakPolarHBondContact O-CG2 3.47Å; V108-V111 PolarHBondContact O-N 3.44Å; V111-L113 PolarHBondContact O-N 3.04Å; V111-W114 PolarHBondContact O-N 3.14Å; V111-V115 HydrophobicContact CG1-CG2 4.28Å; V111-V115 WeakPolarHBondContact O-CB 3.3Å; V111-V115 VanDerWaalsContact O-CG2 3.28Å; V111-V115 WeakPolarHBondContact O-CG2 3.5Å; V111-V115 PolarHBondContact O-N 3.45Å
112P53.4Low59.2Low47 Ų4789.6 Ų89.631%0.30550%0.495SS..Hα-helixtrans-66.4-27.7178.525.8-33.7000112.1L86 A89 L116L86-P112 HydrophobicContact CD1-CB 3.64Å; L86-P112 HydrophobicContact CD1-CG 4.16Å; L86-P112 WeakPolarHBondContact CD1-O 3.48Å; A89-P112 HydrophobicContact CB-CG 4.46Å; P112-L116 WeakPolarHBondContact O-CB 3.37Å; P112-L116 PolarHBondContact O-N 3.34Å
113L55.4Low60.3Low85 Ų8588.2 Ų88.245%0.44548%0.482SS..Hα-helixtrans-73.6-39.2175.8-163.6149.2000111.2L86 C110 V111 L116 L117L86-L113 HydrophobicContact CD1-CB 4.28Å; L86-L113 HydrophobicContact CD2-CB 4.36Å; L86-L113 HydrophobicContact CD2-CG 4.2Å; C110-L113 CarbonylContact O-C 3.53Å; C110-L113 WeakPolarHBondContact O-CA 3.45Å; C110-L113 VanDerWaalsContact O-CB 3.27Å; C110-L113 WeakPolarHBondContact O-CB 3.31Å; C110-L113 PolarHBondContact O-N 3.4Å; V111-L113 PolarHBondContact O-N 3.04Å; L113-L116 PolarHBondContact O-N 3.35Å; L113-L117 WeakPolarHBondContact O-CB 3.19Å; L113-L117 PolarHBondContact O-N 3.38Å
114W58Low61.1Low184 Ų18485.8 Ų85.870%0.69747%0.469SS*.Hα-helixtrans-67.4-39172.3-79.593.4000112.4C110 V111 L116 L117 G118C110-W114 PolarHBondContact O-N 2.89Å; V111-W114 PolarHBondContact O-N 3.14Å; W114-L116 VanDerWaalsContact C-N 3.34Å; W114-L117 PolarHBondContact O-N 3.04Å; W114-G118 PolarHBondContact O-N 3.05Å
115V66.3Low62Low102 Ų10282.9 Ų82.962%0.61846%0.464SS*.Hα-helixtrans-66.3-38.8174.6171.80000110.6V111 G119V111-V115 HydrophobicContact CG1-CG2 4.28Å; V111-V115 WeakPolarHBondContact O-CB 3.3Å; V111-V115 VanDerWaalsContact O-CG2 3.28Å; V111-V115 WeakPolarHBondContact O-CG2 3.5Å; V111-V115 PolarHBondContact O-N 3.45Å; V115-G119 PolarHBondContact O-N 3.48Å
116L59.3Low62.9Low41 Ų4182.3 Ų82.322%0.21546%0.463CS..Hα-helixtrans-67.4-47175.2-163.786.6000111.7S82 L86 P112 L113 W114 G118 G119 A120S82-L116 VanDerWaalsContact CB-CD1 3.43Å; S82-L116 WeakPolarHBondContact OG-CD1 3.36Å; L86-L116 HydrophobicContact CB-CD2 4.31Å; L86-L116 HydrophobicContact CD2-CB 3.91Å; L86-L116 HydrophobicContact CD2-CD2 3.31Å; L86-L116 HydrophobicContact CD2-CG 4.11Å; L86-L116 HydrophobicContact CG-CD2 4.37Å; P112-L116 WeakPolarHBondContact O-CB 3.37Å; P112-L116 PolarHBondContact O-N 3.34Å; L113-L116 PolarHBondContact O-N 3.35Å; W114-L116 VanDerWaalsContact C-N 3.34Å; L116-G118 VanDerWaalsContact C-N 3.29Å; L116-G118 PolarHBondContact O-N 2.88Å; L116-G119 PolarHBondContact O-N 3.2Å; L116-A120 WeakPolarHBondContact O-CB 3.45Å; L116-A120 PolarHBondContact O-N 3.48Å
117L63.8Low63.4Low106 Ų10680.1 Ų80.156%0.55545%0.452SS*.Hα-helixtrans-63.7-39.6179.2-150.3111.4000110.6L113 W114 L121L113-L117 WeakPolarHBondContact O-CB 3.19Å; L113-L117 PolarHBondContact O-N 3.38Å; W114-L117 PolarHBondContact O-N 3.04Å; L117-L121 WeakPolarHBondContact O-CB 3.49Å; L117-L121 PolarHBondContact O-N 3.43Å
118G74Confident64.3Low32 Ų3280.7 Ų80.733%0.3345%0.452SS..Hα-helixtrans-64.6-48.7173.900000112.5W114 L116 A120 L121 L122W114-G118 PolarHBondContact O-N 3.05Å; L116-G118 VanDerWaalsContact C-N 3.29Å; L116-G118 PolarHBondContact O-N 2.88Å; G118-A120 VanDerWaalsContact C-N 3.33Å; G118-A120 PolarHBondContact O-N 3Å; G118-L121 PolarHBondContact O-N 3.41Å; G118-L122 WeakPolarHBondContact O-CB 3.33Å; G118-L122 VanDerWaalsContact O-CG 3.28Å; G118-L122 WeakPolarHBondContact O-CG 3.35Å; G118-L122 PolarHBondContact O-N 2.78Å
119G70.6Confident65Low37 Ų3782.8 Ų82.838%0.38145%0.453SS..Hα-helixtrans-61-41.1176.800000112.7V115 L116 L122 E123V115-G119 PolarHBondContact O-N 3.48Å; L116-G119 PolarHBondContact O-N 3.2Å; G119-L122 PolarHBondContact O-N 3.39Å; G119-E123 WeakPolarHBondContact O-CB 3.06Å; G119-E123 PolarHBondContact O-N 3.38Å
120A63.8Low65.2Low14 Ų1486.5 Ų86.512%0.11647%0.467CS..Hα-helixtrans-61.9-45.3174.300000112.8W79 L116 G118 L122 E123 L124W79-A120 HydrophobicContact CH2-CB 3.22Å; W79-A120 HydrophobicContact CZ2-CB 3.23Å; W79-A120 HydrophobicContact CZ3-CB 4.35Å; L116-A120 WeakPolarHBondContact O-CB 3.45Å; L116-A120 PolarHBondContact O-N 3.48Å; G118-A120 VanDerWaalsContact C-N 3.33Å; G118-A120 PolarHBondContact O-N 3Å; A120-L122 VanDerWaalsContact C-N 3.35Å; A120-E123 PolarHBondContact O-N 3.27Å; A120-L124 WeakPolarHBondContact O-CB 3.28Å; A120-L124 WeakPolarHBondContact O-CG 3.49Å; A120-L124 PolarHBondContact O-N 3.31Å
121L73.2Confident65.3Low124 Ų12493.6 Ų93.665%0.64949%0.489SS*.Hα-helixtrans-67.8-36.7179.6-145.881.1000111.5L117 G118 G125L117-L121 WeakPolarHBondContact O-CB 3.49Å; L117-L121 PolarHBondContact O-N 3.43Å; G118-L121 PolarHBondContact O-N 3.41Å; L121-G125 PolarHBondContact O-N 2.92Å
122L74.1Confident64.8Low129 Ų129100.2 Ų100.268%0.67551%0.506SS*.Hα-helixtrans-68-42.9176.1-72.5172.2000111.7G118 G119 A120 G125 Y126G118-L122 WeakPolarHBondContact O-CB 3.33Å; G118-L122 VanDerWaalsContact O-CG 3.28Å; G118-L122 WeakPolarHBondContact O-CG 3.35Å; G118-L122 PolarHBondContact O-N 2.78Å; G119-L122 PolarHBondContact O-N 3.39Å; A120-L122 VanDerWaalsContact C-N 3.35Å; L122-G125 PolarHBondContact O-N 3.49Å; L122-Y126 WeakPolarHBondContact O-CB 3.33Å; L122-Y126 PolarHBondContact O-N 3.03Å
123E69.2Low64.8Low62 Ų62107.7 Ų107.729%0.2953%0.528SS..Hα-helixtrans-61.5-45174.3-97.4-85165.200112.2K75 G119 A120 Y126 S127K75-E123 WeakPolarHBondContact CD-OE2 3.39Å; K75-E123 WeakPolarHBondContact CE-OE1 3.28Å; K75-E123 WeakPolarHBondContact CE-OE2 3.25Å; K75-E123 IonicContact NZ-OE1 3.48Å; K75-E123 PolarHBondContact NZ-OE1 2.96Å; K75-E123 IonicContact NZ-OE2 2.77Å; K75-E123 PolarHBondContact NZ-OE2 3.5Å; G119-E123 WeakPolarHBondContact O-CB 3.06Å; G119-E123 PolarHBondContact O-N 3.38Å; A120-E123 PolarHBondContact O-N 3.27Å; E123-Y126 PolarHBondContact O-N 3.39Å; E123-S127 WeakPolarHBondContact O-CB 3.32Å; E123-S127 PolarHBondContact O-N 3.22Å; E123-S127 PolarHBondContact O-OG 3.49Å
124L67.8Low64.4Low103 Ų103112.5 Ų112.554%0.53955%0.554SS.*Hα-helixtrans-66.5-40.4175.5-77.4164000111.7A120 S127 V128A120-L124 WeakPolarHBondContact O-CB 3.28Å; A120-L124 WeakPolarHBondContact O-CG 3.49Å; A120-L124 PolarHBondContact O-N 3.31Å; L124-S127 WeakPolarHBondContact CA-OG 3.35Å; L124-S127 PolarHBondContact O-N 3.03Å; L124-S127 PolarHBondContact O-OG 2.92Å; L124-V128 WeakPolarHBondContact O-CB 3.34Å; L124-V128 VanDerWaalsContact O-CG2 3.31Å; L124-V128 WeakPolarHBondContact O-CG2 3.11Å; L124-V128 PolarHBondContact O-N 3.1Å
125G74.1Confident64.7Low40 Ų40109 Ų10941%0.41255%0.547SS..Hα-helixtrans-60.3-48.2174.800000111.8L121 L122 V128 F129L121-G125 PolarHBondContact O-N 2.92Å; L122-G125 PolarHBondContact O-N 3.49Å; G125-V128 PolarHBondContact O-N 2.98Å; G125-F129 WeakPolarHBondContact O-CB 3.36Å; G125-F129 PolarHBondContact O-N 3.14Å
126Y69.9Low64.6Low183 Ų183109.3 Ų109.372%0.71854%0.543SS*.Hα-helixtrans-64.5-42.5179.6-125.9-91.1000112.2L122 E123 F129 H130L122-Y126 WeakPolarHBondContact O-CB 3.33Å; L122-Y126 PolarHBondContact O-N 3.03Å; E123-Y126 PolarHBondContact O-N 3.39Å; Y126-F129 PolarHBondContact O-N 3.3Å; Y126-H130 VanDerWaalsContact O-CB 3.31Å; Y126-H130 WeakPolarHBondContact O-CB 3.37Å; Y126-H130 PolarHBondContact O-N 3.22Å
127S64.9Low64.9Low52 Ų52113.1 Ų113.136%0.36456%0.562SS.*Hα-helixtrans-67.7-40.1179.351.30000113.1E123 L124 Y131E123-S127 WeakPolarHBondContact O-CB 3.32Å; E123-S127 PolarHBondContact O-N 3.22Å; E123-S127 PolarHBondContact O-OG 3.49Å; L124-S127 WeakPolarHBondContact CA-OG 3.35Å; L124-S127 PolarHBondContact O-N 3.03Å; L124-S127 PolarHBondContact O-OG 2.92Å; S127-Y131 WeakPolarHBondContact O-CB 3.44Å; S127-Y131 PolarHBondContact O-N 2.74Å; S127-Y131 VanDerWaalsContact O-N 3.13Å
128V69.9Low65Low94 Ų94113.5 Ų113.557%0.5756%0.562SS**Hα-helixtrans-67.9-40.3175.5167.90000111.7L124 G125 Y131 R132L124-V128 WeakPolarHBondContact O-CB 3.34Å; L124-V128 VanDerWaalsContact O-CG2 3.31Å; L124-V128 WeakPolarHBondContact O-CG2 3.11Å; L124-V128 PolarHBondContact O-N 3.1Å; G125-V128 PolarHBondContact O-N 2.98Å; V128-Y131 PolarHBondContact O-N 3.19Å; V128-R132 PolarHBondContact O-N 2.88Å
129F68.8Low64.4Low144 Ų144118.6 Ų118.663%0.63258%0.577SS**Hα-helixtrans-72.6-33.5-178.5-140.8-87.9000112.4G125 Y126G125-F129 WeakPolarHBondContact O-CB 3.36Å; G125-F129 PolarHBondContact O-N 3.14Å; Y126-F129 PolarHBondContact O-N 3.3Å
130H57.9Low64Low119 Ų119124.1 Ų124.155%0.55159%0.59SS**Hα-helixtrans-70.6-37.8174.8-159.2-39.7000112Y126 R132 R133Y126-H130 VanDerWaalsContact O-CB 3.31Å; Y126-H130 WeakPolarHBondContact O-CB 3.37Å; Y126-H130 PolarHBondContact O-N 3.22Å; H130-R132 VanDerWaalsContact C-N 3.25Å; H130-R132 PolarHBondContact O-N 3.24Å; H130-R133 PolarHBondContact O-N 3.38Å
131Y54.7Low64Low195 Ų195131.9 Ų131.977%0.76562%0.623SS**Hα-helixtrans-67.1-22.6177.4-174.5-103.5000113.9S127 V128 R133S127-Y131 WeakPolarHBondContact O-CB 3.44Å; S127-Y131 PolarHBondContact O-N 2.74Å; S127-Y131 VanDerWaalsContact O-N 3.13Å; V128-Y131 PolarHBondContact O-N 3.19Å; Y131-R133 VanDerWaalsContact C-N 3.35Å
132R52.3Low63.3Low212 Ų212132.5 Ų132.580%0.862%0.621SS**THydrogen-bonded Turntrans-84.4-8.9178.7-173.9174.3-84.5-168.2-4.6113.2V128 H130V128-R132 PolarHBondContact O-N 2.88Å; H130-R132 VanDerWaalsContact C-N 3.25Å; H130-R132 PolarHBondContact O-N 3.24Å
133R52.1Low62.4Low204 Ų204132.8 Ų132.877%0.7762%0.617SS**  trans-100.9-9.1-174.1-135179.7-172.1128.30.1114H130 Y131H130-R133 PolarHBondContact O-N 3.38Å; Y131-R133 VanDerWaalsContact C-N 3.35Å
134D47.1Very low61.8Low186 Ų186139.3 Ų139.3100%0.99565%0.647SS**  trans-97.10166.4-61.5-39.3000109.6

Retrieved 134 of 134 residues in 45.6 ms (Link to these results)