A0A077ZLM6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLM6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 113 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
1M47.1Very low52Low196 Ų19697.4 Ų97.497%0.96649%0.489SS*.  0-51.20-79.1-165.8167.500114.5R3 T4 L5M1-R3 PolarHBondContact O-N 3.27Å; M1-T4 WeakPolarHBondContact CA-OG1 3.44Å; M1-T4 PolarHBondContact O-N 3.25Å; M1-T4 PolarHBondContact O-OG1 3.38Å; M1-L5 WeakPolarHBondContact O-CD1 3.12Å; M1-L5 WeakPolarHBondContact O-CG 3.39Å; M1-L5 PolarHBondContact O-N 2.88Å; M1-L5 VanDerWaalsContact O-N 3.09Å
2F41.7Very low53Low121 Ų12192.3 Ų92.353%0.53147%0.47SS..Hα-helixtrans-62.7-39178.2-92.9-96.5000115.1T4 L5 N6 I59F2-T4 VanDerWaalsContact C-N 3.33Å; F2-T4 PolarHBondContact O-N 3.11Å; F2-L5 PolarHBondContact O-N 3.37Å; F2-N6 PolarHBondContact O-N 3.42Å; F2-N6 VanDerWaalsContact O-N 3.13Å; F2-I59 HydrophobicContact CD1-CG2 3.94Å; F2-I59 HydrophobicContact CE1-CG2 3.03Å; F2-I59 HydrophobicContact CE2-CG2 4.14Å; F2-I59 HydrophobicContact CZ-CG2 3.16Å
3R49.7Very low53.9Low230 Ų23087.5 Ų87.587%0.86846%0.456SS*.Hα-helixtrans-62.1-40.9175.8-99.8-179.7174167.6-2.5111.9M1 S7M1-R3 PolarHBondContact O-N 3.27Å; R3-S7 PolarHBondContact O-N 3.01Å; R3-S7 PolarHBondContact O-OG 3.34Å
4T49.7Very low54.8Low79 Ų7988.9 Ų88.949%0.48546%0.458SS..Hα-helixtrans-70.6-39.5-180450000111.8M1 F2 S7 L8M1-T4 WeakPolarHBondContact CA-OG1 3.44Å; M1-T4 PolarHBondContact O-N 3.25Å; M1-T4 PolarHBondContact O-OG1 3.38Å; F2-T4 VanDerWaalsContact C-N 3.33Å; F2-T4 PolarHBondContact O-N 3.11Å; T4-S7 WeakPolarHBondContact CA-OG 3.3Å; T4-S7 PolarHBondContact O-OG 2.9Å; T4-L8 VanDerWaalsContact O-CB 3.26Å; T4-L8 WeakPolarHBondContact O-CB 3.26Å; T4-L8 VanDerWaalsContact O-CD1 3.22Å; T4-L8 WeakPolarHBondContact O-CD1 3.37Å; T4-L8 WeakPolarHBondContact O-CG 3.32Å; T4-L8 PolarHBondContact O-N 2.9Å
5L47.5Very low55.7Low57 Ų5791.7 Ų91.730%0.29847%0.465SS..Hα-helixtrans-64.6-41.9176-73.9155.4000112.4M1 F2 L8 T9 I59M1-L5 WeakPolarHBondContact O-CD1 3.12Å; M1-L5 WeakPolarHBondContact O-CG 3.39Å; M1-L5 PolarHBondContact O-N 2.88Å; M1-L5 VanDerWaalsContact O-N 3.09Å; F2-L5 PolarHBondContact O-N 3.37Å; L5-L8 PolarHBondContact O-N 3.49Å; L5-T9 VanDerWaalsContact O-CG2 3.31Å; L5-T9 WeakPolarHBondContact O-CG2 3.28Å; L5-T9 PolarHBondContact O-N 2.55Å; L5-T9 PolarHBondContact O-OG1 3.37Å; L5-I59 HydrophobicContact CB-CD1 4.26Å; L5-I59 HydrophobicContact CD1-CD1 3.92Å; L5-I59 HydrophobicContact CD2-CD1 4.48Å; L5-I59 HydrophobicContact CG-CD1 4.45Å
6N48.3Very low56.3Low57 Ų5794.8 Ų94.831%0.30547%0.47SS..Hα-helixtrans-70-41.3178.2-119.716.1000112.2F2 L8 T9 I10 I67 L71F2-N6 PolarHBondContact O-N 3.42Å; F2-N6 VanDerWaalsContact O-N 3.13Å; N6-L8 VanDerWaalsContact C-N 3.28Å; N6-L8 PolarHBondContact O-N 2.88Å; N6-T9 WeakPolarHBondContact CA-OG1 3.45Å; N6-T9 PolarHBondContact O-N 3.27Å; N6-T9 PolarHBondContact O-OG1 3.46Å; N6-I10 WeakPolarHBondContact O-CG1 3.37Å; N6-I10 PolarHBondContact O-N 2.67Å; N6-I10 VanDerWaalsContact O-N 3.11Å; N6-I67 VanDerWaalsContact ND2-CG2 3.3Å; N6-I67 WeakPolarHBondContact ND2-CG2 3.41Å; N6-L71 HydrophobicContact CB-CD1 4.38Å; N6-L71 WeakPolarHBondContact ND2-CD1 3.11Å; N6-L71 VanDerWaalsContact OD1-CD1 3.23Å; N6-L71 WeakPolarHBondContact OD1-CD1 3.35Å
7S55.8Low57Low58 Ų5891.9 Ų91.941%0.40646%0.456SS..Hα-helixtrans-61.8-41172.860.40000110.7R3 T4 T9 I10 V11R3-S7 PolarHBondContact O-N 3.01Å; R3-S7 PolarHBondContact O-OG 3.34Å; T4-S7 WeakPolarHBondContact CA-OG 3.3Å; T4-S7 PolarHBondContact O-OG 2.9Å; S7-T9 PolarHBondContact O-N 2.84Å; S7-I10 PolarHBondContact O-N 3.37Å; S7-V11 VanDerWaalsContact O-CB 3.28Å; S7-V11 WeakPolarHBondContact O-CB 3.15Å; S7-V11 WeakPolarHBondContact O-CG2 3.41Å; S7-V11 PolarHBondContact O-N 3.33Å
8L54.2Low57.7Low106 Ų10691.2 Ų91.256%0.55545%0.454SS*.Hα-helixtrans-62.9-39.9176.1-78160000112.2T4 L5 N6 V11 S12T4-L8 VanDerWaalsContact O-CB 3.26Å; T4-L8 WeakPolarHBondContact O-CB 3.26Å; T4-L8 VanDerWaalsContact O-CD1 3.22Å; T4-L8 WeakPolarHBondContact O-CD1 3.37Å; T4-L8 WeakPolarHBondContact O-CG 3.32Å; T4-L8 PolarHBondContact O-N 2.9Å; L5-L8 PolarHBondContact O-N 3.49Å; N6-L8 VanDerWaalsContact C-N 3.28Å; N6-L8 PolarHBondContact O-N 2.88Å; L8-V11 PolarHBondContact O-N 3.36Å; L8-S12 WeakPolarHBondContact O-CB 3.33Å; L8-S12 PolarHBondContact O-N 3.26Å
9T56.8Low58.2Low44 Ų4489.9 Ų89.927%0.2745%0.445SS..Hα-helixtrans-65.8-38.7176.955.60000113.2L5 N6 S7 S12 G13 W53L5-T9 VanDerWaalsContact O-CG2 3.31Å; L5-T9 WeakPolarHBondContact O-CG2 3.28Å; L5-T9 PolarHBondContact O-N 2.55Å; L5-T9 PolarHBondContact O-OG1 3.37Å; N6-T9 WeakPolarHBondContact CA-OG1 3.45Å; N6-T9 PolarHBondContact O-N 3.27Å; N6-T9 PolarHBondContact O-OG1 3.46Å; S7-T9 PolarHBondContact O-N 2.84Å; T9-S12 PolarHBondContact O-N 2.89Å; T9-G13 PolarHBondContact O-N 2.97Å; T9-W53 VanDerWaalsContact CB-CH2 3.47Å; T9-W53 HydrophobicContact CG2-CH2 3.61Å; T9-W53 HydrophobicContact CG2-CZ2 4.37Å; T9-W53 HydrophobicContact CG2-CZ3 3.82Å; T9-W53 WeakPolarHBondContact O-CH2 3.31Å
10I59.7Low58.5Low56 Ų5688.8 Ų88.829%0.28744%0.441SS..Hα-helixtrans-71.3-44.1177.1-66.6163.5000110.2N6 S7 S12 G13 F14 L71 L74N6-I10 WeakPolarHBondContact O-CG1 3.37Å; N6-I10 PolarHBondContact O-N 2.67Å; N6-I10 VanDerWaalsContact O-N 3.11Å; S7-I10 PolarHBondContact O-N 3.37Å; I10-S12 VanDerWaalsContact C-N 3.26Å; I10-S12 PolarHBondContact O-N 2.88Å; I10-G13 PolarHBondContact O-N 2.9Å; I10-F14 VanDerWaalsContact O-CB 3.31Å; I10-F14 WeakPolarHBondContact O-CB 3.37Å; I10-F14 PolarHBondContact O-N 3.32Å; I10-L71 HydrophobicContact CD1-CD1 4.1Å; I10-L71 HydrophobicContact CD1-CG 4.4Å; I10-L74 HydrophobicContact CD1-CD1 4.39Å; I10-L74 HydrophobicContact CD1-CD2 4.2Å; I10-L74 HydrophobicContact CG1-CD2 4.49Å; I10-L74 HydrophobicContact CG2-CD2 3.91Å
11V61.9Low58.8Low67 Ų6788.1 Ų88.141%0.40644%0.435SS..Hα-helixtrans-60-40.1174.81690000110.3S7 L8 F14 F15S7-V11 VanDerWaalsContact O-CB 3.28Å; S7-V11 WeakPolarHBondContact O-CB 3.15Å; S7-V11 WeakPolarHBondContact O-CG2 3.41Å; S7-V11 PolarHBondContact O-N 3.33Å; L8-V11 PolarHBondContact O-N 3.36Å; V11-F14 WeakPolarHBondContact O-CB 3.31Å; V11-F14 PolarHBondContact O-N 2.88Å; V11-F15 HydrophobicContact CG1-CD2 3.6Å; V11-F15 HydrophobicContact CG1-CE2 3.4Å; V11-F15 VanDerWaalsContact CG1-CE2 3.4Å; V11-F15 WeakPolarHBondContact O-CD2 3.46Å; V11-F15 PolarHBondContact O-N 3.13Å
12S63.2Low59.5Low37 Ų3785.4 Ų85.426%0.25941%0.414SS..Hα-helixtrans-69.2-42.3177.1174.20000112.9L8 T9 I10 F14 F15 W16 W53L8-S12 WeakPolarHBondContact O-CB 3.33Å; L8-S12 PolarHBondContact O-N 3.26Å; T9-S12 PolarHBondContact O-N 2.89Å; I10-S12 VanDerWaalsContact C-N 3.26Å; I10-S12 PolarHBondContact O-N 2.88Å; S12-F14 VanDerWaalsContact C-N 3.28Å; S12-F14 PolarHBondContact O-N 2.9Å; S12-F15 PolarHBondContact O-N 3.48Å; S12-W16 PolarHBondContact O-N 3.25Å; S12-W53 VanDerWaalsContact OG-CZ3 3.3Å; S12-W53 WeakPolarHBondContact OG-CZ3 3.48Å
13G65.4Low60.4Low29 Ų2980.7 Ų80.730%0.29940%0.397SS..Hα-helixtrans-62.9-36.4171.500000112.3T9 I10 W16 L17T9-G13 PolarHBondContact O-N 2.97Å; I10-G13 PolarHBondContact O-N 2.9Å; G13-W16 WeakPolarHBondContact O-CB 3.45Å; G13-W16 PolarHBondContact O-N 3.5Å; G13-L17 WeakPolarHBondContact O-CD1 3.38Å; G13-L17 VanDerWaalsContact O-CG 3.31Å; G13-L17 WeakPolarHBondContact O-CG 3.42Å; G13-L17 PolarHBondContact O-N 3.43Å
14F66Low61Low108 Ų10873.3 Ų73.347%0.47438%0.377SS..Hα-helixtrans-65.4-43.3172.2-178.4-101.1000112I10 V11 S12 W16 L17 L18I10-F14 VanDerWaalsContact O-CB 3.31Å; I10-F14 WeakPolarHBondContact O-CB 3.37Å; I10-F14 PolarHBondContact O-N 3.32Å; V11-F14 WeakPolarHBondContact O-CB 3.31Å; V11-F14 PolarHBondContact O-N 2.88Å; S12-F14 VanDerWaalsContact C-N 3.28Å; S12-F14 PolarHBondContact O-N 2.9Å; F14-W16 VanDerWaalsContact C-N 3.3Å; F14-W16 PolarHBondContact O-N 3.16Å; F14-L17 PolarHBondContact O-N 3.12Å; F14-L18 HydrophobicContact CD1-CD1 3.7Å; F14-L18 HydrophobicContact CD1-CG 4.24Å; F14-L18 HydrophobicContact CE1-CD1 3.25Å; F14-L18 HydrophobicContact CE1-CG 3.89Å; F14-L18 HydrophobicContact CZ-CD1 3.87Å; F14-L18 HydrophobicContact CZ-CD2 4.42Å; F14-L18 HydrophobicContact CZ-CG 4.08Å; F14-L18 WeakPolarHBondContact O-CB 3.23Å; F14-L18 PolarHBondContact O-N 3.41Å
15F67.9Low61.3Low130 Ų13074.3 Ų74.357%0.5737%0.372SS*.Hα-helixtrans-61.5-38.7172.6-86.3-65.9000112V11 S12 L17 L18 F19V11-F15 HydrophobicContact CG1-CD2 3.6Å; V11-F15 HydrophobicContact CG1-CE2 3.4Å; V11-F15 VanDerWaalsContact CG1-CE2 3.4Å; V11-F15 WeakPolarHBondContact O-CD2 3.46Å; V11-F15 PolarHBondContact O-N 3.13Å; S12-F15 PolarHBondContact O-N 3.48Å; F15-L17 VanDerWaalsContact C-N 3.34Å; F15-L17 PolarHBondContact O-N 2.92Å; F15-L18 PolarHBondContact O-N 3.5Å; F15-F19 VanDerWaalsContact O-CB 3.23Å; F15-F19 WeakPolarHBondContact O-CB 3.05Å; F15-F19 PolarHBondContact O-N 3.5Å
16W66.1Low61.6Low142 Ų14275.7 Ų75.754%0.53838%0.377SS..Hα-helixtrans-63.1-41175.8-163.275000111.9S12 G13 F14 F19 L20S12-W16 PolarHBondContact O-N 3.25Å; G13-W16 WeakPolarHBondContact O-CB 3.45Å; G13-W16 PolarHBondContact O-N 3.5Å; F14-W16 VanDerWaalsContact C-N 3.3Å; F14-W16 PolarHBondContact O-N 3.16Å; W16-F19 WeakPolarHBondContact O-CB 3.38Å; W16-F19 PolarHBondContact O-N 3.04Å; W16-L20 HydrophobicContact CD2-CD1 4.19Å; W16-L20 HydrophobicContact CE3-CD1 3.67Å; W16-L20 HydrophobicContact CH2-CD1 3.72Å; W16-L20 HydrophobicContact CZ2-CD1 4.21Å; W16-L20 HydrophobicContact CZ3-CD1 3.42Å; W16-L20 VanDerWaalsContact CZ3-CD1 3.42Å; W16-L20 WeakPolarHBondContact O-CG 3.32Å; W16-L20 PolarHBondContact O-N 3.35Å
17L68.3Low61.9Low46 Ų4680.5 Ų80.524%0.24140%0.396CS..Hα-helixtrans-72.8-39.3177.5-67.9160.4000112.5G13 F14 F15 F19 L20 F21 V78 I82G13-L17 WeakPolarHBondContact O-CD1 3.38Å; G13-L17 VanDerWaalsContact O-CG 3.31Å; G13-L17 WeakPolarHBondContact O-CG 3.42Å; G13-L17 PolarHBondContact O-N 3.43Å; F14-L17 PolarHBondContact O-N 3.12Å; F15-L17 VanDerWaalsContact C-N 3.34Å; F15-L17 PolarHBondContact O-N 2.92Å; L17-F19 VanDerWaalsContact C-N 3.26Å; L17-F19 PolarHBondContact O-N 3.43Å; L17-L20 PolarHBondContact O-N 3.44Å; L17-F21 WeakPolarHBondContact O-CB 3.19Å; L17-F21 PolarHBondContact O-N 3.46Å; L17-V78 HydrophobicContact CD1-CG1 4.21Å; L17-I82 HydrophobicContact CB-CD1 3.74Å; L17-I82 HydrophobicContact CD1-CD1 3.17Å; L17-I82 HydrophobicContact CD2-CD1 4.27Å; L17-I82 HydrophobicContact CD2-CG2 4.33Å; L17-I82 HydrophobicContact CG-CD1 3.87Å
18L68.9Low61.8Low79 Ų7982 Ų8241%0.41441%0.405SS..Hα-helixtrans-59.9-39.2169.8-83.2177.7000111.4F14 F15 F21 W22F14-L18 HydrophobicContact CD1-CD1 3.7Å; F14-L18 HydrophobicContact CD1-CG 4.24Å; F14-L18 HydrophobicContact CE1-CD1 3.25Å; F14-L18 HydrophobicContact CE1-CG 3.89Å; F14-L18 HydrophobicContact CZ-CD1 3.87Å; F14-L18 HydrophobicContact CZ-CD2 4.42Å; F14-L18 HydrophobicContact CZ-CG 4.08Å; F14-L18 WeakPolarHBondContact O-CB 3.23Å; F14-L18 PolarHBondContact O-N 3.41Å; F15-L18 PolarHBondContact O-N 3.5Å; L18-F21 PolarHBondContact O-N 3.03Å; L18-W22 VanDerWaalsContact O-CB 3.32Å; L18-W22 WeakPolarHBondContact O-CB 3.33Å; L18-W22 PolarHBondContact O-N 2.92Å
19F67.8Low61.6Low66 Ų6683.4 Ų83.429%0.28941%0.407SS..Hα-helixtrans-66.5-45.4177.6-176-91.7000111.6F15 W16 L17 F21 W22 S23 N42 L46F15-F19 VanDerWaalsContact O-CB 3.23Å; F15-F19 WeakPolarHBondContact O-CB 3.05Å; F15-F19 PolarHBondContact O-N 3.5Å; W16-F19 WeakPolarHBondContact O-CB 3.38Å; W16-F19 PolarHBondContact O-N 3.04Å; L17-F19 VanDerWaalsContact C-N 3.26Å; L17-F19 PolarHBondContact O-N 3.43Å; F19-F21 VanDerWaalsContact C-N 3.29Å; F19-F21 PolarHBondContact O-N 3.45Å; F19-W22 PolarHBondContact O-N 2.79Å; F19-S23 WeakPolarHBondContact O-CB 3.49Å; F19-S23 PolarHBondContact O-N 3.28Å; F19-S23 PolarHBondContact O-OG 2.88Å; F19-N42 HydrophobicContact CZ-CB 4.06Å; F19-L46 HydrophobicContact CD1-CD2 3.82Å; F19-L46 HydrophobicContact CD1-CG 4.39Å; F19-L46 HydrophobicContact CE1-CD1 3.77Å; F19-L46 HydrophobicContact CE1-CD2 3.75Å; F19-L46 HydrophobicContact CE1-CG 3.81Å; F19-L46 HydrophobicContact CZ-CG 4.35Å
20L64.1Low61.1Low68 Ų6883.9 Ų83.936%0.35641%0.412SS..Hα-helixtrans-60.8-38.3173-72.6176.6000112.3W16 L17 S23 T24W16-L20 HydrophobicContact CD2-CD1 4.19Å; W16-L20 HydrophobicContact CE3-CD1 3.67Å; W16-L20 HydrophobicContact CH2-CD1 3.72Å; W16-L20 HydrophobicContact CZ2-CD1 4.21Å; W16-L20 HydrophobicContact CZ3-CD1 3.42Å; W16-L20 VanDerWaalsContact CZ3-CD1 3.42Å; W16-L20 WeakPolarHBondContact O-CG 3.32Å; W16-L20 PolarHBondContact O-N 3.35Å; L17-L20 PolarHBondContact O-N 3.44Å; L20-S23 WeakPolarHBondContact CA-OG 3.4Å; L20-S23 PolarHBondContact O-OG 2.85Å; L20-T24 WeakPolarHBondContact O-CB 3.47Å; L20-T24 VanDerWaalsContact O-CG2 3.28Å; L20-T24 WeakPolarHBondContact O-CG2 3.46Å; L20-T24 PolarHBondContact O-N 2.95Å; L20-T24 PolarHBondContact O-OG1 3.11Å
21F64.6Low60.6Low74 Ų7487.1 Ų87.133%0.32544%0.436SS..Hα-helixtrans-67.1-41.1174.5-175.9-98.3000111.9L17 L18 F19 T24 R25 W89L17-F21 WeakPolarHBondContact O-CB 3.19Å; L17-F21 PolarHBondContact O-N 3.46Å; L18-F21 PolarHBondContact O-N 3.03Å; F19-F21 VanDerWaalsContact C-N 3.29Å; F19-F21 PolarHBondContact O-N 3.45Å; F21-T24 WeakPolarHBondContact CA-OG1 3.32Å; F21-T24 PolarHBondContact O-OG1 3.34Å; F21-R25 VanDerWaalsContact O-CB 3.3Å; F21-R25 WeakPolarHBondContact O-CB 3.42Å; F21-R25 PolarHBondContact O-N 2.73Å; F21-W89 HydrophobicContact CE2-CD2 4.24Å; F21-W89 HydrophobicContact CE2-CG 4.2Å; F21-W89 HydrophobicContact CZ-CD2 4.12Å; F21-W89 HydrophobicContact CZ-CE3 4.27Å
22W62.4Low60Low139 Ų13990.8 Ų90.853%0.52745%0.453SS..Hα-helixtrans-66.8-45.1178-168.7-81.9000111.9L18 F19 R25 E26L18-W22 VanDerWaalsContact O-CB 3.32Å; L18-W22 WeakPolarHBondContact O-CB 3.33Å; L18-W22 PolarHBondContact O-N 2.92Å; F19-W22 PolarHBondContact O-N 2.79Å; W22-R25 WeakPolarHBondContact O-CB 3.37Å; W22-R25 PolarHBondContact O-N 3.4Å; W22-E26 PolarHBondContact NE1-OE1 3.47Å; W22-E26 PolarHBondContact O-N 3.3Å
23S61.1Low59.3Low23 Ų2392.6 Ų92.616%0.16148%0.478CS..Hα-helixtrans-62.4-46.1177.764.30000111.1F19 L20 R25 E26 F27F19-S23 WeakPolarHBondContact O-CB 3.49Å; F19-S23 PolarHBondContact O-N 3.28Å; F19-S23 PolarHBondContact O-OG 2.88Å; L20-S23 WeakPolarHBondContact CA-OG 3.4Å; L20-S23 PolarHBondContact O-OG 2.85Å; S23-R25 VanDerWaalsContact C-N 3.29Å; S23-R25 PolarHBondContact O-N 3.44Å; S23-E26 PolarHBondContact O-N 3.5Å; S23-F27 WeakPolarHBondContact O-CD2 3.43Å; S23-F27 PolarHBondContact O-N 3.35Å
24T60.8Low58.2Low74 Ų7497.4 Ų97.445%0.45450%0.495SS..Hα-helixtrans-63.4-33.6174.951.60000112.9L20 F21 F27 C28L20-T24 WeakPolarHBondContact O-CB 3.47Å; L20-T24 VanDerWaalsContact O-CG2 3.28Å; L20-T24 WeakPolarHBondContact O-CG2 3.46Å; L20-T24 PolarHBondContact O-N 2.95Å; L20-T24 PolarHBondContact O-OG1 3.11Å; F21-T24 WeakPolarHBondContact CA-OG1 3.32Å; F21-T24 PolarHBondContact O-OG1 3.34Å; T24-F27 WeakPolarHBondContact O-CB 3.47Å; T24-F27 PolarHBondContact O-N 3.09Å; T24-C28 PolarHBondContact O-N 3.28Å; T24-C28 VanDerWaalsContact O-N 3.07Å
25R56Low57.2Low100 Ų10095.5 Ų95.538%0.37750%0.495SS..Hα-helixtrans-63.2-48172.1-176.1-176.3-177.9-170.95.3111.3F21 W22 S23 F27 C28 F29F21-R25 VanDerWaalsContact O-CB 3.3Å; F21-R25 WeakPolarHBondContact O-CB 3.42Å; F21-R25 PolarHBondContact O-N 2.73Å; W22-R25 WeakPolarHBondContact O-CB 3.37Å; W22-R25 PolarHBondContact O-N 3.4Å; S23-R25 VanDerWaalsContact C-N 3.29Å; S23-R25 PolarHBondContact O-N 3.44Å; R25-F27 VanDerWaalsContact C-N 3.28Å; R25-F27 PolarHBondContact O-N 2.75Å; R25-C28 PolarHBondContact O-N 3.33Å; R25-C28 VanDerWaalsContact O-N 3.13Å; R25-F29 HydrophobicContact CG-CD2 3.59Å; R25-F29 HydrophobicContact CG-CE2 3.73Å; R25-F29 WeakPolarHBondContact O-CD2 3.31Å; R25-F29 PolarHBondContact O-N 2.75Å
26E54.2Low56.2Low87 Ų8795.2 Ų95.241%0.40750%0.5SS..Hα-helixtrans-58.4-41.8176.2-71.9-176.6172.900111.3W22 S23 C28 F29 S30W22-E26 PolarHBondContact NE1-OE1 3.47Å; W22-E26 PolarHBondContact O-N 3.3Å; S23-E26 PolarHBondContact O-N 3.5Å; E26-C28 VanDerWaalsContact C-N 3.35Å; E26-C28 PolarHBondContact O-N 3.46Å; E26-F29 PolarHBondContact O-N 2.86Å; E26-S30 PolarHBondContact O-N 3.47Å; E26-S30 VanDerWaalsContact O-N 3.14Å; E26-S30 PolarHBondContact O-OG 2.91Å
27F54.4Low55.3Low158 Ų15898.6 Ų98.669%0.69351%0.514SS*.Hα-helixtrans-58.2-41173.4-83.9-71.6000113.4S23 T24 R25S23-F27 WeakPolarHBondContact O-CD2 3.43Å; S23-F27 PolarHBondContact O-N 3.35Å; T24-F27 WeakPolarHBondContact O-CB 3.47Å; T24-F27 PolarHBondContact O-N 3.09Å; R25-F27 VanDerWaalsContact C-N 3.28Å; R25-F27 PolarHBondContact O-N 2.75Å
28C53.2Low54.4Low90 Ų9097.9 Ų97.961%0.60852%0.515SS*.Hα-helixtrans-74.5-30.2177.4-78.60000113.6T24 R25 E26 S30T24-C28 PolarHBondContact O-N 3.28Å; T24-C28 VanDerWaalsContact O-N 3.07Å; R25-C28 PolarHBondContact O-N 3.33Å; R25-C28 VanDerWaalsContact O-N 3.13Å; E26-C28 VanDerWaalsContact C-N 3.35Å; E26-C28 PolarHBondContact O-N 3.46Å; C28-S30 VanDerWaalsContact C-N 3.3Å
29F51.9Low53.4Low135 Ų13596.9 Ų96.959%0.59251%0.513SS*.Hα-helixtrans-84-1.3178.5-86-79.5000113.7R25 E26 P31R25-F29 HydrophobicContact CG-CD2 3.59Å; R25-F29 HydrophobicContact CG-CE2 3.73Å; R25-F29 WeakPolarHBondContact O-CD2 3.31Å; R25-F29 PolarHBondContact O-N 2.75Å; E26-F29 PolarHBondContact O-N 2.86Å; F29-P31 VanDerWaalsContact C-CD 3.49Å; F29-P31 WeakPolarHBondContact O-CD 3.4Å
30S45.6Very low52.5Low54 Ų5498.2 Ų98.238%0.37853%0.527SS..  trans-86.994.2166.2-68.40000110E26 C28 L32E26-S30 PolarHBondContact O-N 3.47Å; E26-S30 VanDerWaalsContact O-N 3.14Å; E26-S30 PolarHBondContact O-OG 2.91Å; C28-S30 VanDerWaalsContact C-N 3.3Å; S30-L32 PolarHBondContact O-N 2.9Å
31P49.9Very low52Low123 Ų12399.3 Ų99.380%0.79954%0.536SS*.SBendtrans-66.1-12.6173.828-36.9000113.1F29F29-P31 VanDerWaalsContact C-CD 3.49Å; F29-P31 WeakPolarHBondContact O-CD 3.4Å
32L47.5Very low51.7Low144 Ų14497.9 Ų97.975%0.75453%0.532SS*.SBendtrans-121.3103.8179.3-68.5134.3000107.2S30 I34S30-L32 PolarHBondContact O-N 2.9Å; L32-I34 PolarHBondContact O-N 2.87Å
33G48.7Very low51.3Low76 Ų7697.2 Ų97.278%0.78454%0.535SS*.SBendtrans-67.543.9-169.300000117
34I43.7Very low51Low129 Ų129100.9 Ų100.966%0.66256%0.556SS**  trans-139.698.5169.1-59.295.1000107.9L32 D36L32-I34 PolarHBondContact O-N 2.87Å; I34-D36 VanDerWaalsContact CG2-OD2 3.24Å; I34-D36 WeakPolarHBondContact CG2-OD2 3.13Å
35S43.4Very low51Low68 Ų68102.1 Ų102.148%0.47656%0.559SS.*  trans-11890.8159.9-179.90000107.4Y37S35-Y37 PolarHBondContact O-N 2.86Å
36D48.2Very low51Low125 Ų12599.9 Ų99.967%0.66856%0.555SS**THydrogen-bonded Turntrans-70.7-5.8-178.7-70-38.4000113.4I34I34-D36 VanDerWaalsContact CG2-OD2 3.24Å; I34-D36 WeakPolarHBondContact CG2-OD2 3.13Å
37Y46Very low51.3Low212 Ų212102.4 Ų102.483%0.83157%0.568SS**THydrogen-bonded Turntrans-107.9-9.5-171.5-76.9-82.5000115.6S35S35-Y37 PolarHBondContact O-N 2.86Å
38A50.3Low51.5Low32 Ų3297.5 Ų97.526%0.26455%0.553SS.*SBendtrans-91.7-28.7-178.400000116.9N42A38-N42 PolarHBondContact O-ND2 3.1Å
39P48.7Very low51.9Low57 Ų5797.2 Ų97.237%0.3755%0.545SS..Hα-helixtrans-73.2-40.8-170.424.3-29.7000113.1N42 E43P39-N42 PolarHBondContact O-N 3.37Å; P39-E43 WeakPolarHBondContact O-CG 3.39Å; P39-E43 PolarHBondContact O-N 3.35Å; P39-E43 VanDerWaalsContact O-N 3.08Å
40V47.1Very low52.2Low95 Ų9593.8 Ų93.858%0.57654%0.538SS*.Hα-helixtrans-72.2-41.2-168.2-175.60000113N42 E43 V44V40-N42 VanDerWaalsContact C-N 3.32Å; V40-N42 PolarHBondContact O-N 3.47Å; V40-E43 PolarHBondContact O-N 3.34Å; V40-V44 WeakPolarHBondContact O-CG2 3.28Å; V40-V44 PolarHBondContact O-N 3.49Å
41T53.9Low52.6Low90 Ų9095.5 Ų95.555%0.55255%0.546SS*.Hα-helixtrans-68.7-33.8178.943.40000111.8L45T41-L45 PolarHBondContact O-N 3.41Å
42N58.5Low52.8Low45 Ų4595.1 Ų95.124%0.24154%0.536CS..Hα-helixtrans-71.1-39.5177.4-74.3-25.6000112.3F19 A38 P39 V40 L46F19-N42 HydrophobicContact CZ-CB 4.06Å; A38-N42 PolarHBondContact O-ND2 3.1Å; P39-N42 PolarHBondContact O-N 3.37Å; V40-N42 VanDerWaalsContact C-N 3.32Å; V40-N42 PolarHBondContact O-N 3.47Å; N42-L46 WeakPolarHBondContact O-CB 3.34Å; N42-L46 WeakPolarHBondContact O-CD1 3.28Å; N42-L46 WeakPolarHBondContact O-CG 3.49Å; N42-L46 PolarHBondContact O-N 2.9Å
43E55.2Low53.1Low124 Ų12493 Ų9358%0.57952%0.518SS*.Hα-helixtrans-63.6-42.9177.8-75.7177.1-169.900112.9P39 V40 L46 M47P39-E43 WeakPolarHBondContact O-CG 3.39Å; P39-E43 PolarHBondContact O-N 3.35Å; P39-E43 VanDerWaalsContact O-N 3.08Å; V40-E43 PolarHBondContact O-N 3.34Å; E43-L46 WeakPolarHBondContact O-CB 3.3Å; E43-L46 PolarHBondContact O-N 3.49Å; E43-M47 PolarHBondContact O-N 3.02Å
44V54.8Low53Low101 Ų10193.8 Ų93.861%0.61251%0.51SS*.Hα-helixtrans-67.3-41.9179.8177.40000111.2V40 M47 S48V40-V44 WeakPolarHBondContact O-CG2 3.28Å; V40-V44 PolarHBondContact O-N 3.49Å; V44-M47 PolarHBondContact O-N 3.35Å; V44-S48 PolarHBondContact O-N 3.35Å; V44-S48 PolarHBondContact O-OG 2.91Å
45L59.7Low52.9Low99 Ų9992 Ų9252%0.51851%0.508SS..Hα-helixtrans-62.5-44.1174.7-107.2157.3000111.1T41 S48 I49T41-L45 PolarHBondContact O-N 3.41Å; L45-S48 PolarHBondContact O-N 3.33Å; L45-S48 PolarHBondContact O-OG 2.86Å; L45-I49 HydrophobicContact CD2-CD1 4.28Å; L45-I49 WeakPolarHBondContact O-CD1 3.13Å; L45-I49 VanDerWaalsContact O-CG1 3.29Å; L45-I49 WeakPolarHBondContact O-CG1 3.22Å; L45-I49 PolarHBondContact O-N 3.23Å; L45-I49 VanDerWaalsContact O-N 3.08Å
46L56.5Low52.9Low54 Ų5494.8 Ų94.828%0.28352%0.515SS..Hα-helixtrans-59.4-47.2175.8-79.9167.7000112.7F19 N42 E43 S48 I49 S50F19-L46 HydrophobicContact CD1-CD2 3.82Å; F19-L46 HydrophobicContact CD1-CG 4.39Å; F19-L46 HydrophobicContact CE1-CD1 3.77Å; F19-L46 HydrophobicContact CE1-CD2 3.75Å; F19-L46 HydrophobicContact CE1-CG 3.81Å; F19-L46 HydrophobicContact CZ-CG 4.35Å; N42-L46 WeakPolarHBondContact O-CB 3.34Å; N42-L46 WeakPolarHBondContact O-CD1 3.28Å; N42-L46 WeakPolarHBondContact O-CG 3.49Å; N42-L46 PolarHBondContact O-N 2.9Å; E43-L46 WeakPolarHBondContact O-CB 3.3Å; E43-L46 PolarHBondContact O-N 3.49Å; L46-S48 PolarHBondContact O-N 2.81Å; L46-I49 PolarHBondContact O-N 3.18Å; L46-S50 PolarHBondContact O-N 3.47Å
47M59.6Low52.7Low140 Ų14093.2 Ų93.269%0.6951%0.51SS*.Hα-helixtrans-62.5-44.1178.1-77.8-157164.100111.4E43 V44 I49 S50 V51E43-M47 PolarHBondContact O-N 3.02Å; V44-M47 PolarHBondContact O-N 3.35Å; M47-I49 VanDerWaalsContact C-N 3.33Å; M47-I49 PolarHBondContact O-N 3.44Å; M47-S50 PolarHBondContact O-N 2.86Å; M47-S50 VanDerWaalsContact O-N 3.13Å; M47-S50 PolarHBondContact O-OG 3.47Å; M47-V51 WeakPolarHBondContact O-CG2 3.46Å; M47-V51 PolarHBondContact O-N 2.89Å
48S60.2Low52.5Low54 Ų5491.8 Ų91.838%0.37851%0.511SS..Hα-helixtrans-61.5-39.6-18072.20000112.8V44 L45 L46 V51 L52V44-S48 PolarHBondContact O-N 3.35Å; V44-S48 PolarHBondContact O-OG 2.91Å; L45-S48 PolarHBondContact O-N 3.33Å; L45-S48 PolarHBondContact O-OG 2.86Å; L46-S48 PolarHBondContact O-N 2.81Å; S48-V51 PolarHBondContact O-N 3.47Å; S48-L52 WeakPolarHBondContact O-CG 3.3Å; S48-L52 PolarHBondContact O-N 2.83Å; S48-L52 VanDerWaalsContact O-N 3.08Å
49I61.5Low52.5Low85 Ų8592.9 Ų92.944%0.43651%0.512SS..Hα-helixtrans-67.7-38.2176.7-66.6164.1000110.5L45 L46 M47 V51 W53L45-I49 HydrophobicContact CD2-CD1 4.28Å; L45-I49 WeakPolarHBondContact O-CD1 3.13Å; L45-I49 VanDerWaalsContact O-CG1 3.29Å; L45-I49 WeakPolarHBondContact O-CG1 3.22Å; L45-I49 PolarHBondContact O-N 3.23Å; L45-I49 VanDerWaalsContact O-N 3.08Å; L46-I49 PolarHBondContact O-N 3.18Å; M47-I49 VanDerWaalsContact C-N 3.33Å; M47-I49 PolarHBondContact O-N 3.44Å; I49-V51 PolarHBondContact O-N 3.4Å; I49-W53 WeakPolarHBondContact O-CB 3.43Å; I49-W53 PolarHBondContact O-N 3.41Å
50S57.6Low52.2Low63 Ų6394.6 Ų94.644%0.44152%0.523SS..Hα-helixtrans-67.4-33.5178.478.70000113.6L46 M47 W53 C54L46-S50 PolarHBondContact O-N 3.47Å; M47-S50 PolarHBondContact O-N 2.86Å; M47-S50 VanDerWaalsContact O-N 3.13Å; M47-S50 PolarHBondContact O-OG 3.47Å; S50-W53 WeakPolarHBondContact O-CB 3.22Å; S50-C54 PolarHBondContact O-N 2.79Å
51V54.1Low52.5Low90 Ų9092 Ų9255%0.54552%0.515SS..Hα-helixtrans-73.7-46.5176.2173.60000110.7M47 S48 I49 W53 C54 C55M47-V51 WeakPolarHBondContact O-CG2 3.46Å; M47-V51 PolarHBondContact O-N 2.89Å; S48-V51 PolarHBondContact O-N 3.47Å; I49-V51 PolarHBondContact O-N 3.4Å; V51-W53 PolarHBondContact O-N 3.45Å; V51-C54 PolarHBondContact O-N 2.83Å; V51-C54 VanDerWaalsContact O-N 3.17Å; V51-C55 PolarHBondContact O-N 3.43Å; V51-C55 VanDerWaalsContact O-N 3.11Å; V51-C55 PolarHBondContact O-SG 2.98Å
52L54.2Low52.5Low114 Ų11494.4 Ų94.460%0.59753%0.53SS*.Hα-helixtrans-57.6-35.6173-77.4164.1000111.4S48 M56S48-L52 WeakPolarHBondContact O-CG 3.3Å; S48-L52 PolarHBondContact O-N 2.83Å; S48-L52 VanDerWaalsContact O-N 3.08Å; L52-M56 VanDerWaalsContact O-CG 3.28Å; L52-M56 WeakPolarHBondContact O-CG 3.31Å; L52-M56 PolarHBondContact O-N 3.11Å
53W54.2Low52.3Low100 Ų100101.3 Ų101.338%0.37956%0.557SS.*Hα-helixtrans-63.7-50.2173.2175.5-96.5000113.2T9 S12 I49 S50 V51 C55 M56 V57T9-W53 VanDerWaalsContact CB-CH2 3.47Å; T9-W53 HydrophobicContact CG2-CH2 3.61Å; T9-W53 HydrophobicContact CG2-CZ2 4.37Å; T9-W53 HydrophobicContact CG2-CZ3 3.82Å; T9-W53 WeakPolarHBondContact O-CH2 3.31Å; S12-W53 VanDerWaalsContact OG-CZ3 3.3Å; S12-W53 WeakPolarHBondContact OG-CZ3 3.48Å; I49-W53 WeakPolarHBondContact O-CB 3.43Å; I49-W53 PolarHBondContact O-N 3.41Å; S50-W53 WeakPolarHBondContact O-CB 3.22Å; V51-W53 PolarHBondContact O-N 3.45Å; W53-C55 VanDerWaalsContact C-N 3.27Å; W53-C55 PolarHBondContact O-N 3.49Å; W53-M56 PolarHBondContact O-N 3.32Å; W53-M56 VanDerWaalsContact O-N 3.1Å; W53-V57 WeakPolarHBondContact O-CG2 3.12Å
54C45.4Very low52.1Low92 Ų9299.6 Ų99.662%0.62255%0.546SS*.Hα-helixtrans-58.1-38.4177.2-84.10000112.6S50 V51 M56 V57S50-C54 PolarHBondContact O-N 2.79Å; V51-C54 PolarHBondContact O-N 2.83Å; V51-C54 VanDerWaalsContact O-N 3.17Å; C54-M56 VanDerWaalsContact C-N 3.3Å; C54-M56 PolarHBondContact O-N 2.81Å; C54-V57 PolarHBondContact O-N 3.05Å
55C41.8Very low52.5Low91 Ų91100.3 Ų100.362%0.61555%0.55SS**Hα-helixtrans-65.1-30.7177.1-70.60000113.3V51 W53 V57V51-C55 PolarHBondContact O-N 3.43Å; V51-C55 VanDerWaalsContact O-N 3.11Å; V51-C55 PolarHBondContact O-SG 2.98Å; W53-C55 VanDerWaalsContact C-N 3.27Å; W53-C55 PolarHBondContact O-N 3.49Å; C55-V57 VanDerWaalsContact C-N 3.32Å; C55-V57 PolarHBondContact O-N 3.03Å
56M44.3Very low52.5Low127 Ų127101.4 Ų101.463%0.62656%0.556SS**Hα-helixtrans-80.8-9.5-178.6-67.5-70.417700113.8L52 W53 C54 Q58L52-M56 VanDerWaalsContact O-CG 3.28Å; L52-M56 WeakPolarHBondContact O-CG 3.31Å; L52-M56 PolarHBondContact O-N 3.11Å; W53-M56 PolarHBondContact O-N 3.32Å; W53-M56 VanDerWaalsContact O-N 3.1Å; C54-M56 VanDerWaalsContact C-N 3.3Å; C54-M56 PolarHBondContact O-N 2.81Å; M56-Q58 VanDerWaalsContact C-N 3.32Å; M56-Q58 PolarHBondContact O-N 3.27Å
57V42.8Very low52.7Low93 Ų93102.7 Ų102.756%0.56456%0.563SS**THydrogen-bonded Turntrans-84.28-172.2171.10000114.1W53 C54 C55 I59W53-V57 WeakPolarHBondContact O-CG2 3.12Å; C54-V57 PolarHBondContact O-N 3.05Å; C55-V57 VanDerWaalsContact C-N 3.32Å; C55-V57 PolarHBondContact O-N 3.03Å; V57-I59 PolarHBondContact O-N 3.17Å; V57-I59 VanDerWaalsContact O-N 3.12Å
58Q42.7Very low52.7Low182 Ų182102.8 Ų102.885%0.8556%0.555SS**  trans-80.789.5172.3-72.7-173.51.600111.9M56M56-Q58 VanDerWaalsContact C-N 3.32Å; M56-Q58 PolarHBondContact O-N 3.27Å
59I49Very low53Low55 Ų55109.3 Ų109.328%0.28257%0.571SS.*  trans-140.6125.6-179.3-57.8177.1000112.6F2 L5 V57 R64F2-I59 HydrophobicContact CD1-CG2 3.94Å; F2-I59 HydrophobicContact CE1-CG2 3.03Å; F2-I59 HydrophobicContact CE2-CG2 4.14Å; F2-I59 HydrophobicContact CZ-CG2 3.16Å; L5-I59 HydrophobicContact CB-CD1 4.26Å; L5-I59 HydrophobicContact CD1-CD1 3.92Å; L5-I59 HydrophobicContact CD2-CD1 4.48Å; L5-I59 HydrophobicContact CG-CD1 4.45Å; V57-I59 PolarHBondContact O-N 3.17Å; V57-I59 VanDerWaalsContact O-N 3.12Å; I59-R64 PolarHBondContact O-NE 3.5Å; I59-R64 PolarHBondContact O-NH2 2.91Å
60P43.9Very low53.2Low93 Ų93111.4 Ų111.460%0.60458%0.579SS**  trans-76.8172.8-165.229.9-36.8000119R64P60-R64 VanDerWaalsContact C-NE 3.27Å; P60-R64 PolarHBondContact O-NE 3.06Å
61G52.4Low53.3Low39 Ų39110.2 Ų110.240%0.40257%0.568SS.*SBendtrans-81.1-28.5-13800000122.7R64G61-R64 VanDerWaalsContact CA-CZ 3.49Å; G61-R64 WeakPolarHBondContact O-CD 3.31Å; G61-R64 VanDerWaalsContact O-CG 3.32Å; G61-R64 WeakPolarHBondContact O-CG 3.26Å
62V53.9Low53.8Low142 Ų142114.7 Ų114.786%0.86158%0.575SS**THydrogen-bonded Turntrans-97.3-29.3-142.9-154.30000116R64V62-R64 VanDerWaalsContact C-N 3.34Å
63K53.9Low54.6Low189 Ų189113.6 Ų113.682%0.82257%0.57SS**THydrogen-bonded Turntrans-95.418.4175.7-63.5-172.9-179-177.10113.6
64R52.5Low55.3Low89 Ų89112.6 Ų112.634%0.33657%0.571SS.*Hα-helixtrans-76.8-29.1-165.3-73.1-174.5-173.1165.69.4115.2I59 P60 G61 V62 R68I59-R64 PolarHBondContact O-NE 3.5Å; I59-R64 PolarHBondContact O-NH2 2.91Å; P60-R64 VanDerWaalsContact C-NE 3.27Å; P60-R64 PolarHBondContact O-NE 3.06Å; G61-R64 VanDerWaalsContact CA-CZ 3.49Å; G61-R64 WeakPolarHBondContact O-CD 3.31Å; G61-R64 VanDerWaalsContact O-CG 3.32Å; G61-R64 WeakPolarHBondContact O-CG 3.26Å; V62-R64 VanDerWaalsContact C-N 3.34Å; R64-R68 WeakPolarHBondContact O-CB 3.47Å; R64-R68 WeakPolarHBondContact O-CG 3.45Å; R64-R68 PolarHBondContact O-N 3.35Å
65T62.7Low56.3Low116 Ų116112.3 Ų112.371%0.71256%0.563SS**Hα-helixtrans-69.5-46.7-166.753.10000113.5R68 R69T65-R68 PolarHBondContact O-N 3.08Å; T65-R69 PolarHBondContact O-N 2.78Å; T65-R69 VanDerWaalsContact O-N 3.11Å
66L60.1Low57.8Low122 Ų122113.1 Ų113.164%0.63956%0.561SS**Hα-helixtrans-70.5-40.9-177.5-156.5144.1000111.4R69 H70L66-R69 PolarHBondContact O-N 3.36Å; L66-H70 PolarHBondContact O-N 3.41Å
67I60.8Low59.2Low81 Ų81111.7 Ų111.742%0.41556%0.559SS.*Hα-helixtrans-65.2-41.6174.2-63.3171.2000110.7N6 R69 H70 L71N6-I67 VanDerWaalsContact ND2-CG2 3.3Å; N6-I67 WeakPolarHBondContact ND2-CG2 3.41Å; I67-R69 VanDerWaalsContact C-N 3.27Å; I67-R69 PolarHBondContact O-N 3.45Å; I67-H70 PolarHBondContact O-N 3.35Å; I67-L71 VanDerWaalsContact O-CB 3.26Å; I67-L71 WeakPolarHBondContact O-CB 3.32Å; I67-L71 PolarHBondContact O-N 2.82Å
68R59.4Low60.6Low142 Ų142109.1 Ų109.154%0.53654%0.543SS..Hα-helixtrans-59.1-36.9175.1-84.8175179.4-169-2112.3R64 T65 L71 R72R64-R68 WeakPolarHBondContact O-CB 3.47Å; R64-R68 WeakPolarHBondContact O-CG 3.45Å; R64-R68 PolarHBondContact O-N 3.35Å; T65-R68 PolarHBondContact O-N 3.08Å; R68-L71 PolarHBondContact O-N 2.91Å; R68-R72 WeakPolarHBondContact O-CB 3.2Å; R68-R72 WeakPolarHBondContact O-CG 3.17Å; R68-R72 PolarHBondContact O-N 3.38Å
69R65.3Low62Low190 Ų190104.9 Ų104.972%0.71753%0.525SS*.Hα-helixtrans-67.8-47.9179.1-166.1175.2-173.71741.6111.6T65 L66 I67 L71 R72 N73T65-R69 PolarHBondContact O-N 2.78Å; T65-R69 VanDerWaalsContact O-N 3.11Å; L66-R69 PolarHBondContact O-N 3.36Å; I67-R69 VanDerWaalsContact C-N 3.27Å; I67-R69 PolarHBondContact O-N 3.45Å; R69-L71 VanDerWaalsContact C-N 3.29Å; R69-L71 PolarHBondContact O-N 3.25Å; R69-R72 PolarHBondContact O-N 3.49Å; R69-N73 PolarHBondContact O-N 2.96Å
70H65.9Low63.3Low129 Ų129105 Ų10560%0.59753%0.532SS*.Hα-helixtrans-61.9-39.7175-75.6-53.4000112.2L66 I67 N73 L74L66-H70 PolarHBondContact O-N 3.41Å; I67-H70 PolarHBondContact O-N 3.35Å; H70-N73 PolarHBondContact O-N 2.94Å; H70-L74 WeakPolarHBondContact O-CB 3.41Å; H70-L74 PolarHBondContact O-N 3.45Å
71L61.1Low64.6Low39 Ų39103.2 Ų103.220%0.20452%0.524CS..Hα-helixtrans-69.4-37.7-179.8-156.5132.7000112.2N6 I10 I67 R68 R69 L74 L75N6-L71 HydrophobicContact CB-CD1 4.38Å; N6-L71 WeakPolarHBondContact ND2-CD1 3.11Å; N6-L71 VanDerWaalsContact OD1-CD1 3.23Å; N6-L71 WeakPolarHBondContact OD1-CD1 3.35Å; I10-L71 HydrophobicContact CD1-CD1 4.1Å; I10-L71 HydrophobicContact CD1-CG 4.4Å; I67-L71 VanDerWaalsContact O-CB 3.26Å; I67-L71 WeakPolarHBondContact O-CB 3.32Å; I67-L71 PolarHBondContact O-N 2.82Å; R68-L71 PolarHBondContact O-N 2.91Å; R69-L71 VanDerWaalsContact C-N 3.29Å; R69-L71 PolarHBondContact O-N 3.25Å; L71-L74 PolarHBondContact O-N 3.2Å; L71-L75 HydrophobicContact CD2-CD1 3.87Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 PolarHBondContact O-N 3.38Å
72R62.9Low65.7Low184 Ų184103.3 Ų103.369%0.69452%0.515SS*.Hα-helixtrans-61.6-46.1170.5-83.4-177.5175-177.8-2.4111.8R68 R69 L74 L75 L76R68-R72 WeakPolarHBondContact O-CB 3.2Å; R68-R72 WeakPolarHBondContact O-CG 3.17Å; R68-R72 PolarHBondContact O-N 3.38Å; R69-R72 PolarHBondContact O-N 3.49Å; R72-L74 VanDerWaalsContact C-N 3.33Å; R72-L74 PolarHBondContact O-N 3.45Å; R72-L75 PolarHBondContact O-N 3.07Å; R72-L76 WeakPolarHBondContact O-CB 3.4Å; R72-L76 VanDerWaalsContact O-CG 3.28Å; R72-L76 WeakPolarHBondContact O-CG 3.49Å; R72-L76 PolarHBondContact O-N 2.86Å
73N71.4Confident66.7Low91 Ų9199.5 Ų99.549%0.48750%0.495SS..Hα-helixtrans-61.7-42.9177-83.415.2000111.6R69 H70 L76 V77R69-N73 PolarHBondContact O-N 2.96Å; H70-N73 PolarHBondContact O-N 2.94Å; N73-L76 PolarHBondContact O-N 3.48Å; N73-V77 WeakPolarHBondContact O-CG2 3.46Å; N73-V77 PolarHBondContact O-N 2.78Å
74L69.8Low67.8Low78 Ų7894.3 Ų94.341%0.40848%0.479SS..Hα-helixtrans-64.7-45178-165.9154.8000111.2I10 H70 L71 R72 L76 V77 V78I10-L74 HydrophobicContact CD1-CD1 4.39Å; I10-L74 HydrophobicContact CD1-CD2 4.2Å; I10-L74 HydrophobicContact CG1-CD2 4.49Å; I10-L74 HydrophobicContact CG2-CD2 3.91Å; H70-L74 WeakPolarHBondContact O-CB 3.41Å; H70-L74 PolarHBondContact O-N 3.45Å; L71-L74 PolarHBondContact O-N 3.2Å; R72-L74 VanDerWaalsContact C-N 3.33Å; R72-L74 PolarHBondContact O-N 3.45Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.06Å; L74-V77 PolarHBondContact O-N 2.8Å; L74-V78 HydrophobicContact CD2-CG2 3.83Å; L74-V78 VanDerWaalsContact O-CG2 3.31Å; L74-V78 WeakPolarHBondContact O-CG2 3.27Å; L74-V78 PolarHBondContact O-N 3.39Å
75L66.7Low68.8Low86 Ų8691.7 Ų91.745%0.4548%0.48SS..Hα-helixtrans-57.2-45.2173.4-100.2161.7000112L71 R72 V77 V78 I79L71-L75 HydrophobicContact CD2-CD1 3.87Å; L71-L75 WeakPolarHBondContact O-CB 3.43Å; L71-L75 PolarHBondContact O-N 3.38Å; R72-L75 PolarHBondContact O-N 3.07Å; L75-V77 VanDerWaalsContact C-N 3.35Å; L75-V77 PolarHBondContact O-N 2.67Å; L75-V78 PolarHBondContact O-N 2.93Å; L75-I79 HydrophobicContact CD2-CD1 4.25Å; L75-I79 WeakPolarHBondContact O-CB 3.45Å; L75-I79 WeakPolarHBondContact O-CD1 3.21Å; L75-I79 WeakPolarHBondContact O-CG1 3.46Å; L75-I79 PolarHBondContact O-N 3.41Å
76L71.5Confident69.3Low109 Ų10990.5 Ų90.557%0.57147%0.468SS*.Hα-helixtrans-61.4-43.4177.9-75169000111.7R72 N73 L74 I79 S80R72-L76 WeakPolarHBondContact O-CB 3.4Å; R72-L76 VanDerWaalsContact O-CG 3.28Å; R72-L76 WeakPolarHBondContact O-CG 3.49Å; R72-L76 PolarHBondContact O-N 2.86Å; N73-L76 PolarHBondContact O-N 3.48Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.06Å; L76-I79 PolarHBondContact O-N 3.43Å; L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3.42Å; L76-S80 PolarHBondContact O-OG 3.34Å
77V74.2Confident70.1Confident96 Ų9691.4 Ų91.458%0.58247%0.467SS*.Hα-helixtrans-62.5-45.6175.8172.10000110.7N73 L74 L75 S80 A81N73-V77 WeakPolarHBondContact O-CG2 3.46Å; N73-V77 PolarHBondContact O-N 2.78Å; L74-V77 PolarHBondContact O-N 2.8Å; L75-V77 VanDerWaalsContact C-N 3.35Å; L75-V77 PolarHBondContact O-N 2.67Å; V77-S80 WeakPolarHBondContact CA-OG 3.46Å; V77-S80 PolarHBondContact O-N 3.37Å; V77-S80 PolarHBondContact O-OG 3.02Å; V77-A81 WeakPolarHBondContact O-CB 3.23Å; V77-A81 PolarHBondContact O-N 3.13Å
78V71.9Confident70.8Confident39 Ų3993 Ų9324%0.23648%0.476CS..Hα-helixtrans-63.8-45.3179.4170.20000111.7L17 L74 L75 S80 A81 I82L17-V78 HydrophobicContact CD1-CG1 4.21Å; L74-V78 HydrophobicContact CD2-CG2 3.83Å; L74-V78 VanDerWaalsContact O-CG2 3.31Å; L74-V78 WeakPolarHBondContact O-CG2 3.27Å; L74-V78 PolarHBondContact O-N 3.39Å; L75-V78 PolarHBondContact O-N 2.93Å; V78-S80 VanDerWaalsContact C-N 3.31Å; V78-S80 PolarHBondContact O-N 2.96Å; V78-A81 PolarHBondContact O-N 2.77Å; V78-I82 HydrophobicContact CG1-CD1 3.58Å; V78-I82 WeakPolarHBondContact O-CB 3.49Å; V78-I82 WeakPolarHBondContact O-CD1 3.32Å; V78-I82 WeakPolarHBondContact O-CG1 3.27Å; V78-I82 PolarHBondContact O-N 3.43Å
79I73.2Confident71.4Confident93 Ų9391.3 Ų91.348%0.47747%0.47SS..Hα-helixtrans-61.5-41.7175.9-67.5162.9000110.5L75 L76 I82 S83L75-I79 HydrophobicContact CD2-CD1 4.25Å; L75-I79 WeakPolarHBondContact O-CB 3.45Å; L75-I79 WeakPolarHBondContact O-CD1 3.21Å; L75-I79 WeakPolarHBondContact O-CG1 3.46Å; L75-I79 PolarHBondContact O-N 3.41Å; L76-I79 PolarHBondContact O-N 3.43Å; I79-I82 PolarHBondContact O-N 3.5Å; I79-S83 WeakPolarHBondContact O-CB 3.41Å; I79-S83 PolarHBondContact O-N 3.35Å; I79-S83 PolarHBondContact O-OG 2.83Å
80S75.3Confident71.6Confident59 Ų5984.6 Ų84.641%0.41346%0.455SS..Hα-helixtrans-63.6-44.1176.272.90000112.2L76 V77 V78 I82 S83 T84L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3.42Å; L76-S80 PolarHBondContact O-OG 3.34Å; V77-S80 WeakPolarHBondContact CA-OG 3.46Å; V77-S80 PolarHBondContact O-N 3.37Å; V77-S80 PolarHBondContact O-OG 3.02Å; V78-S80 VanDerWaalsContact C-N 3.31Å; V78-S80 PolarHBondContact O-N 2.96Å; S80-I82 PolarHBondContact O-N 3.08Å; S80-S83 WeakPolarHBondContact CA-OG 3.28Å; S80-S83 PolarHBondContact O-N 2.76Å; S80-S83 PolarHBondContact O-OG 3.2Å; S80-T84 WeakPolarHBondContact O-CB 3.34Å; S80-T84 VanDerWaalsContact O-CG2 3.32Å; S80-T84 WeakPolarHBondContact O-CG2 3.47Å; S80-T84 PolarHBondContact O-N 2.99Å; S80-T84 PolarHBondContact O-OG1 3.46Å
81A72.6Confident71.9Confident54 Ų5482 Ų8245%0.44645%0.445SS..Hα-helixtrans-64.2-42.8179.800000111.2V77 V78 T84 G85V77-A81 WeakPolarHBondContact O-CB 3.23Å; V77-A81 PolarHBondContact O-N 3.13Å; V78-A81 PolarHBondContact O-N 2.77Å; A81-T84 WeakPolarHBondContact CA-OG1 3.48Å; A81-T84 PolarHBondContact O-N 3.38Å; A81-T84 PolarHBondContact O-OG1 3.3Å; A81-G85 PolarHBondContact O-N 2.96Å
82I74.5Confident72.6Confident41 Ų4182.9 Ų82.921%0.2146%0.458CS..Hα-helixtrans-70.9-43.3-179.9-69163.9000111.1L17 V78 I79 S80 T84 G85 I86L17-I82 HydrophobicContact CB-CD1 3.74Å; L17-I82 HydrophobicContact CD1-CD1 3.17Å; L17-I82 HydrophobicContact CD2-CD1 4.27Å; L17-I82 HydrophobicContact CD2-CG2 4.33Å; L17-I82 HydrophobicContact CG-CD1 3.87Å; V78-I82 HydrophobicContact CG1-CD1 3.58Å; V78-I82 WeakPolarHBondContact O-CB 3.49Å; V78-I82 WeakPolarHBondContact O-CD1 3.32Å; V78-I82 WeakPolarHBondContact O-CG1 3.27Å; V78-I82 PolarHBondContact O-N 3.43Å; I79-I82 PolarHBondContact O-N 3.5Å; S80-I82 PolarHBondContact O-N 3.08Å; I82-T84 VanDerWaalsContact C-N 3.32Å; I82-T84 PolarHBondContact O-N 3.21Å; I82-G85 PolarHBondContact O-N 3.07Å; I82-I86 HydrophobicContact CG2-CD1 3.57Å; I82-I86 HydrophobicContact CG2-CG1 4.2Å; I82-I86 WeakPolarHBondContact O-CB 3.29Å; I82-I86 VanDerWaalsContact O-CG1 3.22Å; I82-I86 WeakPolarHBondContact O-CG1 3.42Å; I82-I86 PolarHBondContact O-N 3.02Å
83S75.2Confident72.7Confident62 Ų6276.2 Ų76.243%0.43444%0.439SS..Hα-helixtrans-61.4-40.9174.554.50000111.8I79 S80 I86 F87I79-S83 WeakPolarHBondContact O-CB 3.41Å; I79-S83 PolarHBondContact O-N 3.35Å; I79-S83 PolarHBondContact O-OG 2.83Å; S80-S83 WeakPolarHBondContact CA-OG 3.28Å; S80-S83 PolarHBondContact O-N 2.76Å; S80-S83 PolarHBondContact O-OG 3.2Å; S83-I86 PolarHBondContact O-N 3.23Å; S83-F87 VanDerWaalsContact O-CB 3.3Å; S83-F87 WeakPolarHBondContact O-CB 3.33Å; S83-F87 PolarHBondContact O-N 2.92Å
84T75.8Confident72.2Confident81 Ų8179.6 Ų79.650%0.49745%0.45SS..Hα-helixtrans-64.8-40173.155.30000112.6S80 A81 I82 F87 L88S80-T84 WeakPolarHBondContact O-CB 3.34Å; S80-T84 VanDerWaalsContact O-CG2 3.32Å; S80-T84 WeakPolarHBondContact O-CG2 3.47Å; S80-T84 PolarHBondContact O-N 2.99Å; S80-T84 PolarHBondContact O-OG1 3.46Å; A81-T84 WeakPolarHBondContact CA-OG1 3.48Å; A81-T84 PolarHBondContact O-N 3.38Å; A81-T84 PolarHBondContact O-OG1 3.3Å; I82-T84 VanDerWaalsContact C-N 3.32Å; I82-T84 PolarHBondContact O-N 3.21Å; T84-F87 PolarHBondContact O-N 3.18Å; T84-L88 WeakPolarHBondContact O-CB 3.3Å; T84-L88 WeakPolarHBondContact O-CG 2.75Å; T84-L88 PolarHBondContact O-N 3.08Å
85G75.6Confident71.6Confident34 Ų3484.3 Ų84.335%0.35146%0.462SS..Hα-helixtrans-63.9-45.5176.800000112.2A81 I82 F87 L88 W89A81-G85 PolarHBondContact O-N 2.96Å; I82-G85 PolarHBondContact O-N 3.07Å; G85-F87 VanDerWaalsContact C-N 3.33Å; G85-F87 PolarHBondContact O-N 3.06Å; G85-L88 PolarHBondContact O-N 3.31Å; G85-W89 WeakPolarHBondContact O-CB 3.48Å; G85-W89 PolarHBondContact O-N 3.46Å
86I73.1Confident71Confident91 Ų9183 Ų8347%0.46746%0.458SS..Hα-helixtrans-63.6-40.2175.3-65.5164.4000110.5I82 S83 W89 A90I82-I86 HydrophobicContact CG2-CD1 3.57Å; I82-I86 HydrophobicContact CG2-CG1 4.2Å; I82-I86 WeakPolarHBondContact O-CB 3.29Å; I82-I86 VanDerWaalsContact O-CG1 3.22Å; I82-I86 WeakPolarHBondContact O-CG1 3.42Å; I82-I86 PolarHBondContact O-N 3.02Å; S83-I86 PolarHBondContact O-N 3.23Å; I86-W89 PolarHBondContact O-N 3.42Å; I86-A90 VanDerWaalsContact O-CB 3.27Å; I86-A90 WeakPolarHBondContact O-CB 3.35Å; I86-A90 PolarHBondContact O-N 3.41Å
87F75.2Confident70.1Confident140 Ų14081.7 Ų81.761%0.61446%0.458SS*.Hα-helixtrans-66.1-46.8178.7-168.9-102000111.9S83 T84 G85 W89 A90 L91S83-F87 VanDerWaalsContact O-CB 3.3Å; S83-F87 WeakPolarHBondContact O-CB 3.33Å; S83-F87 PolarHBondContact O-N 2.92Å; T84-F87 PolarHBondContact O-N 3.18Å; G85-F87 VanDerWaalsContact C-N 3.33Å; G85-F87 PolarHBondContact O-N 3.06Å; F87-W89 VanDerWaalsContact C-N 3.3Å; F87-W89 PolarHBondContact O-N 3.21Å; F87-A90 PolarHBondContact O-N 3.35Å; F87-L91 HydrophobicContact CD1-CD1 3.73Å; F87-L91 HydrophobicContact CD1-CG 4.47Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE1-CG 4.3Å; F87-L91 HydrophobicContact CZ-CD1 4.27Å; F87-L91 WeakPolarHBondContact O-CB 3.33Å; F87-L91 VanDerWaalsContact O-CG 3.31Å; F87-L91 WeakPolarHBondContact O-CG 3.5Å; F87-L91 PolarHBondContact O-N 3.48Å
88L76.7Confident68.8Low116 Ų11680.3 Ų80.361%0.60746%0.457SS*.Hα-helixtrans-61-40.1173.5-73.4171000111.5T84 G85 L91 A92T84-L88 WeakPolarHBondContact O-CB 3.3Å; T84-L88 WeakPolarHBondContact O-CG 2.75Å; T84-L88 PolarHBondContact O-N 3.08Å; G85-L88 PolarHBondContact O-N 3.31Å; L88-L91 PolarHBondContact O-N 3.21Å; L88-A92 VanDerWaalsContact O-CB 3.27Å; L88-A92 WeakPolarHBondContact O-CB 3.37Å; L88-A92 PolarHBondContact O-N 2.87Å
89W72.7Confident67.7Low105 Ų10584 Ų8440%0.39848%0.475SS..Hα-helixtrans-66.2-46.5177.1-174.1-94.1000112.2F21 G85 I86 F87 L91 A92 C93F21-W89 HydrophobicContact CE2-CD2 4.24Å; F21-W89 HydrophobicContact CE2-CG 4.2Å; F21-W89 HydrophobicContact CZ-CD2 4.12Å; F21-W89 HydrophobicContact CZ-CE3 4.27Å; G85-W89 WeakPolarHBondContact O-CB 3.48Å; G85-W89 PolarHBondContact O-N 3.46Å; I86-W89 PolarHBondContact O-N 3.42Å; F87-W89 VanDerWaalsContact C-N 3.3Å; F87-W89 PolarHBondContact O-N 3.21Å; W89-L91 VanDerWaalsContact C-N 3.29Å; W89-L91 PolarHBondContact O-N 3.38Å; W89-A92 CarbonylContact O-C 3.44Å; W89-A92 WeakPolarHBondContact O-CA 3.12Å; W89-A92 WeakPolarHBondContact O-CB 3.34Å; W89-A92 PolarHBondContact O-N 3.22Å; W89-C93 PolarHBondContact NE1-SG 3.38Å; W89-C93 VanDerWaalsContact NE1-SG 3.41Å; W89-C93 PolarHBondContact O-N 3.41Å; W89-C93 PolarHBondContact O-SG 3.4Å; W89-C93 VanDerWaalsContact O-SG 3.42Å
90A69.3Low66.6Low50 Ų5084.4 Ų84.441%0.41348%0.477SS..Hα-helixtrans-61.5-38.7176.800000111.9I86 F87 C93 K94I86-A90 VanDerWaalsContact O-CB 3.27Å; I86-A90 WeakPolarHBondContact O-CB 3.35Å; I86-A90 PolarHBondContact O-N 3.41Å; F87-A90 PolarHBondContact O-N 3.35Å; A90-C93 PolarHBondContact O-N 3.01Å; A90-K94 PolarHBondContact O-N 3.07Å
91L71.2Confident65.2Low74 Ų7483.7 Ų83.739%0.38748%0.479SS..Hα-helixtrans-63-45.8170.7-74.2170.7000111.3F87 L88 W89 C93 K94 W95F87-L91 HydrophobicContact CD1-CD1 3.73Å; F87-L91 HydrophobicContact CD1-CG 4.47Å; F87-L91 HydrophobicContact CE1-CD1 3.53Å; F87-L91 HydrophobicContact CE1-CG 4.3Å; F87-L91 HydrophobicContact CZ-CD1 4.27Å; F87-L91 WeakPolarHBondContact O-CB 3.33Å; F87-L91 VanDerWaalsContact O-CG 3.31Å; F87-L91 WeakPolarHBondContact O-CG 3.5Å; F87-L91 PolarHBondContact O-N 3.48Å; L88-L91 PolarHBondContact O-N 3.21Å; W89-L91 VanDerWaalsContact C-N 3.29Å; W89-L91 PolarHBondContact O-N 3.38Å; L91-C93 VanDerWaalsContact C-N 3.28Å; L91-C93 PolarHBondContact O-N 2.92Å; L91-K94 PolarHBondContact O-N 3.32Å; L91-W95 PolarHBondContact O-N 3.43Å
92A74.9Confident63.9Low57 Ų5789.6 Ų89.647%0.47150%0.495SS..Hα-helixtrans-67.4-24.117800000113.5L88 W89 P96L88-A92 VanDerWaalsContact O-CB 3.27Å; L88-A92 WeakPolarHBondContact O-CB 3.37Å; L88-A92 PolarHBondContact O-N 2.87Å; W89-A92 CarbonylContact O-C 3.44Å; W89-A92 WeakPolarHBondContact O-CA 3.12Å; W89-A92 WeakPolarHBondContact O-CB 3.34Å; W89-A92 PolarHBondContact O-N 3.22Å; A92-P96 WeakPolarHBondContact O-CD 3.26Å; A92-P96 WeakPolarHBondContact O-CG 3.44Å
93C65.1Low62.7Low45 Ų4591 Ų9130%0.30451%0.512SS..Hα-helixtrans-79.4-35170.7-70.60000111.9W89 A90 L91 P96 S97W89-C93 PolarHBondContact NE1-SG 3.38Å; W89-C93 VanDerWaalsContact NE1-SG 3.41Å; W89-C93 PolarHBondContact O-N 3.41Å; W89-C93 PolarHBondContact O-SG 3.4Å; W89-C93 VanDerWaalsContact O-SG 3.42Å; A90-C93 PolarHBondContact O-N 3.01Å; L91-C93 VanDerWaalsContact C-N 3.28Å; L91-C93 PolarHBondContact O-N 2.92Å; C93-P96 WeakPolarHBondContact O-CD 3.36Å; C93-P96 WeakPolarHBondContact O-CG 3.39Å; C93-S97 PolarHBondContact O-OG 2.95Å
94K62.5Low61.2Low162 Ų16293.8 Ų93.870%0.70452%0.522SS*.Hα-helixtrans-72.1-34.5175.7-92.4-174.7172.51750113.4A90 L91 S97 A98A90-K94 PolarHBondContact O-N 3.07Å; L91-K94 PolarHBondContact O-N 3.32Å; K94-S97 PolarHBondContact O-N 3.13Å; K94-A98 PolarHBondContact O-N 3.14Å
95W56.7Low60Low177 Ų17796.5 Ų96.567%0.6753%0.533SS*.Hα-helixtrans-60.3-46.2-179.3-99.868.7000115.4L91 S97 A98 L99L91-W95 PolarHBondContact O-N 3.43Å; W95-S97 VanDerWaalsContact C-N 3.32Å; W95-S97 PolarHBondContact O-N 3.36Å; W95-A98 PolarHBondContact O-N 2.92Å; W95-L99 HydrophobicContact CE3-CD1 4.09Å; W95-L99 PolarHBondContact O-N 3.11Å
96P54Low58.5Low57 Ų57102 Ų10237%0.3755%0.554SS.*Hα-helixtrans-65.5-36.7175.324.6-32.7000110.5A92 C93 A98 L99 I100A92-P96 WeakPolarHBondContact O-CD 3.26Å; A92-P96 WeakPolarHBondContact O-CG 3.44Å; C93-P96 WeakPolarHBondContact O-CD 3.36Å; C93-P96 WeakPolarHBondContact O-CG 3.39Å; P96-A98 VanDerWaalsContact C-N 3.3Å; P96-A98 PolarHBondContact O-N 2.75Å; P96-L99 PolarHBondContact O-N 3.14Å; P96-I100 HydrophobicContact CB-CD1 4.17Å; P96-I100 VanDerWaalsContact O-CB 3.26Å; P96-I100 WeakPolarHBondContact O-CB 3.45Å; P96-I100 WeakPolarHBondContact O-CD1 2.87Å; P96-I100 PolarHBondContact O-N 3.05Å
97S51.7Low57.1Low82 Ų82106.4 Ų106.457%0.57357%0.566SS**Hα-helixtrans-64.8-32174.7-52.60000113C93 K94 W95 G101C93-S97 PolarHBondContact O-OG 2.95Å; K94-S97 PolarHBondContact O-N 3.13Å; W95-S97 VanDerWaalsContact C-N 3.32Å; W95-S97 PolarHBondContact O-N 3.36Å; S97-G101 WeakPolarHBondContact O-CA 3.24Å; S97-G101 PolarHBondContact O-N 3.42Å
98A48.4Very low55.8Low68 Ų68105.2 Ų105.256%0.56257%0.57SS**Hα-helixtrans-72.8-32.9174.100000112.9K94 W95 P96K94-A98 PolarHBondContact O-N 3.14Å; W95-A98 PolarHBondContact O-N 2.92Å; P96-A98 VanDerWaalsContact C-N 3.3Å; P96-A98 PolarHBondContact O-N 2.75Å
99L47.5Very low54.2Low117 Ų117103.7 Ų103.761%0.61357%0.567SS**Hα-helixtrans-80.1-42.8176.1-81.8156.1000112.5W95 P96 K102 A103W95-L99 HydrophobicContact CE3-CD1 4.09Å; W95-L99 PolarHBondContact O-N 3.11Å; P96-L99 PolarHBondContact O-N 3.14Å; L99-K102 PolarHBondContact O-N 3.48Å; L99-A103 PolarHBondContact O-N 3.37Å; L99-A103 VanDerWaalsContact O-N 3.14Å
100I50.7Low52.9Low101 Ų101106.9 Ų106.952%0.51858%0.584SS.*Hα-helixtrans-72.3-36.3176.5-84.2130.7000111.9P96 K102 A103 N104P96-I100 HydrophobicContact CB-CD1 4.17Å; P96-I100 VanDerWaalsContact O-CB 3.26Å; P96-I100 WeakPolarHBondContact O-CB 3.45Å; P96-I100 WeakPolarHBondContact O-CD1 2.87Å; P96-I100 PolarHBondContact O-N 3.05Å; I100-K102 PolarHBondContact O-N 3.18Å; I100-A103 PolarHBondContact O-N 3.41Å; I100-A103 VanDerWaalsContact O-N 3.11Å; I100-N104 PolarHBondContact O-N 2.75Å
101G46.2Very low51.5Low43 Ų43109.2 Ų109.244%0.44360%0.603SS.*Hα-helixtrans-62.6-29.9174.300000113.1S97S97-G101 WeakPolarHBondContact O-CA 3.24Å; S97-G101 PolarHBondContact O-N 3.42Å
102K45.9Very low50.1Low179 Ų179111.7 Ų111.778%0.77862%0.617SS**Hα-helixtrans-81.2-28.6171.8-103.3-178.4171.5176.90113.5L99 I100L99-K102 PolarHBondContact O-N 3.48Å; I100-K102 PolarHBondContact O-N 3.18Å
103A48.3Very low48.5Very low69 Ų69117.8 Ų117.857%0.5766%0.656SS**Hα-helixtrans-74.8-31.1178.600000113L99 I100 L105L99-A103 PolarHBondContact O-N 3.37Å; L99-A103 VanDerWaalsContact O-N 3.14Å; I100-A103 PolarHBondContact O-N 3.41Å; I100-A103 VanDerWaalsContact O-N 3.11Å; A103-L105 PolarHBondContact O-N 2.76Å
104N44.6Very low47.7Very low122 Ų122121.4 Ų121.465%0.65267%0.674SS**G310 helixtrans-82.4-0.3-175.8-92.5-23.7000115.9I100 N106I100-N104 PolarHBondContact O-N 2.75Å; N104-N106 PolarHBondContact O-N 3.22Å
105L49.6Very low46.9Very low137 Ų137119.3 Ų119.372%0.71767%0.672SS**G310 helixtrans-74.4-8.2172.8-104.6115.6000114.1A103A103-L105 PolarHBondContact O-N 2.76Å
106N44.5Very low46.4Very low150 Ų150116.1 Ų116.180%0.80267%0.672SS**G310 helixtrans-107.49.8-175.1-76.7-0000115.9N104N104-N106 PolarHBondContact O-N 3.22Å
107Y44.3Very low45.9Very low184 Ų184119.5 Ų119.572%0.72269%0.69SS**  trans-114.169.6170.4-159.3-96.4000111.1P109Y107-P109 HydrophobicContact CD1-CG 4.22Å; Y107-P109 HydrophobicContact CE1-CB 3.86Å; Y107-P109 HydrophobicContact CE1-CG 3.81Å; Y107-P109 VanDerWaalsContact O-CD 3.22Å; Y107-P109 WeakPolarHBondContact O-CD 3.22Å
108V46.8Very low45.6Very low115 Ų115121.9 Ų121.970%0.69770%0.697SS**  trans-84.1104.1150.8-178.20000105.1F110V108-F110 PolarHBondContact O-N 2.95Å
109P44.4Very low45.4Very low84 Ų84125.5 Ų125.555%0.54571%0.706SS.*  trans-65.2106.716626.7-29000106.3Y107 A111Y107-P109 HydrophobicContact CD1-CG 4.22Å; Y107-P109 HydrophobicContact CE1-CB 3.86Å; Y107-P109 HydrophobicContact CE1-CG 3.81Å; Y107-P109 VanDerWaalsContact O-CD 3.22Å; Y107-P109 WeakPolarHBondContact O-CD 3.22Å; P109-A111 PolarHBondContact O-N 2.95Å
110F43.9Very low45.2Very low172 Ų172126.1 Ų126.175%0.75471%0.713SS**  trans-53.1107.2170.7-119.8-93.7000107.6V108 N112V108-F110 PolarHBondContact O-N 2.95Å; F110-N112 VanDerWaalsContact C-N 3.28Å; F110-N112 WeakPolarHBondContact CD1-OD1 3.47Å; F110-N112 PolarHBondContact O-N 2.98Å
111A39.8Very low44.8Very low98 Ų98128 Ų12881%0.8173%0.728SS**  trans-6791.8164.700000107.2P109P109-A111 PolarHBondContact O-N 2.95Å
112N41.6Very low44.7Very low126 Ų126135.1 Ų135.167%0.67475%0.751SS**  trans-100.6102.8165.1-86.1-2.8000108.1F110F110-N112 VanDerWaalsContact C-N 3.28Å; F110-N112 WeakPolarHBondContact CD1-OD1 3.47Å; F110-N112 PolarHBondContact O-N 2.98Å
113S42.8Very low44.6Very low185 Ų185131.1 Ų131.1100%1.29475%0.749SS**  trans30.90135.764.60000118

Retrieved 113 of 113 residues in 32.1 ms (Link to these results)