G4VG84_SCHMA Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit KCP2

AlphaFold DB , UniProt , Accession G4VG84, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 132 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41Very low71.3Confident216 Ų21689.6 Ų89.6100%1.06449%0.49SS*.  0108.70177.9174.3-178.800107.2L3M1-L3 HydrophobicContact CE-CD2 4.33Å; M1-L3 PolarHBondContact O-N 3.24Å
2V55.9Low73Confident147 Ų14783.3 Ų83.389%0.89146%0.458SS*.  trans-76.3108.1173.41760000106.4
3L57.1Low74.6Confident66 Ų6681.1 Ų81.135%0.34644%0.444SS..  trans-65135.7173.2-70.7165.8000107.9M1 A7 S8 M11M1-L3 HydrophobicContact CE-CD2 4.33Å; M1-L3 PolarHBondContact O-N 3.24Å; L3-A7 HydrophobicContact CB-CB 4.17Å; L3-A7 HydrophobicContact CD2-CB 4.19Å; L3-S8 VanDerWaalsContact CB-OG 3.24Å; L3-S8 WeakPolarHBondContact CB-OG 3.37Å; L3-S8 PolarHBondContact O-OG 3.4Å; L3-M11 HydrophobicContact CD1-CG 4.17Å
4K65.7Low76Confident181 Ų18180.5 Ų80.579%0.78744%0.44SS*.  trans-54.5144.4171-72.9-177.1171.5178.30108.7G6 A7 S8K4-G6 PolarHBondContact O-N 3.31Å; K4-A7 WeakPolarHBondContact O-CA 3.4Å; K4-A7 WeakPolarHBondContact O-CB 3.49Å; K4-A7 PolarHBondContact O-N 3.1Å; K4-S8 PolarHBondContact O-N 3.21Å; K4-S8 VanDerWaalsContact O-N 3.09Å
5S67.8Low77.3Confident48 Ų4881.7 Ų81.734%0.33645%0.445SS..Hα-helixtrans-44.4-45-173.4-65.10000113.5A7 S8 S9S5-A7 PolarHBondContact O-N 3.33Å; S5-S8 WeakPolarHBondContact O-CB 3.47Å; S5-S8 PolarHBondContact O-N 2.78Å; S5-S9 PolarHBondContact O-N 3.15Å; S5-S9 PolarHBondContact O-OG 2.74Å; S5-S9 VanDerWaalsContact O-OG 3.05Å
6G70.8Confident78.4Confident38 Ų3877.1 Ų77.139%0.39242%0.42SS..Hα-helixtrans-64.2-36.2177.100000115.2K4 S9 F10K4-G6 PolarHBondContact O-N 3.31Å; G6-S9 WeakPolarHBondContact O-CB 3.48Å; G6-S9 PolarHBondContact O-N 3.46Å; G6-F10 PolarHBondContact O-N 3.3Å; G6-F10 VanDerWaalsContact O-N 3.08Å
7A79.4Confident79.4Confident42 Ų4278 Ų7835%0.34742%0.423SS..Hα-helixtrans-69.4-38.1174.500000111.2L3 K4 S5 S9 F10 M11L3-A7 HydrophobicContact CB-CB 4.17Å; L3-A7 HydrophobicContact CD2-CB 4.19Å; K4-A7 WeakPolarHBondContact O-CA 3.4Å; K4-A7 WeakPolarHBondContact O-CB 3.49Å; K4-A7 PolarHBondContact O-N 3.1Å; S5-A7 PolarHBondContact O-N 3.33Å; A7-S9 VanDerWaalsContact C-N 3.34Å; A7-F10 PolarHBondContact O-N 3.33Å; A7-M11 VanDerWaalsContact O-CG 3.28Å; A7-M11 WeakPolarHBondContact O-CG 3.27Å; A7-M11 PolarHBondContact O-N 3.12Å
8S83.1Confident80.4Confident30 Ų3079 Ų7921%0.2143%0.432CS..Hα-helixtrans-62.6-39.9173.1-56.80000111.9L3 K4 S5 S12L3-S8 VanDerWaalsContact CB-OG 3.24Å; L3-S8 WeakPolarHBondContact CB-OG 3.37Å; L3-S8 PolarHBondContact O-OG 3.4Å; K4-S8 PolarHBondContact O-N 3.21Å; K4-S8 VanDerWaalsContact O-N 3.09Å; S5-S8 WeakPolarHBondContact O-CB 3.47Å; S5-S8 PolarHBondContact O-N 2.78Å; S8-S12 WeakPolarHBondContact O-CB 3.47Å; S8-S12 PolarHBondContact O-N 3.35Å; S8-S12 PolarHBondContact O-OG 3.48Å
9S83.9Confident81.2Confident6 Ų676.4 Ų76.44%0.04242%0.419CS..Hα-helixtrans-58.4-53173-52.20000110.9S5 G6 A7 M11 S12 L13 F54 N57S5-S9 PolarHBondContact O-N 3.15Å; S5-S9 PolarHBondContact O-OG 2.74Å; S5-S9 VanDerWaalsContact O-OG 3.05Å; G6-S9 WeakPolarHBondContact O-CB 3.48Å; G6-S9 PolarHBondContact O-N 3.46Å; A7-S9 VanDerWaalsContact C-N 3.34Å; S9-M11 VanDerWaalsContact C-N 3.33Å; S9-M11 PolarHBondContact O-N 3Å; S9-S12 PolarHBondContact O-N 3.32Å; S9-S12 VanDerWaalsContact O-N 3.16Å; S9-L13 PolarHBondContact O-N 3.44Å; S9-F54 WeakPolarHBondContact O-CD2 3.16Å; S9-N57 WeakPolarHBondContact OG-CB 3.32Å
10F89.3Confident81.8Confident119 Ų11974.9 Ų74.952%0.52241%0.408SS..Hα-helixtrans-62.6-40.9-176.6-171.9-108.8000112.4G6 A7 S12 L13 L14G6-F10 PolarHBondContact O-N 3.3Å; G6-F10 VanDerWaalsContact O-N 3.08Å; A7-F10 PolarHBondContact O-N 3.33Å; F10-S12 PolarHBondContact O-N 3.11Å; F10-L13 PolarHBondContact O-N 3Å; F10-L14 HydrophobicContact CD1-CD1 3.78Å; F10-L14 HydrophobicContact CD1-CG 4.22Å; F10-L14 HydrophobicContact CE1-CD1 3.38Å; F10-L14 HydrophobicContact CE1-CD2 4.39Å; F10-L14 HydrophobicContact CE1-CG 3.9Å; F10-L14 HydrophobicContact CZ-CD1 3.99Å; F10-L14 HydrophobicContact CZ-CD2 4.16Å; F10-L14 HydrophobicContact CZ-CG 4.08Å; F10-L14 WeakPolarHBondContact O-CG 3.36Å; F10-L14 PolarHBondContact O-N 2.7Å
11M89.9Confident82.5Confident93 Ų9373.6 Ų73.646%0.45841%0.407SS..Hα-helixtrans-64.2-40.4175.5-69.5-61.817900112.1L3 A7 S9 L13 L14 L15L3-M11 HydrophobicContact CD1-CG 4.17Å; A7-M11 VanDerWaalsContact O-CG 3.28Å; A7-M11 WeakPolarHBondContact O-CG 3.27Å; A7-M11 PolarHBondContact O-N 3.12Å; S9-M11 VanDerWaalsContact C-N 3.33Å; S9-M11 PolarHBondContact O-N 3Å; M11-L13 VanDerWaalsContact C-N 3.33Å; M11-L13 PolarHBondContact O-N 3.29Å; M11-L14 PolarHBondContact O-N 3.27Å; M11-L14 HydrophobicContact SD-CD1 4.43Å; M11-L15 WeakPolarHBondContact O-CB 3.35Å; M11-L15 WeakPolarHBondContact O-CG 3.26Å; M11-L15 PolarHBondContact O-N 3.08Å
12S92.5Very high85.1Confident14 Ų1465.1 Ų65.110%0.09837%0.372CS..Hα-helixtrans-63.5-41176.2-55.60000111.3S8 S9 F10 L15 L16 T53S8-S12 WeakPolarHBondContact O-CB 3.47Å; S8-S12 PolarHBondContact O-N 3.35Å; S8-S12 PolarHBondContact O-OG 3.48Å; S9-S12 PolarHBondContact O-N 3.32Å; S9-S12 VanDerWaalsContact O-N 3.16Å; F10-S12 PolarHBondContact O-N 3.11Å; S12-L15 PolarHBondContact O-N 3.18Å; S12-L16 VanDerWaalsContact O-CB 3.3Å; S12-L16 WeakPolarHBondContact O-CB 3.43Å; S12-L16 PolarHBondContact O-N 3.36Å; S12-T53 WeakPolarHBondContact OG-CG2 3.37Å
13L93.2Very high86.8Confident54 Ų5458.4 Ų58.428%0.28333%0.331SS..Hα-helixtrans-64.6-45.2175.8-176.865.3000112S9 F10 M11 L16 L17 F54S9-L13 PolarHBondContact O-N 3.44Å; F10-L13 PolarHBondContact O-N 3Å; M11-L13 VanDerWaalsContact C-N 3.33Å; M11-L13 PolarHBondContact O-N 3.29Å; L13-L16 WeakPolarHBondContact O-CB 3.26Å; L13-L16 PolarHBondContact O-N 3.3Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.05Å; L13-F54 HydrophobicContact CB-CD2 3.89Å; L13-F54 HydrophobicContact CB-CE2 4.15Å; L13-F54 HydrophobicContact CB-CG 4.42Å; L13-F54 HydrophobicContact CD2-CE2 4.13Å; L13-F54 HydrophobicContact CD2-CZ 4.36Å
14L94.9Very high88.5Confident73 Ų7359.2 Ų59.238%0.38233%0.329SS..Hα-helixtrans-61-46.7176.7-76.3179.5000111.7F10 M11 L16 L17 V18F10-L14 HydrophobicContact CD1-CD1 3.78Å; F10-L14 HydrophobicContact CD1-CG 4.22Å; F10-L14 HydrophobicContact CE1-CD1 3.38Å; F10-L14 HydrophobicContact CE1-CD2 4.39Å; F10-L14 HydrophobicContact CE1-CG 3.9Å; F10-L14 HydrophobicContact CZ-CD1 3.99Å; F10-L14 HydrophobicContact CZ-CD2 4.16Å; F10-L14 HydrophobicContact CZ-CG 4.08Å; F10-L14 WeakPolarHBondContact O-CG 3.36Å; F10-L14 PolarHBondContact O-N 2.7Å; M11-L14 PolarHBondContact O-N 3.27Å; M11-L14 HydrophobicContact SD-CD1 4.43Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 3.47Å; L14-L17 PolarHBondContact O-N 3.08Å; L14-V18 WeakPolarHBondContact O-CG2 3.44Å; L14-V18 PolarHBondContact O-N 3.32Å
15L94.7Very high89.9Confident99 Ų9957.5 Ų57.552%0.51833%0.328SS..Hα-helixtrans-62.1-40.4176.8-72.9174.7000111.5M11 S12 L17 V18 V19 L50M11-L15 WeakPolarHBondContact O-CB 3.35Å; M11-L15 WeakPolarHBondContact O-CG 3.26Å; M11-L15 PolarHBondContact O-N 3.08Å; S12-L15 PolarHBondContact O-N 3.18Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.01Å; L15-V18 PolarHBondContact O-N 3.19Å; L15-V19 VanDerWaalsContact O-CG2 3.31Å; L15-V19 WeakPolarHBondContact O-CG2 3.12Å; L15-V19 PolarHBondContact O-N 3.15Å; L15-L50 HydrophobicContact CB-CD1 3.98Å; L15-L50 HydrophobicContact CB-CD2 4.11Å; L15-L50 HydrophobicContact CD1-CD2 4.37Å
16L95.6Very high91.1Very high8 Ų861 Ų614%0.04234%0.337CS..Hα-helixtrans-57.2-48.2175178.6155.3000110.8S12 L13 L14 V18 V19 F20 I47 L50 L51S12-L16 VanDerWaalsContact O-CB 3.3Å; S12-L16 WeakPolarHBondContact O-CB 3.43Å; S12-L16 PolarHBondContact O-N 3.36Å; L13-L16 WeakPolarHBondContact O-CB 3.26Å; L13-L16 PolarHBondContact O-N 3.3Å; L14-L16 VanDerWaalsContact C-N 3.31Å; L14-L16 PolarHBondContact O-N 3.47Å; L16-V18 VanDerWaalsContact C-N 3.35Å; L16-V18 PolarHBondContact O-N 3.43Å; L16-V19 PolarHBondContact O-N 3.41Å; L16-F20 WeakPolarHBondContact O-CB 3.18Å; L16-F20 PolarHBondContact O-N 2.79Å; L16-I47 HydrophobicContact CD1-CG2 4.14Å; L16-I47 HydrophobicContact CG-CG2 4.11Å; L16-L50 HydrophobicContact CB-CB 4.01Å; L16-L50 HydrophobicContact CB-CD1 4.44Å; L16-L50 HydrophobicContact CD1-CB 4.49Å; L16-L51 HydrophobicContact CD1-CB 3.63Å; L16-L51 HydrophobicContact CD1-CD1 3.82Å; L16-L51 HydrophobicContact CD1-CG 4.28Å
17L95.4Very high92.1Very high92 Ų9260.1 Ų60.148%0.48233%0.327SS..Hα-helixtrans-64.2-39.6179.3-68.8176.8000111.9L13 L14 L15 F20 A21L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 3.05Å; L14-L17 PolarHBondContact O-N 3.08Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.01Å; L17-F20 PolarHBondContact O-N 3.26Å; L17-A21 WeakPolarHBondContact O-CB 3.17Å; L17-A21 PolarHBondContact O-N 3.36Å
18V96.5Very high92.6Very high96 Ų9666 Ų6658%0.58235%0.347SS*.Hα-helixtrans-64-46.1176.51710000111.1L14 L15 L16 A21 A22L14-V18 WeakPolarHBondContact O-CG2 3.44Å; L14-V18 PolarHBondContact O-N 3.32Å; L15-V18 PolarHBondContact O-N 3.19Å; L16-V18 VanDerWaalsContact C-N 3.35Å; L16-V18 PolarHBondContact O-N 3.43Å; V18-A21 PolarHBondContact O-N 2.79Å; V18-A22 WeakPolarHBondContact O-CB 3.26Å; V18-A22 PolarHBondContact O-N 3.04Å
19V95.3Very high93Very high30 Ų3068.4 Ų68.418%0.18236%0.36CS..Hα-helixtrans-63.3-44.3177.4174.60000110.4L15 L16 A22 M23 I47 L50L15-V19 VanDerWaalsContact O-CG2 3.31Å; L15-V19 WeakPolarHBondContact O-CG2 3.12Å; L15-V19 PolarHBondContact O-N 3.15Å; L16-V19 PolarHBondContact O-N 3.41Å; V19-A22 PolarHBondContact O-N 3.28Å; V19-M23 HydrophobicContact CG1-SD 4.25Å; V19-M23 WeakPolarHBondContact O-CB 3.46Å; V19-M23 WeakPolarHBondContact O-CG 3.43Å; V19-M23 PolarHBondContact O-N 3.3Å; V19-I47 HydrophobicContact CB-CG1 4.34Å; V19-I47 HydrophobicContact CG1-CD1 4.33Å; V19-I47 HydrophobicContact CG1-CG1 3.8Å; V19-L50 HydrophobicContact CG2-CD1 4.16Å
20F94.6Very high93Very high46 Ų4669.1 Ų69.120%0.20236%0.363CS..Hα-helixtrans-63.5-42.8177.1-179.2-110.7000112.4L16 L17 M23 R24 I47 F85L16-F20 WeakPolarHBondContact O-CB 3.18Å; L16-F20 PolarHBondContact O-N 2.79Å; L17-F20 PolarHBondContact O-N 3.26Å; F20-M23 WeakPolarHBondContact O-CB 3.42Å; F20-M23 PolarHBondContact O-N 3.45Å; F20-R24 HydrophobicContact CD1-CG 4.44Å; F20-R24 HydrophobicContact CE1-CG 4Å; F20-R24 HydrophobicContact CE2-CG 4.37Å; F20-R24 HydrophobicContact CZ-CG 3.96Å; F20-R24 WeakPolarHBondContact O-CG 3.07Å; F20-R24 PolarHBondContact O-N 3.12Å; F20-I47 HydrophobicContact CB-CD1 3.97Å; F20-I47 HydrophobicContact CD2-CD1 4.01Å; F20-I47 HydrophobicContact CG-CD1 4.49Å; F20-F85 HydrophobicContact CD2-CB 3.9Å; F20-F85 HydrophobicContact CD2-CD1 4.07Å; F20-F85 HydrophobicContact CD2-CG 4.03Å; F20-F85 HydrophobicContact CE1-CD1 4.39Å; F20-F85 HydrophobicContact CE2-CB 3.69Å; F20-F85 AromaticContact CE2-CD1 3.48Å; F20-F85 HydrophobicContact CE2-CD1 3.48Å; F20-F85 VanDerWaalsContact CE2-CD1 3.48Å; F20-F85 HydrophobicContact CE2-CE1 4.34Å; F20-F85 AromaticContact CE2-CG 3.81Å; F20-F85 HydrophobicContact CE2-CG 3.81Å; F20-F85 AromaticContact CZ-CD1 3.66Å; F20-F85 HydrophobicContact CZ-CD1 3.66Å; F20-F85 HydrophobicContact CZ-CE1 4.17Å; F20-F85 HydrophobicContact CZ-CG 4.43Å
21A95.9Very high93Very high47 Ų4766 Ų6639%0.38836%0.356SS..Hα-helixtrans-63-44.3176.100000111.4L17 V18 M23 R24 L25L17-A21 WeakPolarHBondContact O-CB 3.17Å; L17-A21 PolarHBondContact O-N 3.36Å; V18-A21 PolarHBondContact O-N 2.79Å; A21-M23 VanDerWaalsContact C-N 3.33Å; A21-M23 PolarHBondContact O-N 3.36Å; A21-R24 WeakPolarHBondContact O-CB 3.25Å; A21-R24 PolarHBondContact O-N 3.27Å; A21-R24 VanDerWaalsContact O-N 3.15Å; A21-L25 WeakPolarHBondContact O-CG 3.3Å; A21-L25 PolarHBondContact O-N 2.97Å
22A94.7Very high93.1Very high39 Ų3966.3 Ų66.332%0.32237%0.368SS..Hα-helixtrans-59.6-45.2174.300000111.3V18 V19 R24 L25 F26V18-A22 WeakPolarHBondContact O-CB 3.26Å; V18-A22 PolarHBondContact O-N 3.04Å; V19-A22 PolarHBondContact O-N 3.28Å; A22-R24 VanDerWaalsContact C-N 3.28Å; A22-R24 PolarHBondContact O-N 3.49Å; A22-L25 PolarHBondContact O-N 3.34Å; A22-F26 WeakPolarHBondContact O-CD2 3.48Å; A22-F26 PolarHBondContact O-N 3.31Å
23M92.5Very high93Very high5 Ų568.1 Ų68.13%0.02538%0.381CS..Hα-helixtrans-58.1-36.7174.5-89.2179.575.800113.3V19 F20 A21 A27 G40 F43 I47 I89V19-M23 HydrophobicContact CG1-SD 4.25Å; V19-M23 WeakPolarHBondContact O-CB 3.46Å; V19-M23 WeakPolarHBondContact O-CG 3.43Å; V19-M23 PolarHBondContact O-N 3.3Å; F20-M23 WeakPolarHBondContact O-CB 3.42Å; F20-M23 PolarHBondContact O-N 3.45Å; A21-M23 VanDerWaalsContact C-N 3.33Å; A21-M23 PolarHBondContact O-N 3.36Å; M23-A27 WeakPolarHBondContact O-CA 3.47Å; M23-A27 PolarHBondContact O-N 3.47Å; M23-G40 WeakPolarHBondContact CE-O 3.46Å; M23-F43 HydrophobicContact CE-CB 4.45Å; M23-F43 HydrophobicContact CG-CB 3.9Å; M23-F43 HydrophobicContact SD-CB 3.56Å; M23-F43 VanDerWaalsContact SD-CB 3.56Å; M23-I47 HydrophobicContact CE-CD1 4.29Å; M23-I47 HydrophobicContact SD-CD1 3.5Å; M23-I47 VanDerWaalsContact SD-CD1 3.5Å; M23-I47 HydrophobicContact SD-CG1 4.31Å; M23-I89 HydrophobicContact CB-CD1 3.86Å; M23-I89 HydrophobicContact CE-CD1 3.33Å; M23-I89 HydrophobicContact CE-CG1 4.24Å; M23-I89 HydrophobicContact CG-CD1 4.06Å
24R93.3Very high92.9Very high83 Ų8373.1 Ų73.131%0.31340%0.403SS..Hα-helixtrans-69.2-47.5173.3-74.9-6192.8176.517.4112.3F20 A21 A22 F26 A27 F85 T88 I89F20-R24 HydrophobicContact CD1-CG 4.44Å; F20-R24 HydrophobicContact CE1-CG 4Å; F20-R24 HydrophobicContact CE2-CG 4.37Å; F20-R24 HydrophobicContact CZ-CG 3.96Å; F20-R24 WeakPolarHBondContact O-CG 3.07Å; F20-R24 PolarHBondContact O-N 3.12Å; A21-R24 WeakPolarHBondContact O-CB 3.25Å; A21-R24 PolarHBondContact O-N 3.27Å; A21-R24 VanDerWaalsContact O-N 3.15Å; A22-R24 VanDerWaalsContact C-N 3.28Å; A22-R24 PolarHBondContact O-N 3.49Å; R24-F26 VanDerWaalsContact C-N 3.27Å; R24-F26 PolarHBondContact O-N 2.83Å; R24-A27 WeakPolarHBondContact O-CB 3.26Å; R24-A27 PolarHBondContact O-N 3.48Å; R24-A27 VanDerWaalsContact O-N 3.14Å; R24-F85 PolarHBondContact NH2-O 3.02Å; R24-T88 VanDerWaalsContact NH1-C 3.28Å; R24-T88 PolarHBondContact NH1-O 3.16Å; R24-T88 PolarHBondContact NH1-OG1 3.24Å; R24-T88 PolarHBondContact NH2-O 3.4Å; R24-T88 PolarHBondContact NH2-OG1 2.9Å; R24-I89 VanDerWaalsContact NH2-CA 3.35Å
25L94.9Very high92.8Very high146 Ų14674.2 Ų74.276%0.76441%0.408SS*.Hα-helixtrans-62.2-37.2-178-70174.3000111.9A21 A22A21-L25 WeakPolarHBondContact O-CG 3.3Å; A21-L25 PolarHBondContact O-N 2.97Å; A22-L25 PolarHBondContact O-N 3.34Å
26F92.4Very high92.8Very high121 Ų12172.1 Ų72.153%0.53140%0.397SS..THydrogen-bonded Turntrans-97.416.8178.1-61-67.5000113.1A22 R24 E28 T29 L30A22-F26 WeakPolarHBondContact O-CD2 3.48Å; A22-F26 PolarHBondContact O-N 3.31Å; R24-F26 VanDerWaalsContact C-N 3.27Å; R24-F26 PolarHBondContact O-N 2.83Å; F26-E28 VanDerWaalsContact C-N 3.35Å; F26-E28 PolarHBondContact O-N 2.9Å; F26-T29 PolarHBondContact O-N 3.19Å; F26-L30 HydrophobicContact CB-CD1 3.73Å; F26-L30 WeakPolarHBondContact O-CB 3.47Å; F26-L30 VanDerWaalsContact O-CD1 3.26Å; F26-L30 WeakPolarHBondContact O-CD1 3.5Å; F26-L30 PolarHBondContact O-N 3.11Å
27A91.1Very high92.6Very high20 Ų2072 Ų7217%0.16540%0.397CS..Hα-helixtrans-58.2-44.9-173.700000112.8M23 R24 L30 S31 I89M23-A27 WeakPolarHBondContact O-CA 3.47Å; M23-A27 PolarHBondContact O-N 3.47Å; R24-A27 WeakPolarHBondContact O-CB 3.26Å; R24-A27 PolarHBondContact O-N 3.48Å; R24-A27 VanDerWaalsContact O-N 3.14Å; A27-L30 PolarHBondContact O-N 3.11Å; A27-S31 WeakPolarHBondContact O-CB 3.1Å; A27-S31 PolarHBondContact O-N 3.4Å; A27-S31 PolarHBondContact O-OG 2.84Å; A27-I89 HydrophobicContact CB-CG2 4.02Å
28E90.8Very high92.6Very high166 Ų16670.7 Ų70.778%0.77639%0.389SS*.Hα-helixtrans-61.9-46.6177.9-63.8-172.6170.600111F26 L30 S31 S32F26-E28 VanDerWaalsContact C-N 3.35Å; F26-E28 PolarHBondContact O-N 2.9Å; E28-L30 PolarHBondContact O-N 2.86Å; E28-S31 PolarHBondContact O-N 3.11Å; E28-S31 VanDerWaalsContact O-N 3.15Å; E28-S31 PolarHBondContact O-OG 3.4Å; E28-S32 PolarHBondContact O-N 3.27Å; E28-S32 VanDerWaalsContact O-N 3.1Å
29T91.7Very high92.5Very high80 Ų8071.3 Ų71.349%0.49138%0.384SS..Hα-helixtrans-60.3-44.6176.2-51.40000111.6F26 S31 S32 L36F26-T29 PolarHBondContact O-N 3.19Å; T29-S31 PolarHBondContact O-N 3.43Å; T29-S32 WeakPolarHBondContact O-CB 3.5Å; T29-S32 PolarHBondContact O-N 3.46Å; T29-L36 HydrophobicContact CG2-CD1 4.38Å; T29-L36 WeakPolarHBondContact O-CD1 3.43Å
30L84.7Confident92.4Very high20 Ų2069.9 Ų69.911%0.10538%0.375CS..Hα-helixtrans-63.2-31.6178.2-95.165.6000112.2F26 A27 E28 L36 T37 I89F26-L30 HydrophobicContact CB-CD1 3.73Å; F26-L30 WeakPolarHBondContact O-CB 3.47Å; F26-L30 VanDerWaalsContact O-CD1 3.26Å; F26-L30 WeakPolarHBondContact O-CD1 3.5Å; F26-L30 PolarHBondContact O-N 3.11Å; A27-L30 PolarHBondContact O-N 3.11Å; E28-L30 PolarHBondContact O-N 2.86Å; L30-L36 CarbonylContact O-C 3.51Å; L30-L36 WeakPolarHBondContact O-CB 3.37Å; L30-T37 VanDerWaalsContact O-CG2 3.27Å; L30-T37 WeakPolarHBondContact O-CG2 3.34Å; L30-T37 PolarHBondContact O-N 3.33Å; L30-T37 VanDerWaalsContact O-N 3.08Å; L30-I89 HydrophobicContact CB-CG2 4.17Å; L30-I89 HydrophobicContact CD2-CD1 3.72Å
31S87.8Confident92.4Very high53 Ų5367.7 Ų67.737%0.37137%0.366SS..Hα-helixtrans-84-12.817972.60000114.6A27 E28 T29 S33A27-S31 WeakPolarHBondContact O-CB 3.1Å; A27-S31 PolarHBondContact O-N 3.4Å; A27-S31 PolarHBondContact O-OG 2.84Å; E28-S31 PolarHBondContact O-N 3.11Å; E28-S31 VanDerWaalsContact O-N 3.15Å; E28-S31 PolarHBondContact O-OG 3.4Å; T29-S31 PolarHBondContact O-N 3.43Å; S31-S33 VanDerWaalsContact C-N 3.34Å; S31-S33 PolarHBondContact O-N 2.91Å
32S91.8Very high92.4Very high100 Ų10069.2 Ų69.270%0.69936%0.364SS*.Hα-helixtrans-68.9-29.1-173179.90000113.8E28 T29E28-S32 PolarHBondContact O-N 3.27Å; E28-S32 VanDerWaalsContact O-N 3.1Å; T29-S32 WeakPolarHBondContact O-CB 3.5Å; T29-S32 PolarHBondContact O-N 3.46Å
33S91.1Very high92.4Very high53 Ų5371.4 Ų71.437%0.37137%0.366SS..SBendtrans-139148.1-178.2179.20000112.1S31 I35 L36 T37S31-S33 VanDerWaalsContact C-N 3.34Å; S31-S33 PolarHBondContact O-N 2.91Å; S33-I35 VanDerWaalsContact C-N 3.26Å; S33-I35 PolarHBondContact O-N 3.49Å; S33-L36 PolarHBondContact O-N 3.24Å; S33-T37 PolarHBondContact O-N 2.99Å
34Q90.7Very high92.6Very high159 Ų15971.2 Ų71.274%0.74337%0.365SS*.Hα-helixtrans-55.3-41.9178.6-173.8176.8-8.600111.8L36 T37 I38Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.08Å; Q34-T37 PolarHBondContact O-N 3.4Å; Q34-T37 PolarHBondContact O-OG1 2.89Å; Q34-I38 PolarHBondContact O-N 2.91Å
35I93.7Very high92.8Very high95 Ų9567.2 Ų67.249%0.48735%0.35SS..Hα-helixtrans-65.4-37.1178.4-165.763.3000111.9S33 T37 I38 F39S33-I35 VanDerWaalsContact C-N 3.26Å; S33-I35 PolarHBondContact O-N 3.49Å; I35-T37 VanDerWaalsContact C-N 3.32Å; I35-T37 PolarHBondContact O-N 3.34Å; I35-I38 HydrophobicContact CD1-CD1 4.29Å; I35-I38 WeakPolarHBondContact O-CB 3.36Å; I35-I38 PolarHBondContact O-N 3.17Å; I35-F39 HydrophobicContact CG1-CD2 4.28Å; I35-F39 HydrophobicContact CG1-CE2 3.92Å; I35-F39 VanDerWaalsContact O-CD2 3.26Å; I35-F39 WeakPolarHBondContact O-CD2 3.48Å; I35-F39 PolarHBondContact O-N 3.35Å; I35-F39 VanDerWaalsContact O-N 3.15Å
36L93.5Very high92.8Very high56 Ų5662.8 Ų62.829%0.29333%0.327SS..Hα-helixtrans-70.6-30.7179.7-63.2177.7000111.7T29 L30 S33 Q34 I38 F39 G40T29-L36 HydrophobicContact CG2-CD1 4.38Å; T29-L36 WeakPolarHBondContact O-CD1 3.43Å; L30-L36 CarbonylContact O-C 3.51Å; L30-L36 WeakPolarHBondContact O-CB 3.37Å; S33-L36 PolarHBondContact O-N 3.24Å; Q34-L36 VanDerWaalsContact C-N 3.32Å; Q34-L36 PolarHBondContact O-N 3.08Å; L36-I38 VanDerWaalsContact C-N 3.3Å; L36-I38 PolarHBondContact O-N 2.78Å; L36-F39 HydrophobicContact CD2-CD2 4.42Å; L36-F39 WeakPolarHBondContact O-CB 3.14Å; L36-F39 PolarHBondContact O-N 3.42Å; L36-G40 PolarHBondContact O-N 2.69Å
37T92.8Very high93Very high6 Ų657 Ų574%0.03730%0.302CS..Hα-helixtrans-68.2-30172.466.20000112.8L30 S33 Q34 I35 G40 G41 C93 T96L30-T37 VanDerWaalsContact O-CG2 3.27Å; L30-T37 WeakPolarHBondContact O-CG2 3.34Å; L30-T37 PolarHBondContact O-N 3.33Å; L30-T37 VanDerWaalsContact O-N 3.08Å; S33-T37 PolarHBondContact O-N 2.99Å; Q34-T37 PolarHBondContact O-N 3.4Å; Q34-T37 PolarHBondContact O-OG1 2.89Å; I35-T37 VanDerWaalsContact C-N 3.32Å; I35-T37 PolarHBondContact O-N 3.34Å; T37-G40 PolarHBondContact O-N 3.02Å; T37-G41 PolarHBondContact O-N 3.08Å; T37-G41 VanDerWaalsContact O-N 3.08Å; T37-C93 PolarHBondContact O-SG 2.98Å; T37-T96 PolarHBondContact O-OG1 2.67Å
38I94.6Very high93.3Very high63 Ų6356 Ų5632%0.32329%0.294SS..Hα-helixtrans-68.1-44.6172.6-62.9167.2000109.6Q34 I35 L36 G40 G41 F42 T96 F100Q34-I38 PolarHBondContact O-N 2.91Å; I35-I38 HydrophobicContact CD1-CD1 4.29Å; I35-I38 WeakPolarHBondContact O-CB 3.36Å; I35-I38 PolarHBondContact O-N 3.17Å; L36-I38 VanDerWaalsContact C-N 3.3Å; L36-I38 PolarHBondContact O-N 2.78Å; I38-G40 VanDerWaalsContact C-N 3.28Å; I38-G40 PolarHBondContact O-N 2.71Å; I38-G41 WeakPolarHBondContact O-CA 3.19Å; I38-G41 PolarHBondContact O-N 3.45Å; I38-G41 VanDerWaalsContact O-N 3.11Å; I38-F42 PolarHBondContact O-N 2.93Å; I38-T96 HydrophobicContact CG1-CG2 4.34Å; I38-F100 HydrophobicContact CG2-CE2 3.85Å; I38-F100 HydrophobicContact CG2-CZ 3.91Å
39F94Very high93.5Very high109 Ų10949.7 Ų49.748%0.47827%0.266SS..Hα-helixtrans-60.1-38.4172.4-77.9-68.4000112.2I35 L36 G41 F42 F43I35-F39 HydrophobicContact CG1-CD2 4.28Å; I35-F39 HydrophobicContact CG1-CE2 3.92Å; I35-F39 VanDerWaalsContact O-CD2 3.26Å; I35-F39 WeakPolarHBondContact O-CD2 3.48Å; I35-F39 PolarHBondContact O-N 3.35Å; I35-F39 VanDerWaalsContact O-N 3.15Å; L36-F39 HydrophobicContact CD2-CD2 4.42Å; L36-F39 WeakPolarHBondContact O-CB 3.14Å; L36-F39 PolarHBondContact O-N 3.42Å; F39-G41 VanDerWaalsContact C-N 3.3Å; F39-G41 PolarHBondContact O-N 3.45Å; F39-F42 WeakPolarHBondContact O-CA 3.4Å; F39-F42 WeakPolarHBondContact O-CB 3.29Å; F39-F42 PolarHBondContact O-N 2.95Å; F39-F42 VanDerWaalsContact O-N 3.08Å; F39-F43 WeakPolarHBondContact O-CD2 3.43Å; F39-F43 PolarHBondContact O-N 3.27Å
40G93.8Very high93.7Very high0 Ų047.4 Ų47.40%025%0.251CS..Hα-helixtrans-57.6-42.2172.400000112.9M23 L36 T37 I38 F43 G44M23-G40 WeakPolarHBondContact CE-O 3.46Å; L36-G40 PolarHBondContact O-N 2.69Å; T37-G40 PolarHBondContact O-N 3.02Å; I38-G40 VanDerWaalsContact C-N 3.28Å; I38-G40 PolarHBondContact O-N 2.71Å; G40-F43 PolarHBondContact O-N 3.35Å; G40-G44 PolarHBondContact O-N 2.98Å
41G95Very high94.2Very high0 Ų047.3 Ų47.30%025%0.25CS..Hα-helixtrans-62.1-41.2171.100000113.6T37 I38 F39 G44 S45 T96 C97T37-G41 PolarHBondContact O-N 3.08Å; T37-G41 VanDerWaalsContact O-N 3.08Å; I38-G41 WeakPolarHBondContact O-CA 3.19Å; I38-G41 PolarHBondContact O-N 3.45Å; I38-G41 VanDerWaalsContact O-N 3.11Å; F39-G41 VanDerWaalsContact C-N 3.3Å; F39-G41 PolarHBondContact O-N 3.45Å; G41-G44 CarbonylContact O-C 3.57Å; G41-G44 WeakPolarHBondContact O-CA 3.48Å; G41-G44 PolarHBondContact O-N 3.17Å; G41-S45 PolarHBondContact O-N 2.73Å; G41-T96 VanDerWaalsContact CA-OG1 3.26Å; G41-T96 WeakPolarHBondContact CA-OG1 3.45Å; G41-C97 WeakPolarHBondContact O-CA 3.21Å
42F95.6Very high94.5Very high80 Ų8045.3 Ų45.335%0.35124%0.235SC..Hα-helixtrans-60.5-47.3175.2174.2-101.4000111.7I38 F39 G44 S45 L46 F100 M104I38-F42 PolarHBondContact O-N 2.93Å; F39-F42 WeakPolarHBondContact O-CA 3.4Å; F39-F42 WeakPolarHBondContact O-CB 3.29Å; F39-F42 PolarHBondContact O-N 2.95Å; F39-F42 VanDerWaalsContact O-N 3.08Å; F42-G44 VanDerWaalsContact C-N 3.3Å; F42-G44 PolarHBondContact O-N 3.44Å; F42-S45 WeakPolarHBondContact O-CB 3.34Å; F42-S45 PolarHBondContact O-N 3.3Å; F42-S45 PolarHBondContact O-OG 3.37Å; F42-L46 HydrophobicContact CE1-CD1 4.16Å; F42-L46 PolarHBondContact O-N 2.99Å; F42-F100 HydrophobicContact CB-CD2 4.29Å; F42-F100 HydrophobicContact CB-CE2 4.24Å; F42-M104 HydrophobicContact CE2-CE 4.19Å
43F95.4Very high94.5Very high85 Ų8542.8 Ų42.837%0.37322%0.216SC..Hα-helixtrans-63.3-35.2173.5-72.6-71.7000112.5M23 F39 G40 S45 L46 I47M23-F43 HydrophobicContact CE-CB 4.45Å; M23-F43 HydrophobicContact CG-CB 3.9Å; M23-F43 HydrophobicContact SD-CB 3.56Å; M23-F43 VanDerWaalsContact SD-CB 3.56Å; F39-F43 WeakPolarHBondContact O-CD2 3.43Å; F39-F43 PolarHBondContact O-N 3.27Å; G40-F43 PolarHBondContact O-N 3.35Å; F43-S45 VanDerWaalsContact C-N 3.3Å; F43-S45 PolarHBondContact O-N 3.14Å; F43-L46 HydrophobicContact CD1-CD1 3.99Å; F43-L46 HydrophobicContact CE1-CD1 4.48Å; F43-L46 WeakPolarHBondContact O-CB 3.31Å; F43-L46 PolarHBondContact O-N 3.23Å; F43-L46 VanDerWaalsContact O-N 3.13Å; F43-I47 PolarHBondContact O-N 3.32Å; F43-I47 VanDerWaalsContact O-N 3.11Å
44G96.2Very high94.6Very high0 Ų042.5 Ų42.50%021%0.208CC..Hα-helixtrans-60.7-37170.600000113G40 G41 F42 L46 I47 F48G40-G44 PolarHBondContact O-N 2.98Å; G41-G44 CarbonylContact O-C 3.57Å; G41-G44 WeakPolarHBondContact O-CA 3.48Å; G41-G44 PolarHBondContact O-N 3.17Å; F42-G44 VanDerWaalsContact C-N 3.3Å; F42-G44 PolarHBondContact O-N 3.44Å; G44-L46 VanDerWaalsContact C-N 3.3Å; G44-L46 PolarHBondContact O-N 3.47Å; G44-I47 VanDerWaalsContact O-CB 3.31Å; G44-I47 WeakPolarHBondContact O-CB 3.46Å; G44-I47 PolarHBondContact O-N 3.41Å; G44-I47 VanDerWaalsContact O-N 3.16Å; G44-F48 PolarHBondContact O-N 2.95Å
45S96.9Very high94.6Very high0 Ų036.4 Ų36.40%018%0.182CC..Hα-helixtrans-68.2-29.7174.779.20000112.7G41 F42 F43 F48 V49G41-S45 PolarHBondContact O-N 2.73Å; F42-S45 WeakPolarHBondContact O-CB 3.34Å; F42-S45 PolarHBondContact O-N 3.3Å; F42-S45 PolarHBondContact O-OG 3.37Å; F43-S45 VanDerWaalsContact C-N 3.3Å; F43-S45 PolarHBondContact O-N 3.14Å; S45-F48 WeakPolarHBondContact O-CB 3.49Å; S45-F48 PolarHBondContact O-N 2.91Å; S45-V49 WeakPolarHBondContact O-CG2 3.36Å; S45-V49 PolarHBondContact O-N 3.2Å
46L95.7Very high94.3Very high52 Ų5234.1 Ų34.127%0.27217%0.17SC..Hα-helixtrans-66.8-38.7170.7-60.6179.1000111.2F42 F43 G44 F48 V49 L50 M104F42-L46 HydrophobicContact CE1-CD1 4.16Å; F42-L46 PolarHBondContact O-N 2.99Å; F43-L46 HydrophobicContact CD1-CD1 3.99Å; F43-L46 HydrophobicContact CE1-CD1 4.48Å; F43-L46 WeakPolarHBondContact O-CB 3.31Å; F43-L46 PolarHBondContact O-N 3.23Å; F43-L46 VanDerWaalsContact O-N 3.13Å; G44-L46 VanDerWaalsContact C-N 3.3Å; G44-L46 PolarHBondContact O-N 3.47Å; L46-F48 VanDerWaalsContact C-N 3.28Å; L46-F48 PolarHBondContact O-N 3Å; L46-V49 PolarHBondContact O-N 3.34Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.34Å; L46-L50 PolarHBondContact O-N 2.91Å; L46-M104 HydrophobicContact CD2-CE 4Å
47I96.4Very high94Very high0 Ų032.9 Ų32.90%016%0.164CC..Hα-helixtrans-57.6-44.1170.6-67.8175.4000110.1L16 V19 F20 M23 F43 G44 L50 L51 A82 F85L16-I47 HydrophobicContact CD1-CG2 4.14Å; L16-I47 HydrophobicContact CG-CG2 4.11Å; V19-I47 HydrophobicContact CB-CG1 4.34Å; V19-I47 HydrophobicContact CG1-CD1 4.33Å; V19-I47 HydrophobicContact CG1-CG1 3.8Å; F20-I47 HydrophobicContact CB-CD1 3.97Å; F20-I47 HydrophobicContact CD2-CD1 4.01Å; F20-I47 HydrophobicContact CG-CD1 4.49Å; M23-I47 HydrophobicContact CE-CD1 4.29Å; M23-I47 HydrophobicContact SD-CD1 3.5Å; M23-I47 VanDerWaalsContact SD-CD1 3.5Å; M23-I47 HydrophobicContact SD-CG1 4.31Å; F43-I47 PolarHBondContact O-N 3.32Å; F43-I47 VanDerWaalsContact O-N 3.11Å; G44-I47 VanDerWaalsContact O-CB 3.31Å; G44-I47 WeakPolarHBondContact O-CB 3.46Å; G44-I47 PolarHBondContact O-N 3.41Å; G44-I47 VanDerWaalsContact O-N 3.16Å; I47-L50 PolarHBondContact O-N 3.34Å; I47-L51 WeakPolarHBondContact O-CB 3.47Å; I47-L51 PolarHBondContact O-N 3.15Å; I47-A82 HydrophobicContact CG2-CB 4.28Å; I47-F85 HydrophobicContact CG2-CD2 4.23Å
48F96.7Very high93.7Very high0 Ų037.2 Ų37.20%018%0.182CC..Hα-helixtrans-57.8-49.1175.4164.3-104.3000112.4G44 S45 L46 L50 L51 I52 V75 C78 I79 A82 S101 L105G44-F48 PolarHBondContact O-N 2.95Å; S45-F48 WeakPolarHBondContact O-CB 3.49Å; S45-F48 PolarHBondContact O-N 2.91Å; L46-F48 VanDerWaalsContact C-N 3.28Å; L46-F48 PolarHBondContact O-N 3Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 2.84Å; F48-L51 PolarHBondContact O-N 2.85Å; F48-I52 HydrophobicContact CZ-CD1 4.24Å; F48-I52 WeakPolarHBondContact O-CG2 3.3Å; F48-I52 PolarHBondContact O-N 3.39Å; F48-V75 HydrophobicContact CE2-CG1 4.27Å; F48-V75 HydrophobicContact CZ-CG1 4.16Å; F48-C78 HydrophobicContact CD2-CB 4Å; F48-C78 HydrophobicContact CE2-CB 3.94Å; F48-I79 HydrophobicContact CD2-CG1 3.78Å; F48-I79 HydrophobicContact CE2-CD1 4.31Å; F48-I79 HydrophobicContact CE2-CG1 3.44Å; F48-I79 VanDerWaalsContact CE2-CG1 3.44Å; F48-I79 HydrophobicContact CZ-CG1 4.07Å; F48-A82 HydrophobicContact CB-CB 3.68Å; F48-S101 WeakPolarHBondContact CB-OG 3.46Å; F48-S101 WeakPolarHBondContact CG-OG 3.39Å; F48-L105 HydrophobicContact CE1-CB 4.12Å; F48-L105 HydrophobicContact CZ-CB 4.23Å; F48-L105 HydrophobicContact CZ-CD1 4.27Å
49V95.9Very high93.2Very high32 Ų3235.6 Ų35.619%0.19417%0.174CC..Hα-helixtrans-61.8-41.2179.2174.50000111.6S45 L46 I52 T53 M104 L108S45-V49 WeakPolarHBondContact O-CG2 3.36Å; S45-V49 PolarHBondContact O-N 3.2Å; L46-V49 PolarHBondContact O-N 3.34Å; V49-I52 VanDerWaalsContact O-CG2 3.27Å; V49-I52 WeakPolarHBondContact O-CG2 3.19Å; V49-T53 WeakPolarHBondContact O-CB 3.34Å; V49-T53 PolarHBondContact O-N 3.44Å; V49-T53 VanDerWaalsContact O-N 3.09Å; V49-T53 PolarHBondContact O-OG1 3.41Å; V49-M104 HydrophobicContact CG2-CB 3.89Å; V49-M104 HydrophobicContact CG2-CG 4.11Å; V49-M104 HydrophobicContact CG2-SD 4.47Å; V49-L108 HydrophobicContact CG1-CD1 4.46Å; V49-L108 HydrophobicContact CG2-CD1 4.25Å
50L95.8Very high92.6Very high33 Ų3334 Ų3417%0.17316%0.164CC..Hα-helixtrans-70.4-36.4177.7-66.6169.2000111.9L15 L16 V19 L46 I47 F48 T53 F54L15-L50 HydrophobicContact CB-CD1 3.98Å; L15-L50 HydrophobicContact CB-CD2 4.11Å; L15-L50 HydrophobicContact CD1-CD2 4.37Å; L16-L50 HydrophobicContact CB-CB 4.01Å; L16-L50 HydrophobicContact CB-CD1 4.44Å; L16-L50 HydrophobicContact CD1-CB 4.49Å; V19-L50 HydrophobicContact CG2-CD1 4.16Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.34Å; L46-L50 PolarHBondContact O-N 2.91Å; I47-L50 PolarHBondContact O-N 3.34Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 2.84Å; L50-T53 PolarHBondContact O-N 3.04Å; L50-F54 WeakPolarHBondContact O-CB 3.45Å; L50-F54 PolarHBondContact O-N 3.19Å
51L95.4Very high92Very high18 Ų1837.8 Ų37.89%0.09419%0.188CC..Hα-helixtrans-67.6-48.6178.9-175.661.1000111.2L16 I47 F48 T53 F54 V55 C78 I81L16-L51 HydrophobicContact CD1-CB 3.63Å; L16-L51 HydrophobicContact CD1-CD1 3.82Å; L16-L51 HydrophobicContact CD1-CG 4.28Å; I47-L51 WeakPolarHBondContact O-CB 3.47Å; I47-L51 PolarHBondContact O-N 3.15Å; F48-L51 PolarHBondContact O-N 2.85Å; L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 3.49Å; L51-F54 WeakPolarHBondContact O-CB 3.45Å; L51-F54 PolarHBondContact O-N 2.91Å; L51-F54 VanDerWaalsContact O-N 3.16Å; L51-V55 HydrophobicContact CD1-CG2 4.45Å; L51-V55 WeakPolarHBondContact O-CG2 3.43Å; L51-V55 PolarHBondContact O-N 3.18Å; L51-C78 HydrophobicContact CD2-CB 4.08Å; L51-C78 HydrophobicContact CG-CB 4.32Å; L51-I81 HydrophobicContact CD2-CB 3.75Å; L51-I81 HydrophobicContact CD2-CD1 4.37Å; L51-I81 HydrophobicContact CD2-CG2 3.58Å
52I93.1Very high91.3Very high11 Ų1142.8 Ų42.86%0.05621%0.214CC..Hα-helixtrans-64.2-35.4177-165.8173.4000111.2F48 V49 V55 N56 V75 L108F48-I52 HydrophobicContact CZ-CD1 4.24Å; F48-I52 WeakPolarHBondContact O-CG2 3.3Å; F48-I52 PolarHBondContact O-N 3.39Å; V49-I52 VanDerWaalsContact O-CG2 3.27Å; V49-I52 WeakPolarHBondContact O-CG2 3.19Å; I52-V55 PolarHBondContact O-N 2.63Å; I52-N56 VanDerWaalsContact O-CB 3.27Å; I52-N56 WeakPolarHBondContact O-CB 3.37Å; I52-N56 PolarHBondContact O-N 3.16Å; I52-N56 PolarHBondContact O-OD1 3.07Å; I52-V75 HydrophobicContact CD1-CG2 3.62Å; I52-L108 HydrophobicContact CG2-CD1 4.08Å
53T92Very high90.6Very high47 Ų4745.1 Ų45.129%0.28822%0.224SC..Hα-helixtrans-64.2-42.3174.1-57.60000111.3S12 V49 L50 L51 N57S12-T53 WeakPolarHBondContact OG-CG2 3.37Å; V49-T53 WeakPolarHBondContact O-CB 3.34Å; V49-T53 PolarHBondContact O-N 3.44Å; V49-T53 VanDerWaalsContact O-N 3.09Å; V49-T53 PolarHBondContact O-OG1 3.41Å; L50-T53 PolarHBondContact O-N 3.04Å; L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 3.49Å; T53-N57 VanDerWaalsContact O-CB 3.3Å; T53-N57 WeakPolarHBondContact O-CB 3.47Å; T53-N57 PolarHBondContact O-N 3.11Å; T53-N57 VanDerWaalsContact O-N 3.11Å; T53-N57 PolarHBondContact O-ND2 2.97Å
54F92.5Very high89.5Confident46 Ų4642.6 Ų42.620%0.20222%0.222CC..Hα-helixtrans-62.4-50.9174.8168.7-106.2000111.7S9 L13 L50 L51 N57 F58S9-F54 WeakPolarHBondContact O-CD2 3.16Å; L13-F54 HydrophobicContact CB-CD2 3.89Å; L13-F54 HydrophobicContact CB-CE2 4.15Å; L13-F54 HydrophobicContact CB-CG 4.42Å; L13-F54 HydrophobicContact CD2-CE2 4.13Å; L13-F54 HydrophobicContact CD2-CZ 4.36Å; L50-F54 WeakPolarHBondContact O-CB 3.45Å; L50-F54 PolarHBondContact O-N 3.19Å; L51-F54 WeakPolarHBondContact O-CB 3.45Å; L51-F54 PolarHBondContact O-N 2.91Å; L51-F54 VanDerWaalsContact O-N 3.16Å; F54-N57 PolarHBondContact O-N 3.13Å; F54-F58 HydrophobicContact CZ-CD2 4.44Å; F54-F58 HydrophobicContact CZ-CG 4.46Å; F54-F58 WeakPolarHBondContact O-CB 3.4Å; F54-F58 PolarHBondContact O-N 3.48Å
55V91.3Very high88.2Confident32 Ų3248.2 Ų48.219%0.19425%0.252CS..Hα-helixtrans-60.7-50.1-178.8172.60000110.7L51 I52 N57 F58 E59L51-V55 HydrophobicContact CD1-CG2 4.45Å; L51-V55 WeakPolarHBondContact O-CG2 3.43Å; L51-V55 PolarHBondContact O-N 3.18Å; I52-V55 PolarHBondContact O-N 2.63Å; V55-N57 VanDerWaalsContact C-N 3.34Å; V55-N57 PolarHBondContact O-N 3.02Å; V55-F58 WeakPolarHBondContact O-CB 3.2Å; V55-F58 PolarHBondContact O-N 3.23Å; V55-F58 VanDerWaalsContact O-N 3.12Å; V55-E59 HydrophobicContact CG1-CG 4.3Å; V55-E59 WeakPolarHBondContact O-CG 3.31Å; V55-E59 PolarHBondContact O-N 3.42Å
56N88.3Confident86.7Confident47 Ų4757.1 Ų57.125%0.25129%0.294SS..Hα-helixtrans-61.2-41.6-179.4-68.7-0.7000112.2I52 R60I52-N56 VanDerWaalsContact O-CB 3.27Å; I52-N56 WeakPolarHBondContact O-CB 3.37Å; I52-N56 PolarHBondContact O-N 3.16Å; I52-N56 PolarHBondContact O-OD1 3.07Å; N56-R60 WeakPolarHBondContact O-CG 3.42Å; N56-R60 PolarHBondContact O-N 3.43Å; N56-R60 VanDerWaalsContact O-N 3.16Å
57N86.8Confident85Confident30 Ų3058.5 Ų58.516%0.1630%0.298CS..Hα-helixtrans-71.9-33.4177.7-68.9-26.4000111.9S9 T53 F54 V55 T61S9-N57 WeakPolarHBondContact OG-CB 3.32Å; T53-N57 VanDerWaalsContact O-CB 3.3Å; T53-N57 WeakPolarHBondContact O-CB 3.47Å; T53-N57 PolarHBondContact O-N 3.11Å; T53-N57 VanDerWaalsContact O-N 3.11Å; T53-N57 PolarHBondContact O-ND2 2.97Å; F54-N57 PolarHBondContact O-N 3.13Å; V55-N57 VanDerWaalsContact C-N 3.34Å; V55-N57 PolarHBondContact O-N 3.02Å; N57-T61 PolarHBondContact O-N 2.81Å; N57-T61 PolarHBondContact O-OG1 3.43Å
58F85.6Confident83.1Confident96 Ų9664.4 Ų64.442%0.42134%0.338SS..Hα-helixtrans-68.4-44.5176.1-175.7-107.3000111.6F54 V55 R60 T61 L62F54-F58 HydrophobicContact CZ-CD2 4.44Å; F54-F58 HydrophobicContact CZ-CG 4.46Å; F54-F58 WeakPolarHBondContact O-CB 3.4Å; F54-F58 PolarHBondContact O-N 3.48Å; V55-F58 WeakPolarHBondContact O-CB 3.2Å; V55-F58 PolarHBondContact O-N 3.23Å; V55-F58 VanDerWaalsContact O-N 3.12Å; F58-R60 PolarHBondContact O-N 2.9Å; F58-T61 WeakPolarHBondContact O-CA 3.36Å; F58-T61 WeakPolarHBondContact O-CB 3.35Å; F58-T61 PolarHBondContact O-N 3.25Å; F58-L62 HydrophobicContact CD1-CD1 3.89Å; F58-L62 HydrophobicContact CD1-CG 4.43Å; F58-L62 HydrophobicContact CE1-CD1 3.24Å; F58-L62 HydrophobicContact CE1-CG 4.07Å; F58-L62 HydrophobicContact CE2-CD1 4.26Å; F58-L62 HydrophobicContact CE2-CG 4.38Å; F58-L62 HydrophobicContact CZ-CD1 3.46Å; F58-L62 VanDerWaalsContact CZ-CD1 3.46Å; F58-L62 HydrophobicContact CZ-CD2 4.43Å; F58-L62 HydrophobicContact CZ-CG 4.05Å; F58-L62 PolarHBondContact O-N 3.44Å
59E84.4Confident81.3Confident30 Ų3066.3 Ų66.314%0.1435%0.351CS..Hα-helixtrans-60.7-45175.3-73.9-179.4164.600111.9V55 T61 L62 F63 E74V55-E59 HydrophobicContact CG1-CG 4.3Å; V55-E59 WeakPolarHBondContact O-CG 3.31Å; V55-E59 PolarHBondContact O-N 3.42Å; E59-T61 PolarHBondContact O-N 3.41Å; E59-L62 PolarHBondContact O-N 2.86Å; E59-L62 VanDerWaalsContact O-N 3.13Å; E59-F63 HydrophobicContact CB-CD2 4.13Å; E59-F63 HydrophobicContact CG-CD2 4.3Å; E59-F63 HydrophobicContact CG-CE2 4.31Å; E59-F63 PolarHBondContact O-N 3.24Å; E59-E74 WeakPolarHBondContact OE1-CG 3.3Å
60R81.4Confident79.6Confident75 Ų7566.3 Ų66.328%0.28336%0.357SS..Hα-helixtrans-57.4-34172.9-74.4176.9-176.8-79.4-5.6112.8N56 F58 G64 D65N56-R60 WeakPolarHBondContact O-CG 3.42Å; N56-R60 PolarHBondContact O-N 3.43Å; N56-R60 VanDerWaalsContact O-N 3.16Å; F58-R60 PolarHBondContact O-N 2.9Å; R60-G64 CarbonylContact O-C 3.37Å; R60-G64 VanDerWaalsContact O-CA 3.29Å; R60-G64 WeakPolarHBondContact O-CA 3.33Å; R60-G64 PolarHBondContact O-N 2.84Å; R60-D65 PolarHBondContact NH1-O 2.99Å
61T81.1Confident78.1Confident79 Ų7969.1 Ų69.149%0.48538%0.375SS..Hα-helixtrans-75.3-33.3179.3-53.20000112.1N57 F58 E59N57-T61 PolarHBondContact O-N 2.81Å; N57-T61 PolarHBondContact O-OG1 3.43Å; F58-T61 WeakPolarHBondContact O-CA 3.36Å; F58-T61 WeakPolarHBondContact O-CB 3.35Å; F58-T61 PolarHBondContact O-N 3.25Å; E59-T61 PolarHBondContact O-N 3.41Å
62L80.7Confident76.8Confident106 Ų10677 Ų7756%0.55541%0.41SS*.Hα-helixtrans-88.8-45.5-178.4-69.9-173.3000113.9F58 E59F58-L62 HydrophobicContact CD1-CD1 3.89Å; F58-L62 HydrophobicContact CD1-CG 4.43Å; F58-L62 HydrophobicContact CE1-CD1 3.24Å; F58-L62 HydrophobicContact CE1-CG 4.07Å; F58-L62 HydrophobicContact CE2-CD1 4.26Å; F58-L62 HydrophobicContact CE2-CG 4.38Å; F58-L62 HydrophobicContact CZ-CD1 3.46Å; F58-L62 VanDerWaalsContact CZ-CD1 3.46Å; F58-L62 HydrophobicContact CZ-CD2 4.43Å; F58-L62 HydrophobicContact CZ-CG 4.05Å; F58-L62 PolarHBondContact O-N 3.44Å; E59-L62 PolarHBondContact O-N 2.86Å; E59-L62 VanDerWaalsContact O-N 3.13Å
63F80.6Confident76.4Confident129 Ų12980.1 Ų80.157%0.56643%0.43SS*.Hα-helixtrans-99-7.8-172.9-58.8-69000113.2E59 F67E59-F63 HydrophobicContact CB-CD2 4.13Å; E59-F63 HydrophobicContact CG-CD2 4.3Å; E59-F63 HydrophobicContact CG-CE2 4.31Å; E59-F63 PolarHBondContact O-N 3.24Å; F63-F67 HydrophobicContact CB-CB 3.77Å; F63-F67 HydrophobicContact CB-CD1 4.38Å; F63-F67 HydrophobicContact CB-CD2 3.82Å; F63-F67 HydrophobicContact CB-CG 3.73Å; F63-F67 HydrophobicContact CD2-CD1 4.43Å; F63-F67 HydrophobicContact CD2-CE1 4.49Å; F63-F67 HydrophobicContact CG-CD2 4.25Å; F63-F67 HydrophobicContact CG-CG 4.34Å
64G73Confident76.2Confident32 Ų3278.9 Ų78.933%0.3342%0.421SS..  trans91.5164.2-178.200000113.4R60 E66 F67R60-G64 CarbonylContact O-C 3.37Å; R60-G64 VanDerWaalsContact O-CA 3.29Å; R60-G64 WeakPolarHBondContact O-CA 3.33Å; R60-G64 PolarHBondContact O-N 2.84Å; G64-E66 PolarHBondContact O-N 3.17Å; G64-F67 WeakPolarHBondContact O-CB 3.43Å; G64-F67 PolarHBondContact O-N 3.47Å
65D68.6Low76.2Confident118 Ų11877.2 Ų77.263%0.63142%0.415SS*.THydrogen-bonded Turntrans-65.5-22.6-173.9-74.2-46.8000114R60 F67R60-D65 PolarHBondContact NH1-O 2.99Å; D65-F67 VanDerWaalsContact C-N 3.32Å
66E64.5Low76.3Confident186 Ų18678.2 Ų78.287%0.86943%0.426SS*.THydrogen-bonded Turntrans-83.4-5179.2-60-164.8114.100113.5G64 C68G64-E66 PolarHBondContact O-N 3.17Å; E66-C68 PolarHBondContact O-N 3.26Å
67F61Low76.5Confident82 Ų8280.9 Ų80.936%0.3644%0.439SS..  trans-64.1108.5174-168.1-105.7000108.8F63 G64 D65 S69F63-F67 HydrophobicContact CB-CB 3.77Å; F63-F67 HydrophobicContact CB-CD1 4.38Å; F63-F67 HydrophobicContact CB-CD2 3.82Å; F63-F67 HydrophobicContact CB-CG 3.73Å; F63-F67 HydrophobicContact CD2-CD1 4.43Å; F63-F67 HydrophobicContact CD2-CE1 4.49Å; F63-F67 HydrophobicContact CG-CD2 4.25Å; F63-F67 HydrophobicContact CG-CG 4.34Å; G64-F67 WeakPolarHBondContact O-CB 3.43Å; G64-F67 PolarHBondContact O-N 3.47Å; D65-F67 VanDerWaalsContact C-N 3.32Å; F67-S69 PolarHBondContact O-N 3.45Å
68C57.3Low76.9Confident124 Ų12479.5 Ų79.584%0.83843%0.432SS*.  trans-67.780.9168.5-61.40000107.7E66 G70E66-C68 PolarHBondContact O-N 3.26Å; C68-G70 PolarHBondContact O-N 2.81Å
69S58.6Low77.4Confident39 Ų3975.8 Ų75.827%0.27342%0.416SS..  trans-51116172.365.80000106.6F67F67-S69 PolarHBondContact O-N 3.45Å
70G60.5Low77.9Confident32 Ų3278.8 Ų78.833%0.3344%0.436SS..  trans-59153.517700000108.2C68 E74C68-G70 PolarHBondContact O-N 2.81Å; G70-E74 PolarHBondContact N-OE1 2.89Å; G70-E74 VanDerWaalsContact N-OE1 3.16Å
71V64.5Low78.6Confident92 Ų9278.3 Ų78.356%0.55844%0.439SS*.SBendtrans-81.9-13.6169.8-152.30000109.9V75 I109V71-V75 HydrophobicContact CG1-CG2 3.97Å; V71-V75 WeakPolarHBondContact O-CB 3.16Å; V71-V75 WeakPolarHBondContact O-CG2 2.99Å; V71-I109 HydrophobicContact CG1-CD1 4.39Å
72F67.5Low79.4Confident185 Ų18574.5 Ų74.581%0.81142%0.416SS*.SBendtrans-93.1-59.2-159.5-111.4-87.8000114.4A76F72-A76 WeakPolarHBondContact O-CB 3.16Å
73P84.2Confident80.1Confident75 Ų7570.5 Ų70.549%0.48740%0.396SS..Hα-helixtrans-72.6-41-179.522.2-26.9000112.9A76 I77P73-A76 PolarHBondContact O-N 3.37Å; P73-I77 WeakPolarHBondContact O-CD1 3.38Å; P73-I77 WeakPolarHBondContact O-CG1 3.27Å; P73-I77 PolarHBondContact O-N 3Å
74E88.6Confident80.9Confident22 Ų2267.5 Ų67.510%0.10339%0.391CS..Hα-helixtrans-67.6-47.1-171.6-57.583.9170.200111.1E59 G70 A76 I77 C78E59-E74 WeakPolarHBondContact OE1-CG 3.3Å; G70-E74 PolarHBondContact N-OE1 2.89Å; G70-E74 VanDerWaalsContact N-OE1 3.16Å; E74-A76 PolarHBondContact O-N 3.45Å; E74-I77 PolarHBondContact O-N 3.48Å; E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.37Å; E74-C78 PolarHBondContact O-SG 3.29Å
75V92.3Very high81.9Confident11 Ų1169.3 Ų69.37%0.06739%0.39CS..Hα-helixtrans-63-44.3177.4175.50000110.8F48 I52 V71 I77 C78 I79 L105F48-V75 HydrophobicContact CE2-CG1 4.27Å; F48-V75 HydrophobicContact CZ-CG1 4.16Å; I52-V75 HydrophobicContact CD1-CG2 3.62Å; V71-V75 HydrophobicContact CG1-CG2 3.97Å; V71-V75 WeakPolarHBondContact O-CB 3.16Å; V71-V75 WeakPolarHBondContact O-CG2 2.99Å; V75-I77 PolarHBondContact O-N 3.49Å; V75-C78 PolarHBondContact O-N 2.92Å; V75-I79 HydrophobicContact CG1-CD1 3.81Å; V75-I79 HydrophobicContact CG1-CG1 4.27Å; V75-I79 VanDerWaalsContact O-CG1 3.3Å; V75-I79 WeakPolarHBondContact O-CG1 3.41Å; V75-I79 PolarHBondContact O-N 3.27Å; V75-L105 HydrophobicContact CG1-CD1 3.85Å; V75-L105 HydrophobicContact CG1-CD2 3.6Å; V75-L105 HydrophobicContact CG1-CG 4.35Å; V75-L105 HydrophobicContact CG2-CD1 4.11Å
76A92.1Very high83.1Confident52 Ų5263.7 Ų63.743%0.4336%0.36SS..Hα-helixtrans-61.5-45.6179.800000111.3F72 P73 E74 C78 I79 V80F72-A76 WeakPolarHBondContact O-CB 3.16Å; P73-A76 PolarHBondContact O-N 3.37Å; E74-A76 PolarHBondContact O-N 3.45Å; A76-C78 PolarHBondContact O-N 3.4Å; A76-I79 PolarHBondContact O-N 3.43Å; A76-V80 WeakPolarHBondContact O-CG2 3.44Å; A76-V80 PolarHBondContact O-N 3.36Å
77I93.1Very high84.5Confident103 Ų10356.9 Ų56.953%0.52834%0.336SS..Hα-helixtrans-61.1-45.9176.2-67.8164.6000110.4P73 E74 V75 I79 V80 I81P73-I77 WeakPolarHBondContact O-CD1 3.38Å; P73-I77 WeakPolarHBondContact O-CG1 3.27Å; P73-I77 PolarHBondContact O-N 3Å; E74-I77 PolarHBondContact O-N 3.48Å; V75-I77 PolarHBondContact O-N 3.49Å; I77-I79 PolarHBondContact O-N 3.4Å; I77-V80 PolarHBondContact O-N 3.15Å; I77-I81 HydrophobicContact CG2-CD1 3.71Å; I77-I81 HydrophobicContact CG2-CG1 4.45Å; I77-I81 VanDerWaalsContact O-CG1 3.31Å; I77-I81 WeakPolarHBondContact O-CG1 3.28Å; I77-I81 PolarHBondContact O-N 3.25Å
78C95.5Very high86Confident2 Ų257 Ų571%0.01434%0.343CS..Hα-helixtrans-62.4-41.3178.6-69.40000112.3F48 L51 E74 V75 A76 I81 A82F48-C78 HydrophobicContact CD2-CB 4Å; F48-C78 HydrophobicContact CE2-CB 3.94Å; L51-C78 HydrophobicContact CD2-CB 4.08Å; L51-C78 HydrophobicContact CG-CB 4.32Å; E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.37Å; E74-C78 PolarHBondContact O-SG 3.29Å; V75-C78 PolarHBondContact O-N 2.92Å; A76-C78 PolarHBondContact O-N 3.4Å; C78-I81 PolarHBondContact O-N 2.91Å; C78-A82 VanDerWaalsContact O-CB 3.29Å; C78-A82 WeakPolarHBondContact O-CB 3.26Å; C78-A82 PolarHBondContact O-N 2.92Å
79I95.4Very high87.5Confident17 Ų1752.1 Ų52.19%0.08731%0.309CS..Hα-helixtrans-61.8-46.7175.8-72.2174.6000110.2F48 V75 A76 I77 I81 A82 C83 F98 L102F48-I79 HydrophobicContact CD2-CG1 3.78Å; F48-I79 HydrophobicContact CE2-CD1 4.31Å; F48-I79 HydrophobicContact CE2-CG1 3.44Å; F48-I79 VanDerWaalsContact CE2-CG1 3.44Å; F48-I79 HydrophobicContact CZ-CG1 4.07Å; V75-I79 HydrophobicContact CG1-CD1 3.81Å; V75-I79 HydrophobicContact CG1-CG1 4.27Å; V75-I79 VanDerWaalsContact O-CG1 3.3Å; V75-I79 WeakPolarHBondContact O-CG1 3.41Å; V75-I79 PolarHBondContact O-N 3.27Å; A76-I79 PolarHBondContact O-N 3.43Å; I77-I79 PolarHBondContact O-N 3.4Å; I79-I81 VanDerWaalsContact C-N 3.35Å; I79-I81 PolarHBondContact O-N 3.43Å; I79-A82 PolarHBondContact O-N 3.22Å; I79-C83 VanDerWaalsContact O-CB 3.25Å; I79-C83 WeakPolarHBondContact O-CB 3.43Å; I79-C83 PolarHBondContact O-N 2.82Å; I79-C83 PolarHBondContact O-SG 3.49Å; I79-F98 HydrophobicContact CG2-CD2 3.6Å; I79-F98 HydrophobicContact CG2-CE2 3.85Å; I79-L102 HydrophobicContact CD1-CD2 4.34Å
80V96Very high89.1Confident93 Ų9353.8 Ų53.856%0.56431%0.312SS*.Hα-helixtrans-60.6-44.9179.6170.30000111.1A76 I77 S84A76-V80 WeakPolarHBondContact O-CG2 3.44Å; A76-V80 PolarHBondContact O-N 3.36Å; I77-V80 PolarHBondContact O-N 3.15Å; V80-S84 WeakPolarHBondContact O-CB 3.29Å; V80-S84 PolarHBondContact O-N 2.88Å; V80-S84 PolarHBondContact O-OG 2.91Å
81I96.3Very high90.6Very high65 Ų6562.8 Ų62.833%0.33334%0.336SS..Hα-helixtrans-64.6-48.6178.6-67.1168.8000110.9L51 I77 C78 I79 C83 S84 F85L51-I81 HydrophobicContact CD2-CB 3.75Å; L51-I81 HydrophobicContact CD2-CD1 4.37Å; L51-I81 HydrophobicContact CD2-CG2 3.58Å; I77-I81 HydrophobicContact CG2-CD1 3.71Å; I77-I81 HydrophobicContact CG2-CG1 4.45Å; I77-I81 VanDerWaalsContact O-CG1 3.31Å; I77-I81 WeakPolarHBondContact O-CG1 3.28Å; I77-I81 PolarHBondContact O-N 3.25Å; C78-I81 PolarHBondContact O-N 2.91Å; I79-I81 VanDerWaalsContact C-N 3.35Å; I79-I81 PolarHBondContact O-N 3.43Å; I81-C83 PolarHBondContact O-N 2.94Å; I81-S84 WeakPolarHBondContact O-CB 3.2Å; I81-S84 PolarHBondContact O-N 2.69Å; I81-F85 HydrophobicContact CG2-CD2 3.8Å; I81-F85 HydrophobicContact CG2-CE2 3.45Å; I81-F85 VanDerWaalsContact CG2-CE2 3.45Å; I81-F85 HydrophobicContact CG2-CZ 4.27Å; I81-F85 WeakPolarHBondContact O-CD2 3.47Å; I81-F85 PolarHBondContact O-N 2.92Å
82A96.7Very high92Very high0 Ų061.3 Ų61.30%033%0.327CS..Hα-helixtrans-63.2-42.2179.800000112.1I47 F48 C78 I79 S84 F85 S86I47-A82 HydrophobicContact CG2-CB 4.28Å; F48-A82 HydrophobicContact CB-CB 3.68Å; C78-A82 VanDerWaalsContact O-CB 3.29Å; C78-A82 WeakPolarHBondContact O-CB 3.26Å; C78-A82 PolarHBondContact O-N 2.92Å; I79-A82 PolarHBondContact O-N 3.22Å; A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 2.91Å; A82-F85 PolarHBondContact O-N 2.84Å; A82-S86 PolarHBondContact O-N 2.78Å
83C96.5Very high93.3Very high22 Ų2252.5 Ų52.515%0.14929%0.288CS..Hα-helixtrans-62.6-39.1174.6-69.20000111.4I79 I81 S86 A87I79-C83 VanDerWaalsContact O-CB 3.25Å; I79-C83 WeakPolarHBondContact O-CB 3.43Å; I79-C83 PolarHBondContact O-N 2.82Å; I79-C83 PolarHBondContact O-SG 3.49Å; I81-C83 PolarHBondContact O-N 2.94Å; C83-S86 PolarHBondContact O-N 3.31Å; C83-A87 WeakPolarHBondContact O-CB 3.37Å; C83-A87 PolarHBondContact O-N 3.34Å
84S95.7Very high93.8Very high66 Ų6649.4 Ų49.446%0.46227%0.27SS..Hα-helixtrans-63.4-46.7176.2-59.90000111.2V80 I81 A82 S86 A87 T88V80-S84 WeakPolarHBondContact O-CB 3.29Å; V80-S84 PolarHBondContact O-N 2.88Å; V80-S84 PolarHBondContact O-OG 2.91Å; I81-S84 WeakPolarHBondContact O-CB 3.2Å; I81-S84 PolarHBondContact O-N 2.69Å; A82-S84 VanDerWaalsContact C-N 3.31Å; A82-S84 PolarHBondContact O-N 2.91Å; S84-S86 VanDerWaalsContact C-N 3.34Å; S84-S86 PolarHBondContact O-N 3.5Å; S84-A87 PolarHBondContact O-N 3.25Å; S84-T88 WeakPolarHBondContact O-CG2 3.38Å; S84-T88 PolarHBondContact O-N 3.45Å; S84-T88 VanDerWaalsContact O-N 3.12Å
85F94.5Very high94.2Very high69 Ų6952.4 Ų52.430%0.30329%0.29SS..Hα-helixtrans-60.7-41.3175.2-75.2-43.9000112.6F20 R24 I47 I81 A82 T88F20-F85 HydrophobicContact CD2-CB 3.9Å; F20-F85 HydrophobicContact CD2-CD1 4.07Å; F20-F85 HydrophobicContact CD2-CG 4.03Å; F20-F85 HydrophobicContact CE1-CD1 4.39Å; F20-F85 HydrophobicContact CE2-CB 3.69Å; F20-F85 AromaticContact CE2-CD1 3.48Å; F20-F85 HydrophobicContact CE2-CD1 3.48Å; F20-F85 VanDerWaalsContact CE2-CD1 3.48Å; F20-F85 HydrophobicContact CE2-CE1 4.34Å; F20-F85 AromaticContact CE2-CG 3.81Å; F20-F85 HydrophobicContact CE2-CG 3.81Å; F20-F85 AromaticContact CZ-CD1 3.66Å; F20-F85 HydrophobicContact CZ-CD1 3.66Å; F20-F85 HydrophobicContact CZ-CE1 4.17Å; F20-F85 HydrophobicContact CZ-CG 4.43Å; R24-F85 PolarHBondContact NH2-O 3.02Å; I47-F85 HydrophobicContact CG2-CD2 4.23Å; I81-F85 HydrophobicContact CG2-CD2 3.8Å; I81-F85 HydrophobicContact CG2-CE2 3.45Å; I81-F85 VanDerWaalsContact CG2-CE2 3.45Å; I81-F85 HydrophobicContact CG2-CZ 4.27Å; I81-F85 WeakPolarHBondContact O-CD2 3.47Å; I81-F85 PolarHBondContact O-N 2.92Å; A82-F85 PolarHBondContact O-N 2.84Å; F85-T88 PolarHBondContact O-OG1 3.29Å
86S94.6Very high94.3Very high0 Ų052.8 Ų52.80%029%0.293CS..Hα-helixtrans-68.9-39.5176.4-1670000112.4A82 C83 S84 T88 I89 H90 C93A82-S86 PolarHBondContact O-N 2.78Å; C83-S86 PolarHBondContact O-N 3.31Å; S84-S86 VanDerWaalsContact C-N 3.34Å; S84-S86 PolarHBondContact O-N 3.5Å; S86-T88 PolarHBondContact O-N 2.88Å; S86-I89 WeakPolarHBondContact O-CB 3.44Å; S86-I89 PolarHBondContact O-N 3.08Å; S86-H90 PolarHBondContact O-N 3Å; S86-C93 VanDerWaalsContact OG-CB 3.3Å; S86-C93 WeakPolarHBondContact OG-CB 3.31Å; S86-C93 PolarHBondContact OG-O 3.44Å
87A94.4Very high94.6Very high44 Ų4450.3 Ų50.336%0.36427%0.272SS..Hα-helixtrans-64.3-27.1179.200000113.1C83 S84 I89 H90C83-A87 WeakPolarHBondContact O-CB 3.37Å; C83-A87 PolarHBondContact O-N 3.34Å; S84-A87 PolarHBondContact O-N 3.25Å; A87-I89 PolarHBondContact O-N 3.44Å; A87-H90 CarbonylContact O-C 3.18Å; A87-H90 PolarHBondContact O-N 3.16Å
88T91.9Very high94.8Very high83 Ų8350.1 Ų50.151%0.50927%0.267SS..THydrogen-bonded Turntrans-67.5-16.5172.960.70000112.9R24 S84 F85 S86R24-T88 VanDerWaalsContact NH1-C 3.28Å; R24-T88 PolarHBondContact NH1-O 3.16Å; R24-T88 PolarHBondContact NH1-OG1 3.24Å; R24-T88 PolarHBondContact NH2-O 3.4Å; R24-T88 PolarHBondContact NH2-OG1 2.9Å; S84-T88 WeakPolarHBondContact O-CG2 3.38Å; S84-T88 PolarHBondContact O-N 3.45Å; S84-T88 VanDerWaalsContact O-N 3.12Å; F85-T88 PolarHBondContact O-OG1 3.29Å; S86-T88 PolarHBondContact O-N 2.88Å
89I89.4Confident94.8Very high22 Ų2255 Ų5511%0.11329%0.292CS..THydrogen-bonded Turntrans-78.7-60170.8-58.7-176.5000107.1M23 R24 A27 L30 S86 A87M23-I89 HydrophobicContact CB-CD1 3.86Å; M23-I89 HydrophobicContact CE-CD1 3.33Å; M23-I89 HydrophobicContact CE-CG1 4.24Å; M23-I89 HydrophobicContact CG-CD1 4.06Å; R24-I89 VanDerWaalsContact NH2-CA 3.35Å; A27-I89 HydrophobicContact CB-CG2 4.02Å; L30-I89 HydrophobicContact CB-CG2 4.17Å; L30-I89 HydrophobicContact CD2-CD1 3.72Å; S86-I89 WeakPolarHBondContact O-CB 3.44Å; S86-I89 PolarHBondContact O-N 3.08Å; A87-I89 PolarHBondContact O-N 3.44Å
90H91.3Very high94.9Very high74 Ų7457.3 Ų57.334%0.34330%0.302SS..  trans-158.2145-175.3-164.8-102.8000108.8S86 A87 V92 C93 G94S86-H90 PolarHBondContact O-N 3Å; A87-H90 CarbonylContact O-C 3.18Å; A87-H90 PolarHBondContact O-N 3.16Å; H90-V92 VanDerWaalsContact CE1-CG2 3.49Å; H90-V92 WeakPolarHBondContact CE1-CG2 3.34Å; H90-V92 WeakPolarHBondContact ND1-CB 3.3Å; H90-V92 WeakPolarHBondContact ND1-CG2 3.42Å; H90-V92 PolarHBondContact ND1-N 3.26Å; H90-V92 PolarHBondContact O-N 3.48Å; H90-C93 HydrophobicContact CB-CB 4.39Å; H90-C93 WeakPolarHBondContact O-CB 3.45Å; H90-C93 PolarHBondContact O-N 3.44Å; H90-G94 PolarHBondContact O-N 3.5Å
91R92.9Very high95Very high222 Ų22252.9 Ų52.984%0.83828%0.275SS*.Hα-helixtrans-61.1-34.7-177.9-60.5-177-176.6-179.81112.1G94 T95R91-G94 PolarHBondContact O-N 3.37Å; R91-T95 PolarHBondContact O-N 2.9Å
92V93.7Very high94.9Very high60 Ų6053.7 Ų53.736%0.36428%0.28SS..Hα-helixtrans-64.6-40.5175.6-179.10000111.3H90 G94 T95 T96H90-V92 VanDerWaalsContact CE1-CG2 3.49Å; H90-V92 WeakPolarHBondContact CE1-CG2 3.34Å; H90-V92 WeakPolarHBondContact ND1-CB 3.3Å; H90-V92 WeakPolarHBondContact ND1-CG2 3.42Å; H90-V92 PolarHBondContact ND1-N 3.26Å; H90-V92 PolarHBondContact O-N 3.48Å; V92-G94 PolarHBondContact O-N 2.95Å; V92-T95 PolarHBondContact O-N 2.98Å; V92-T95 VanDerWaalsContact O-N 3.11Å; V92-T95 PolarHBondContact O-OG1 2.89Å; V92-T96 HydrophobicContact CG1-CG2 4.26Å; V92-T96 PolarHBondContact O-N 2.91Å; V92-T96 PolarHBondContact O-OG1 3.45Å; V92-T96 VanDerWaalsContact O-OG1 3.12Å
93C94.1Very high94.9Very high0 Ų056.9 Ų56.90%030%0.299CS..Hα-helixtrans-60.1-34.9177.5-64.20000112.2T37 S86 H90 T96 C97T37-C93 PolarHBondContact O-SG 2.98Å; S86-C93 VanDerWaalsContact OG-CB 3.3Å; S86-C93 WeakPolarHBondContact OG-CB 3.31Å; S86-C93 PolarHBondContact OG-O 3.44Å; H90-C93 HydrophobicContact CB-CB 4.39Å; H90-C93 WeakPolarHBondContact O-CB 3.45Å; H90-C93 PolarHBondContact O-N 3.44Å; C93-T96 WeakPolarHBondContact CA-OG1 3.29Å; C93-T96 PolarHBondContact O-OG1 3.09Å; C93-C97 WeakPolarHBondContact O-CB 3.37Å; C93-C97 PolarHBondContact O-N 3.45Å
94G94.5Very high94.9Very high10 Ų1058.2 Ų58.210%0.10330%0.304CS..Hα-helixtrans-62.3-44.9174.400000112.5H90 R91 V92 C97 F98H90-G94 PolarHBondContact O-N 3.5Å; R91-G94 PolarHBondContact O-N 3.37Å; V92-G94 PolarHBondContact O-N 2.95Å; G94-C97 WeakPolarHBondContact O-CB 3.27Å; G94-C97 PolarHBondContact O-N 3.23Å; G94-F98 PolarHBondContact O-N 3.48Å; G94-F98 VanDerWaalsContact O-N 3.11Å
95T96.2Very high94.8Very high85 Ų8556.3 Ų56.352%0.52129%0.288SS..Hα-helixtrans-69.8-41179.460.10000113R91 V92 C97 F98 I99R91-T95 PolarHBondContact O-N 2.9Å; V92-T95 PolarHBondContact O-N 2.98Å; V92-T95 VanDerWaalsContact O-N 3.11Å; V92-T95 PolarHBondContact O-OG1 2.89Å; T95-C97 VanDerWaalsContact C-N 3.34Å; T95-F98 WeakPolarHBondContact O-CB 3.33Å; T95-F98 PolarHBondContact O-N 2.96Å; T95-I99 PolarHBondContact O-N 3.33Å
96T96.2Very high94.8Very high20 Ų2059.1 Ų59.112%0.12330%0.298CS..Hα-helixtrans-69.3-35.8177520000111T37 I38 G41 V92 C93 F98 I99 F100T37-T96 PolarHBondContact O-OG1 2.67Å; I38-T96 HydrophobicContact CG1-CG2 4.34Å; G41-T96 VanDerWaalsContact CA-OG1 3.26Å; G41-T96 WeakPolarHBondContact CA-OG1 3.45Å; V92-T96 HydrophobicContact CG1-CG2 4.26Å; V92-T96 PolarHBondContact O-N 2.91Å; V92-T96 PolarHBondContact O-OG1 3.45Å; V92-T96 VanDerWaalsContact O-OG1 3.12Å; C93-T96 WeakPolarHBondContact CA-OG1 3.29Å; C93-T96 PolarHBondContact O-OG1 3.09Å; T96-F98 VanDerWaalsContact C-N 3.35Å; T96-F98 PolarHBondContact O-N 3.29Å; T96-I99 PolarHBondContact O-N 3.42Å; T96-F100 WeakPolarHBondContact O-CD2 3.18Å; T96-F100 PolarHBondContact O-N 3.38Å
97C97.1Very high94.7Very high0 Ų065.5 Ų65.50%032%0.323CS..Hα-helixtrans-56.5-46.9170.7-179.10000111.5G41 C93 G94 T95 I99 F100 S101G41-C97 WeakPolarHBondContact O-CA 3.21Å; C93-C97 WeakPolarHBondContact O-CB 3.37Å; C93-C97 PolarHBondContact O-N 3.45Å; G94-C97 WeakPolarHBondContact O-CB 3.27Å; G94-C97 PolarHBondContact O-N 3.23Å; T95-C97 VanDerWaalsContact C-N 3.34Å; C97-I99 PolarHBondContact O-N 2.89Å; C97-F100 PolarHBondContact O-N 2.93Å; C97-S101 VanDerWaalsContact O-CB 3.26Å; C97-S101 WeakPolarHBondContact O-CB 3.29Å; C97-S101 PolarHBondContact O-N 3.28Å; C97-S101 PolarHBondContact O-OG 3.03Å
98F97.2Very high94.6Very high98 Ų9866 Ų6643%0.4332%0.319SS..Hα-helixtrans-56.7-47.8178.7-179.5-103000112.2I79 G94 T95 T96 S101 L102I79-F98 HydrophobicContact CG2-CD2 3.6Å; I79-F98 HydrophobicContact CG2-CE2 3.85Å; G94-F98 PolarHBondContact O-N 3.48Å; G94-F98 VanDerWaalsContact O-N 3.11Å; T95-F98 WeakPolarHBondContact O-CB 3.33Å; T95-F98 PolarHBondContact O-N 2.96Å; T96-F98 VanDerWaalsContact C-N 3.35Å; T96-F98 PolarHBondContact O-N 3.29Å; F98-S101 PolarHBondContact O-N 2.62Å; F98-L102 HydrophobicContact CD1-CD1 4.25Å; F98-L102 HydrophobicContact CE1-CD1 3.67Å; F98-L102 HydrophobicContact CE1-CG 4.4Å; F98-L102 HydrophobicContact CZ-CD1 3.93Å; F98-L102 HydrophobicContact CZ-CG 4.38Å; F98-L102 WeakPolarHBondContact O-CG 3.49Å; F98-L102 PolarHBondContact O-N 2.85Å; F98-L102 VanDerWaalsContact O-N 3.08Å
99I96.8Very high94.5Very high105 Ų10566 Ų6654%0.53832%0.315SS..Hα-helixtrans-62.7-49.2179.3-62.8171.3000110.7T95 T96 C97 S101 L102 V103T95-I99 PolarHBondContact O-N 3.33Å; T96-I99 PolarHBondContact O-N 3.42Å; C97-I99 PolarHBondContact O-N 2.89Å; I99-S101 VanDerWaalsContact C-N 3.31Å; I99-S101 PolarHBondContact O-N 2.82Å; I99-L102 PolarHBondContact O-N 3.34Å; I99-V103 PolarHBondContact O-N 3.38Å
100F97.2Very high94.5Very high66 Ų6671.1 Ų71.129%0.28933%0.333SS..Hα-helixtrans-64.7-35.4179-73.7-56.4000112.4I38 F42 T96 C97 L102 V103 M104I38-F100 HydrophobicContact CG2-CE2 3.85Å; I38-F100 HydrophobicContact CG2-CZ 3.91Å; F42-F100 HydrophobicContact CB-CD2 4.29Å; F42-F100 HydrophobicContact CB-CE2 4.24Å; T96-F100 WeakPolarHBondContact O-CD2 3.18Å; T96-F100 PolarHBondContact O-N 3.38Å; C97-F100 PolarHBondContact O-N 2.93Å; F100-L102 PolarHBondContact O-N 3.4Å; F100-V103 PolarHBondContact O-N 3.16Å; F100-M104 WeakPolarHBondContact O-CB 3.46Å; F100-M104 WeakPolarHBondContact O-CG 3.48Å; F100-M104 PolarHBondContact O-N 2.9Å
101S96.9Very high94.4Very high0 Ų072 Ų720%034%0.339CS..Hα-helixtrans-62.8-39.3174.7-72.80000112.1F48 C97 F98 I99 M104 L105F48-S101 WeakPolarHBondContact CB-OG 3.46Å; F48-S101 WeakPolarHBondContact CG-OG 3.39Å; C97-S101 VanDerWaalsContact O-CB 3.26Å; C97-S101 WeakPolarHBondContact O-CB 3.29Å; C97-S101 PolarHBondContact O-N 3.28Å; C97-S101 PolarHBondContact O-OG 3.03Å; F98-S101 PolarHBondContact O-N 2.62Å; I99-S101 VanDerWaalsContact C-N 3.31Å; I99-S101 PolarHBondContact O-N 2.82Å; S101-M104 PolarHBondContact O-N 3.12Å; S101-L105 WeakPolarHBondContact O-CB 2.99Å; S101-L105 PolarHBondContact O-N 3.49Å
102L95.9Very high94.1Very high81 Ų8163.8 Ų63.842%0.42432%0.316SS..Hα-helixtrans-64.6-41.2174.3-68.3179.2000112.1I79 F98 I99 F100 L105 Y106I79-L102 HydrophobicContact CD1-CD2 4.34Å; F98-L102 HydrophobicContact CD1-CD1 4.25Å; F98-L102 HydrophobicContact CE1-CD1 3.67Å; F98-L102 HydrophobicContact CE1-CG 4.4Å; F98-L102 HydrophobicContact CZ-CD1 3.93Å; F98-L102 HydrophobicContact CZ-CG 4.38Å; F98-L102 WeakPolarHBondContact O-CG 3.49Å; F98-L102 PolarHBondContact O-N 2.85Å; F98-L102 VanDerWaalsContact O-N 3.08Å; I99-L102 PolarHBondContact O-N 3.34Å; F100-L102 PolarHBondContact O-N 3.4Å; L102-L105 PolarHBondContact O-N 3.5Å; L102-Y106 PolarHBondContact O-N 3.16Å
103V96.7Very high93.5Very high68 Ų6865.9 Ų65.941%0.41232%0.322SS..Hα-helixtrans-63.1-48.5175.3174.90000110.6I99 F100 L105 Y106 Y107I99-V103 PolarHBondContact O-N 3.38Å; F100-V103 PolarHBondContact O-N 3.16Å; V103-L105 VanDerWaalsContact C-N 3.32Å; V103-L105 PolarHBondContact O-N 2.95Å; V103-Y106 WeakPolarHBondContact O-CB 3.15Å; V103-Y106 PolarHBondContact O-N 3.06Å; V103-Y107 HydrophobicContact CG1-CD2 3.94Å; V103-Y107 HydrophobicContact CG1-CE2 3.61Å; V103-Y107 WeakPolarHBondContact O-CD2 3.38Å; V103-Y107 PolarHBondContact O-N 2.93Å; V103-Y107 VanDerWaalsContact O-N 3.17Å
104M94.9Very high93.2Very high49 Ų4970.9 Ų70.924%0.24135%0.345CS..Hα-helixtrans-60.7-41.6176.6-73.8-62.7-156.100111.8F42 L46 V49 F100 S101 Y106 Y107 L108F42-M104 HydrophobicContact CE2-CE 4.19Å; L46-M104 HydrophobicContact CD2-CE 4Å; V49-M104 HydrophobicContact CG2-CB 3.89Å; V49-M104 HydrophobicContact CG2-CG 4.11Å; V49-M104 HydrophobicContact CG2-SD 4.47Å; F100-M104 WeakPolarHBondContact O-CB 3.46Å; F100-M104 WeakPolarHBondContact O-CG 3.48Å; F100-M104 PolarHBondContact O-N 2.9Å; S101-M104 PolarHBondContact O-N 3.12Å; M104-Y106 VanDerWaalsContact C-N 3.35Å; M104-Y106 PolarHBondContact O-N 2.76Å; M104-Y107 PolarHBondContact O-N 3.38Å; M104-L108 WeakPolarHBondContact O-CG 3.44Å; M104-L108 PolarHBondContact O-N 3.31Å
105L94.1Very high92.6Very high26 Ų2674 Ų7414%0.13636%0.362CS..Hα-helixtrans-60.5-43.517617765.1000111.6F48 V75 S101 L102 V103 Y107 L108 I109F48-L105 HydrophobicContact CE1-CB 4.12Å; F48-L105 HydrophobicContact CZ-CB 4.23Å; F48-L105 HydrophobicContact CZ-CD1 4.27Å; V75-L105 HydrophobicContact CG1-CD1 3.85Å; V75-L105 HydrophobicContact CG1-CD2 3.6Å; V75-L105 HydrophobicContact CG1-CG 4.35Å; V75-L105 HydrophobicContact CG2-CD1 4.11Å; S101-L105 WeakPolarHBondContact O-CB 2.99Å; S101-L105 PolarHBondContact O-N 3.49Å; L102-L105 PolarHBondContact O-N 3.5Å; V103-L105 VanDerWaalsContact C-N 3.32Å; V103-L105 PolarHBondContact O-N 2.95Å; L105-Y107 VanDerWaalsContact C-N 3.32Å; L105-Y107 PolarHBondContact O-N 2.8Å; L105-L108 PolarHBondContact O-N 2.94Å; L105-I109 HydrophobicContact CD1-CD1 3.87Å; L105-I109 HydrophobicContact CD1-CG1 4.11Å; L105-I109 HydrophobicContact CD2-CD1 4.5Å; L105-I109 HydrophobicContact CG-CD1 3.81Å; L105-I109 HydrophobicContact CG-CG1 4.44Å; L105-I109 VanDerWaalsContact O-CG1 3.3Å; L105-I109 WeakPolarHBondContact O-CG1 3.3Å; L105-I109 PolarHBondContact O-N 3.11Å
106Y94.3Very high91.6Very high128 Ų12876.5 Ų76.550%0.50236%0.363SS..Hα-helixtrans-57.1-46175.2170.3-97.2000111.6L102 V103 M104 I109 R110L102-Y106 PolarHBondContact O-N 3.16Å; V103-Y106 WeakPolarHBondContact O-CB 3.15Å; V103-Y106 PolarHBondContact O-N 3.06Å; M104-Y106 VanDerWaalsContact C-N 3.35Å; M104-Y106 PolarHBondContact O-N 2.76Å; Y106-I109 PolarHBondContact O-N 2.99Å; Y106-R110 HydrophobicContact CD1-CG 4.47Å; Y106-R110 HydrophobicContact CD2-CG 4.49Å; Y106-R110 HydrophobicContact CE1-CG 4.04Å; Y106-R110 HydrophobicContact CE2-CG 4.05Å; Y106-R110 WeakPolarHBondContact O-CB 3.35Å; Y106-R110 WeakPolarHBondContact O-CG 3.37Å; Y106-R110 PolarHBondContact O-N 3.27Å
107Y93.8Very high90.4Very high134 Ų13480.2 Ų80.253%0.52538%0.379SS..Hα-helixtrans-66.5-40.4176.8-73.8-67.6000112.7V103 M104 L105 I109 R110 I111V103-Y107 HydrophobicContact CG1-CD2 3.94Å; V103-Y107 HydrophobicContact CG1-CE2 3.61Å; V103-Y107 WeakPolarHBondContact O-CD2 3.38Å; V103-Y107 PolarHBondContact O-N 2.93Å; V103-Y107 VanDerWaalsContact O-N 3.17Å; M104-Y107 PolarHBondContact O-N 3.38Å; L105-Y107 VanDerWaalsContact C-N 3.32Å; L105-Y107 PolarHBondContact O-N 2.8Å; Y107-I109 PolarHBondContact O-N 3.35Å; Y107-R110 PolarHBondContact O-N 3.36Å; Y107-I111 WeakPolarHBondContact O-CB 3.45Å; Y107-I111 VanDerWaalsContact O-CG1 3.26Å; Y107-I111 WeakPolarHBondContact O-CG1 3.42Å; Y107-I111 PolarHBondContact O-N 3.32Å
108L91.4Very high88.6Confident54 Ų5483.5 Ų83.528%0.28340%0.402SS..Hα-helixtrans-60.9-44.4176.1-75.3177.5000111.8V49 I52 M104 L105 S112V49-L108 HydrophobicContact CG1-CD1 4.46Å; V49-L108 HydrophobicContact CG2-CD1 4.25Å; I52-L108 HydrophobicContact CG2-CD1 4.08Å; M104-L108 WeakPolarHBondContact O-CG 3.44Å; M104-L108 PolarHBondContact O-N 3.31Å; L105-L108 PolarHBondContact O-N 2.94Å; L108-S112 VanDerWaalsContact O-CB 3.28Å; L108-S112 WeakPolarHBondContact O-CB 3.35Å; L108-S112 PolarHBondContact O-N 3.27Å; L108-S112 PolarHBondContact O-OG 3.49Å
109I89.7Confident86.8Confident83 Ų8383.7 Ų83.743%0.42641%0.407SS..Hα-helixtrans-64.4-45177.3-67.8167.6000110.5V71 L105 Y106 Y107 S112 H113V71-I109 HydrophobicContact CG1-CD1 4.39Å; L105-I109 HydrophobicContact CD1-CD1 3.87Å; L105-I109 HydrophobicContact CD1-CG1 4.11Å; L105-I109 HydrophobicContact CD2-CD1 4.5Å; L105-I109 HydrophobicContact CG-CD1 3.81Å; L105-I109 HydrophobicContact CG-CG1 4.44Å; L105-I109 VanDerWaalsContact O-CG1 3.3Å; L105-I109 WeakPolarHBondContact O-CG1 3.3Å; L105-I109 PolarHBondContact O-N 3.11Å; Y106-I109 PolarHBondContact O-N 2.99Å; Y107-I109 PolarHBondContact O-N 3.35Å; I109-S112 PolarHBondContact O-N 3.27Å; I109-H113 WeakPolarHBondContact O-CB 3.05Å; I109-H113 PolarHBondContact O-N 3.26Å
110R90Very high84.9Confident130 Ų13085.3 Ų85.349%0.49141%0.413SS..Hα-helixtrans-58.3-51.2177.5-80.3-83.9-72-162.9-3.1112Y106 Y107 S112 H113 E114Y106-R110 HydrophobicContact CD1-CG 4.47Å; Y106-R110 HydrophobicContact CD2-CG 4.49Å; Y106-R110 HydrophobicContact CE1-CG 4.04Å; Y106-R110 HydrophobicContact CE2-CG 4.05Å; Y106-R110 WeakPolarHBondContact O-CB 3.35Å; Y106-R110 WeakPolarHBondContact O-CG 3.37Å; Y106-R110 PolarHBondContact O-N 3.27Å; Y107-R110 PolarHBondContact O-N 3.36Å; R110-S112 VanDerWaalsContact C-N 3.32Å; R110-S112 PolarHBondContact O-N 3.13Å; R110-H113 PolarHBondContact O-N 3.13Å; R110-E114 WeakPolarHBondContact O-CG 3.46Å; R110-E114 PolarHBondContact O-N 2.81Å
111I89Confident82.7Confident92 Ų9289.2 Ų89.247%0.47243%0.432SS..Hα-helixtrans-62.6-42178.8-66.9165000110.4Y107 H113 E114 V115Y107-I111 WeakPolarHBondContact O-CB 3.45Å; Y107-I111 VanDerWaalsContact O-CG1 3.26Å; Y107-I111 WeakPolarHBondContact O-CG1 3.42Å; Y107-I111 PolarHBondContact O-N 3.32Å; I111-H113 VanDerWaalsContact C-N 3.32Å; I111-H113 PolarHBondContact O-N 3.05Å; I111-E114 PolarHBondContact O-N 3.18Å; I111-V115 HydrophobicContact CG2-CG2 4.16Å; I111-V115 WeakPolarHBondContact O-CB 3.4Å; I111-V115 VanDerWaalsContact O-CG2 3.29Å; I111-V115 WeakPolarHBondContact O-CG2 3.29Å; I111-V115 PolarHBondContact O-N 2.79Å
112S85.7Confident80.7Confident51 Ų5193.7 Ų93.736%0.35746%0.459SS..Hα-helixtrans-58.8-46.5177.2-60.60000110.8L108 I109 R110 E114 V115 Y116L108-S112 VanDerWaalsContact O-CB 3.28Å; L108-S112 WeakPolarHBondContact O-CB 3.35Å; L108-S112 PolarHBondContact O-N 3.27Å; L108-S112 PolarHBondContact O-OG 3.49Å; I109-S112 PolarHBondContact O-N 3.27Å; R110-S112 VanDerWaalsContact C-N 3.32Å; R110-S112 PolarHBondContact O-N 3.13Å; S112-E114 PolarHBondContact O-N 3.23Å; S112-V115 PolarHBondContact O-N 3.01Å; S112-Y116 WeakPolarHBondContact O-CB 3.49Å; S112-Y116 WeakPolarHBondContact O-CD2 3.42Å; S112-Y116 PolarHBondContact O-N 3.22Å
113H82.4Confident78.7Confident104 Ų10494.4 Ų94.448%0.48147%0.467SS..Hα-helixtrans-62.9-43.2178.6-169.2-89.9000112.1I109 R110 I111 Q117I109-H113 WeakPolarHBondContact O-CB 3.05Å; I109-H113 PolarHBondContact O-N 3.26Å; R110-H113 PolarHBondContact O-N 3.13Å; I111-H113 VanDerWaalsContact C-N 3.32Å; I111-H113 PolarHBondContact O-N 3.05Å; H113-Q117 PolarHBondContact CD2-NE2 3.49Å; H113-Q117 PolarHBondContact CE1-NE2 3.35Å; H113-Q117 PolarHBondContact CE1-OE1 3.41Å; H113-Q117 PolarHBondContact ND1-OE1 3.08Å; H113-Q117 VanDerWaalsContact ND1-OE1 3.08Å; H113-Q117 PolarHBondContact NE2-NE2 2.98Å; H113-Q117 WeakPolarHBondContact O-CB 3.28Å; H113-Q117 VanDerWaalsContact O-CG 3.29Å; H113-Q117 WeakPolarHBondContact O-CG 3.43Å; H113-Q117 PolarHBondContact O-N 3.09Å
114E86.8Confident76.5Confident104 Ų10495.8 Ų95.849%0.48648%0.475SS..Hα-helixtrans-62.9-43.4177.3-72.2172-172.600112.1R110 I111 S112 S118R110-E114 WeakPolarHBondContact O-CG 3.46Å; R110-E114 PolarHBondContact O-N 2.81Å; I111-E114 PolarHBondContact O-N 3.18Å; S112-E114 PolarHBondContact O-N 3.23Å; E114-S118 WeakPolarHBondContact O-CB 3.4Å; E114-S118 PolarHBondContact O-N 3.22Å; E114-S118 PolarHBondContact O-OG 3.21Å
115V81.9Confident74.4Confident77 Ų7797.5 Ų97.547%0.46749%0.492SS..Hα-helixtrans-73.4-46.1-177.9173.80000111.6I111 S112 N119I111-V115 HydrophobicContact CG2-CG2 4.16Å; I111-V115 WeakPolarHBondContact O-CB 3.4Å; I111-V115 VanDerWaalsContact O-CG2 3.29Å; I111-V115 WeakPolarHBondContact O-CG2 3.29Å; I111-V115 PolarHBondContact O-N 2.79Å; S112-V115 PolarHBondContact O-N 3.01Å; V115-N119 PolarHBondContact O-N 3.05Å
116Y75.5Confident72.3Confident137 Ų137100.5 Ų100.554%0.53752%0.515SS..Hα-helixtrans-75.7-37.9-175.6-69.8-66.6000112.7S112 N119 E120S112-Y116 WeakPolarHBondContact O-CB 3.49Å; S112-Y116 WeakPolarHBondContact O-CD2 3.42Å; S112-Y116 PolarHBondContact O-N 3.22Å; Y116-N119 PolarHBondContact O-N 2.94Å; Y116-E120 PolarHBondContact O-N 3.22Å
117Q70.3Confident70.2Confident98 Ų9899 Ų9946%0.45852%0.523SS..Hα-helixtrans-69.9-36.4175.5-69.7-169.8-20.100112.8H113 N119 E120 Q121H113-Q117 PolarHBondContact CD2-NE2 3.49Å; H113-Q117 PolarHBondContact CE1-NE2 3.35Å; H113-Q117 PolarHBondContact CE1-OE1 3.41Å; H113-Q117 PolarHBondContact ND1-OE1 3.08Å; H113-Q117 VanDerWaalsContact ND1-OE1 3.08Å; H113-Q117 PolarHBondContact NE2-NE2 2.98Å; H113-Q117 WeakPolarHBondContact O-CB 3.28Å; H113-Q117 VanDerWaalsContact O-CG 3.29Å; H113-Q117 WeakPolarHBondContact O-CG 3.43Å; H113-Q117 PolarHBondContact O-N 3.09Å; Q117-N119 PolarHBondContact O-N 3.44Å; Q117-E120 PolarHBondContact O-N 3.46Å; Q117-Q121 PolarHBondContact O-N 3.47Å
118S61.2Low67.8Low69 Ų6997.9 Ų97.948%0.48354%0.535SS..Hα-helixtrans-61.3-37.1174.8-62.70000111.3E114 Q121 V122E114-S118 WeakPolarHBondContact O-CB 3.4Å; E114-S118 PolarHBondContact O-N 3.22Å; E114-S118 PolarHBondContact O-OG 3.21Å; S118-Q121 PolarHBondContact O-N 2.78Å; S118-V122 WeakPolarHBondContact O-CG2 3.24Å; S118-V122 PolarHBondContact O-N 3Å; S118-V122 VanDerWaalsContact O-N 3.13Å
119N58.5Low65.6Low101 Ų101106.8 Ų106.854%0.5457%0.565SS.*Hα-helixtrans-68.6-34.6177.7-96.725.2000113.5V115 Y116 Q117 Q121 V122 T123V115-N119 PolarHBondContact O-N 3.05Å; Y116-N119 PolarHBondContact O-N 2.94Å; Q117-N119 PolarHBondContact O-N 3.44Å; N119-Q121 VanDerWaalsContact C-N 3.31Å; N119-Q121 PolarHBondContact O-N 3.01Å; N119-V122 PolarHBondContact O-N 3.09Å; N119-T123 PolarHBondContact O-N 3.12Å; N119-T123 VanDerWaalsContact O-N 3.09Å; N119-T123 PolarHBondContact O-OG1 3.32Å
120E56.5Low63.1Low140 Ų140112.2 Ų112.265%0.65459%0.586SS**Hα-helixtrans-63.7-39.1174.4-69.7-175.4160.800111.4Y116 Q117 T123 T124Y116-E120 PolarHBondContact O-N 3.22Å; Q117-E120 PolarHBondContact O-N 3.46Å; E120-T123 PolarHBondContact O-N 3.27Å; E120-T124 WeakPolarHBondContact O-CG2 3.42Å; E120-T124 PolarHBondContact O-N 3.41Å; E120-T124 VanDerWaalsContact O-N 3.11Å; E120-T124 PolarHBondContact O-OG1 3.11Å
121Q50.6Low60.5Low148 Ų148115.9 Ų115.969%0.69261%0.605SS**Hα-helixtrans-72.6-34.2-179.7-155.5173.9-18.300112.8Q117 S118 N119 T124 S125Q117-Q121 PolarHBondContact O-N 3.47Å; S118-Q121 PolarHBondContact O-N 2.78Å; N119-Q121 VanDerWaalsContact C-N 3.31Å; N119-Q121 PolarHBondContact O-N 3.01Å; Q121-T124 WeakPolarHBondContact CA-OG1 3.48Å; Q121-T124 PolarHBondContact O-OG1 2.78Å; Q121-S125 PolarHBondContact O-N 3.26Å; Q121-S125 VanDerWaalsContact O-N 3.12Å; Q121-S125 PolarHBondContact O-OG 3.49Å
122V55.4Low57.9Low93 Ų93124.9 Ų124.956%0.56464%0.641SS**Hα-helixtrans-70-40.7174.8177.60000111.1S118 N119 T124 S125 S126S118-V122 WeakPolarHBondContact O-CG2 3.24Å; S118-V122 PolarHBondContact O-N 3Å; S118-V122 VanDerWaalsContact O-N 3.13Å; N119-V122 PolarHBondContact O-N 3.09Å; V122-T124 PolarHBondContact O-N 3.47Å; V122-S125 PolarHBondContact O-N 2.95Å; V122-S125 PolarHBondContact O-OG 3.38Å; V122-S126 PolarHBondContact O-N 3.48Å
123T53.6Low56.5Low97 Ų97128.6 Ų128.660%0.59566%0.655SS**Hα-helixtrans-64.4-42.3179.1-47.40000111.2N119 E120 S125 S126N119-T123 PolarHBondContact O-N 3.12Å; N119-T123 VanDerWaalsContact O-N 3.09Å; N119-T123 PolarHBondContact O-OG1 3.32Å; E120-T123 PolarHBondContact O-N 3.27Å; T123-S125 PolarHBondContact O-N 3.3Å; T123-S126 PolarHBondContact O-N 3.03Å; T123-S126 PolarHBondContact O-OG 3.5Å
124T52Low55.2Low97 Ų97129.9 Ų129.960%0.59566%0.664SS**Hα-helixtrans-66.6-36.3176.349.90000113.1E120 Q121 V122 S126 S127E120-T124 WeakPolarHBondContact O-CG2 3.42Å; E120-T124 PolarHBondContact O-N 3.41Å; E120-T124 VanDerWaalsContact O-N 3.11Å; E120-T124 PolarHBondContact O-OG1 3.11Å; Q121-T124 WeakPolarHBondContact CA-OG1 3.48Å; Q121-T124 PolarHBondContact O-OG1 2.78Å; V122-T124 PolarHBondContact O-N 3.47Å; T124-S126 VanDerWaalsContact C-N 3.34Å; T124-S126 PolarHBondContact O-N 2.91Å; T124-S127 PolarHBondContact O-N 3.21Å
125S50Low53.4Low84 Ų84131.3 Ų131.359%0.58767%0.674SS**Hα-helixtrans-69-27.3177.573.30000114.1Q121 V122 T123Q121-S125 PolarHBondContact O-N 3.26Å; Q121-S125 VanDerWaalsContact O-N 3.12Å; Q121-S125 PolarHBondContact O-OG 3.49Å; V122-S125 PolarHBondContact O-N 2.95Å; V122-S125 PolarHBondContact O-OG 3.38Å; T123-S125 PolarHBondContact O-N 3.3Å
126S50.6Low51.8Low89 Ų89134.5 Ų134.562%0.62269%0.686SS**Hα-helixtrans-77.1-20176.473.10000113.8V122 T123 T124 S128V122-S126 PolarHBondContact O-N 3.48Å; T123-S126 PolarHBondContact O-N 3.03Å; T123-S126 PolarHBondContact O-OG 3.5Å; T124-S126 VanDerWaalsContact C-N 3.34Å; T124-S126 PolarHBondContact O-N 2.91Å; S126-S128 VanDerWaalsContact C-N 3.34Å; S126-S128 PolarHBondContact O-N 3.48Å
127S48.7Very low50.3Low96 Ų96134.4 Ų134.467%0.67170%0.696SS**G310 helixtrans-77.8-14.9179-179.30000113.7T124 R129T124-S127 PolarHBondContact O-N 3.21Å; S127-R129 PolarHBondContact O-N 3.43Å
128S44.5Very low48.9Very low111 Ų111136.8 Ų136.878%0.77671%0.711SS**G310 helixtrans-861.1-172.8-126.60000114.9S126S126-S128 VanDerWaalsContact C-N 3.34Å; S126-S128 PolarHBondContact O-N 3.48Å
129R44.6Very low48.1Very low241 Ų241141.6 Ų141.691%0.90973%0.728SS**G310 helixtrans-98.620.2-178.1-145.3179.7-176.7172.51.5115.5S127S127-R129 PolarHBondContact O-N 3.43Å
130K37.8Very low47.3Very low198 Ų198144.8 Ų144.886%0.86174%0.742SS**SBendtrans-133.560.5175.8-141178.3-172.2-177.70112.6
131K34.5Very low46.5Very low207 Ų207145.2 Ų145.290%0.975%0.75SS**  trans-157.778.8162-131178-175.2-178.60111.6
132K35.6Very low46.1Very low281 Ų281144.9 Ų144.9100%1.22276%0.755SS**  trans-158.10151.5-137.6-177.7-177.8-1720107.9

Retrieved 132 of 132 residues in 27 ms (Link to these results)

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