G4VLI4_SCHMA Loading...

TLC domain-containing protein

AlphaFold DB , UniProt , Accession G4VLI4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 277 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M71.5Confident87.7Confident139 Ų13984.1 Ų84.169%0.68545%0.445SS*.  0-56.10-71160.8121.500111.8A3 V4 S5 S86 I91M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.24Å; M1-V4 WeakPolarHBondContact O-CB 3.35Å; M1-V4 PolarHBondContact O-N 3.31Å; M1-S5 PolarHBondContact O-N 2.89Å; M1-S5 VanDerWaalsContact O-N 3.08Å; M1-S5 PolarHBondContact O-OG 2.84Å; M1-S86 WeakPolarHBondContact CE-OG 3.32Å; M1-I91 HydrophobicContact CB-CD1 4.41Å; M1-I91 HydrophobicContact CE-CD1 3.46Å; M1-I91 VanDerWaalsContact CE-CD1 3.46Å; M1-I91 HydrophobicContact CG-CD1 4Å; M1-I91 HydrophobicContact SD-CD1 4.49Å
2F78.6Confident88.5Confident166 Ų16677.1 Ų77.173%0.72841%0.408SS*.Hα-helixtrans-52.7-41.9-179.6-171.1-95.4000115.2V4 S5 A6F2-V4 PolarHBondContact O-N 3.4Å; F2-S5 WeakPolarHBondContact CA-OG 3.3Å; F2-S5 PolarHBondContact O-N 3.48Å; F2-S5 PolarHBondContact O-OG 3.42Å; F2-A6 VanDerWaalsContact O-CB 3.32Å; F2-A6 WeakPolarHBondContact O-CB 3.35Å; F2-A6 PolarHBondContact O-N 3.5Å
3A80.5Confident89.2Confident76 Ų7674.5 Ų74.563%0.62840%0.397SS*.Hα-helixtrans-64.2-38.7177.700000112.8M1 F7M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.24Å; A3-F7 WeakPolarHBondContact O-CB 3.28Å; A3-F7 PolarHBondContact O-N 2.93Å
4V82.7Confident89.7Confident67 Ų6775.4 Ų75.441%0.40641%0.406SS..Hα-helixtrans-67.6-44.6178.4176.90000110.2M1 F2 F7 A8 S92M1-V4 WeakPolarHBondContact O-CB 3.35Å; M1-V4 PolarHBondContact O-N 3.31Å; F2-V4 PolarHBondContact O-N 3.4Å; V4-F7 PolarHBondContact O-N 3.31Å; V4-A8 WeakPolarHBondContact O-CB 3.46Å; V4-A8 PolarHBondContact O-N 3.27Å; V4-S92 VanDerWaalsContact CG1-OG 3.29Å; V4-S92 WeakPolarHBondContact CG1-OG 3.45Å
5S87.3Confident90.2Very high19 Ų1972.5 Ų72.513%0.13339%0.392CS..Hα-helixtrans-63.8-43.9176.552.40000112.1M1 F2 A8 L9 S95M1-S5 PolarHBondContact O-N 2.89Å; M1-S5 VanDerWaalsContact O-N 3.08Å; M1-S5 PolarHBondContact O-OG 2.84Å; F2-S5 WeakPolarHBondContact CA-OG 3.3Å; F2-S5 PolarHBondContact O-N 3.48Å; F2-S5 PolarHBondContact O-OG 3.42Å; S5-A8 PolarHBondContact O-N 3.25Å; S5-L9 VanDerWaalsContact O-CB 3.28Å; S5-L9 WeakPolarHBondContact O-CB 3.35Å; S5-L9 PolarHBondContact O-N 2.89Å; S5-S95 VanDerWaalsContact CA-OG 3.27Å; S5-S95 WeakPolarHBondContact CA-OG 3.41Å; S5-S95 WeakPolarHBondContact CB-OG 3.41Å; S5-S95 WeakPolarHBondContact O-CB 3.48Å
6A91.1Very high90.7Very high36 Ų3668 Ų6830%0.29837%0.368SS..Hα-helixtrans-63.4-44.6178.700000111.7F2 L9 L10F2-A6 VanDerWaalsContact O-CB 3.32Å; F2-A6 WeakPolarHBondContact O-CB 3.35Å; F2-A6 PolarHBondContact O-N 3.5Å; A6-L9 PolarHBondContact O-N 3.08Å; A6-L10 WeakPolarHBondContact O-CB 3.49Å; A6-L10 VanDerWaalsContact O-CG 3.32Å; A6-L10 WeakPolarHBondContact O-CG 3.3Å; A6-L10 PolarHBondContact O-N 3.5Å
7F93.5Very high91.1Very high149 Ų14965.8 Ų65.865%0.65436%0.361SS*.Hα-helixtrans-61-49.3175.9178.3-96.2000111.7A3 V4 L9 L10 F11A3-F7 WeakPolarHBondContact O-CB 3.28Å; A3-F7 PolarHBondContact O-N 2.93Å; V4-F7 PolarHBondContact O-N 3.31Å; F7-L9 VanDerWaalsContact C-N 3.32Å; F7-L9 PolarHBondContact O-N 3.39Å; F7-L10 PolarHBondContact O-N 3.42Å; F7-F11 WeakPolarHBondContact O-CB 3.34Å; F7-F11 PolarHBondContact O-N 3.35Å
8A94Very high91.4Very high9 Ų967.5 Ų67.57%0.07437%0.369CS..Hα-helixtrans-62.5-37.9-179.900000112.7V4 S5 S12V4-A8 WeakPolarHBondContact O-CB 3.46Å; V4-A8 PolarHBondContact O-N 3.27Å; S5-A8 PolarHBondContact O-N 3.25Å; A8-S12 WeakPolarHBondContact O-CB 3.45Å; A8-S12 PolarHBondContact O-N 2.85Å
9L94.7Very high91.8Very high42 Ų4265.4 Ų65.422%0.2236%0.358CS..Hα-helixtrans-66.1-52176.3-172.6159.1000111.3S5 A6 F7 F11 S12 V13 L98 I102S5-L9 VanDerWaalsContact O-CB 3.28Å; S5-L9 WeakPolarHBondContact O-CB 3.35Å; S5-L9 PolarHBondContact O-N 2.89Å; A6-L9 PolarHBondContact O-N 3.08Å; F7-L9 VanDerWaalsContact C-N 3.32Å; F7-L9 PolarHBondContact O-N 3.39Å; L9-F11 VanDerWaalsContact C-N 3.34Å; L9-F11 PolarHBondContact O-N 2.91Å; L9-S12 WeakPolarHBondContact O-CB 3.27Å; L9-S12 PolarHBondContact O-N 3.35Å; L9-V13 HydrophobicContact CD2-CG2 4.26Å; L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.41Å; L9-L98 HydrophobicContact CD1-CD2 4.01Å; L9-L98 HydrophobicContact CD1-CG 4.2Å; L9-I102 HydrophobicContact CD1-CD1 4.25Å; L9-I102 HydrophobicContact CD2-CD1 4.45Å
10L95.1Very high92Very high114 Ų11463.3 Ų63.360%0.59735%0.347SS*.Hα-helixtrans-62.2-42.9179-70.7174.2000111.5A6 F7 S12 V13 V14A6-L10 WeakPolarHBondContact O-CB 3.49Å; A6-L10 VanDerWaalsContact O-CG 3.32Å; A6-L10 WeakPolarHBondContact O-CG 3.3Å; A6-L10 PolarHBondContact O-N 3.5Å; F7-L10 PolarHBondContact O-N 3.42Å; L10-S12 VanDerWaalsContact C-N 3.32Å; L10-S12 PolarHBondContact O-N 2.84Å; L10-V13 PolarHBondContact O-N 3.07Å; L10-V14 WeakPolarHBondContact O-CG2 3.36Å; L10-V14 PolarHBondContact O-N 3.11Å
11F96.1Very high92.2Very high108 Ų10867.4 Ų67.447%0.47436%0.361SS..Hα-helixtrans-56.7-46.8174.1175.5-102.9000111.2F7 L9 V13 V14 V15 Y96F7-F11 WeakPolarHBondContact O-CB 3.34Å; F7-F11 PolarHBondContact O-N 3.35Å; L9-F11 VanDerWaalsContact C-N 3.34Å; L9-F11 PolarHBondContact O-N 2.91Å; F11-V13 PolarHBondContact O-N 3.22Å; F11-V14 PolarHBondContact O-N 3.11Å; F11-V15 HydrophobicContact CD1-CG2 4.15Å; F11-V15 HydrophobicContact CD2-CG2 4.13Å; F11-V15 HydrophobicContact CE1-CG2 3.72Å; F11-V15 HydrophobicContact CE2-CG2 3.7Å; F11-V15 HydrophobicContact CG-CG2 4.35Å; F11-V15 HydrophobicContact CZ-CG2 3.48Å; F11-V15 VanDerWaalsContact CZ-CG2 3.48Å; F11-V15 WeakPolarHBondContact O-CB 3.26Å; F11-V15 VanDerWaalsContact O-CG2 3.32Å; F11-V15 WeakPolarHBondContact O-CG2 3.28Å; F11-V15 PolarHBondContact O-N 3.44Å; F11-Y96 HydrophobicContact CD1-CD2 4.37Å; F11-Y96 HydrophobicContact CD1-CE2 4.48Å; F11-Y96 HydrophobicContact CE1-CE2 4.45Å
12S97.1Very high93.4Very high0 Ų065.4 Ų65.40%035%0.352CS..Hα-helixtrans-59.1-45.7176.9-177.40000112.5A8 L9 L10 V14 V15 H16 Y96 Y100A8-S12 WeakPolarHBondContact O-CB 3.45Å; A8-S12 PolarHBondContact O-N 2.85Å; L9-S12 WeakPolarHBondContact O-CB 3.27Å; L9-S12 PolarHBondContact O-N 3.35Å; L10-S12 VanDerWaalsContact C-N 3.32Å; L10-S12 PolarHBondContact O-N 2.84Å; S12-V14 VanDerWaalsContact C-N 3.33Å; S12-V14 PolarHBondContact O-N 3.08Å; S12-V15 PolarHBondContact O-N 2.92Å; S12-H16 PolarHBondContact O-N 3.5Å; S12-H16 PolarHBondContact O-ND1 3.34Å; S12-H16 PolarHBondContact OG-CE1 3.47Å; S12-H16 VanDerWaalsContact OG-CE1 3.32Å; S12-H16 PolarHBondContact OG-ND1 2.92Å; S12-Y96 WeakPolarHBondContact CB-O 3.43Å; S12-Y96 PolarHBondContact OG-O 3.33Å; S12-Y100 PolarHBondContact OG-N 2.91Å
13V96.7Very high94.3Very high44 Ų4457.8 Ų57.827%0.26732%0.32SS..Hα-helixtrans-60.1-44.4177.9174.20000111L9 L10 F11 A17 G99 F103L9-V13 HydrophobicContact CD2-CG2 4.26Å; L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.41Å; L10-V13 PolarHBondContact O-N 3.07Å; F11-V13 PolarHBondContact O-N 3.22Å; V13-A17 VanDerWaalsContact O-CB 3.3Å; V13-A17 WeakPolarHBondContact O-CB 3.33Å; V13-A17 PolarHBondContact O-N 2.93Å; V13-G99 WeakPolarHBondContact CG2-O 3.3Å; V13-F103 HydrophobicContact CG1-CD2 4.48Å
14V96.9Very high95Very high86 Ų8659.8 Ų59.852%0.52131%0.314SS..Hα-helixtrans-64.3-46.8178.5173.50000111.2L10 F11 S12 H16 A17 L18L10-V14 WeakPolarHBondContact O-CG2 3.36Å; L10-V14 PolarHBondContact O-N 3.11Å; F11-V14 PolarHBondContact O-N 3.11Å; S12-V14 VanDerWaalsContact C-N 3.33Å; S12-V14 PolarHBondContact O-N 3.08Å; V14-H16 PolarHBondContact O-N 3.25Å; V14-A17 PolarHBondContact O-N 2.74Å; V14-L18 HydrophobicContact CG1-CD1 4.16Å; V14-L18 WeakPolarHBondContact O-CG 3.2Å; V14-L18 PolarHBondContact O-N 3.08Å
15V97.5Very high95.6Very high33 Ų3360.7 Ų60.720%0.232%0.323CS..Hα-helixtrans-59.2-49178.7168.10000110.9F11 S12 A17 L18 V19F11-V15 HydrophobicContact CD1-CG2 4.15Å; F11-V15 HydrophobicContact CD2-CG2 4.13Å; F11-V15 HydrophobicContact CE1-CG2 3.72Å; F11-V15 HydrophobicContact CE2-CG2 3.7Å; F11-V15 HydrophobicContact CG-CG2 4.35Å; F11-V15 HydrophobicContact CZ-CG2 3.48Å; F11-V15 VanDerWaalsContact CZ-CG2 3.48Å; F11-V15 WeakPolarHBondContact O-CB 3.26Å; F11-V15 VanDerWaalsContact O-CG2 3.32Å; F11-V15 WeakPolarHBondContact O-CG2 3.28Å; F11-V15 PolarHBondContact O-N 3.44Å; S12-V15 PolarHBondContact O-N 2.92Å; V15-A17 VanDerWaalsContact C-N 3.33Å; V15-A17 PolarHBondContact O-N 3.08Å; V15-L18 WeakPolarHBondContact O-CB 3.49Å; V15-L18 PolarHBondContact O-N 3.39Å; V15-L18 VanDerWaalsContact O-N 3.15Å; V15-V19 HydrophobicContact CG1-CG2 4.38Å; V15-V19 WeakPolarHBondContact O-CG2 3.5Å; V15-V19 PolarHBondContact O-N 2.89Å
16H97.8Very high96Very high0 Ų065.4 Ų65.40%035%0.346CS..Hα-helixtrans-68-32.8-179.2-68.996.6000112.4S12 V14 V19 D20 V56 H60 Y96 Y100 F103S12-H16 PolarHBondContact O-N 3.5Å; S12-H16 PolarHBondContact O-ND1 3.34Å; S12-H16 PolarHBondContact OG-CE1 3.47Å; S12-H16 VanDerWaalsContact OG-CE1 3.32Å; S12-H16 PolarHBondContact OG-ND1 2.92Å; V14-H16 PolarHBondContact O-N 3.25Å; H16-V19 PolarHBondContact O-N 2.89Å; H16-D20 WeakPolarHBondContact O-CB 3.35Å; H16-D20 PolarHBondContact O-N 3.27Å; H16-V56 HydrophobicContact CB-CG1 3.96Å; H16-H60 WeakPolarHBondContact NE2-CB 3.49Å; H16-Y96 AromaticContact CE1-CE1 4Å; H16-Y96 AromaticContact CE1-CZ 3.53Å; H16-Y96 PolarHBondContact CE1-OH 3.45Å; H16-Y96 VanDerWaalsContact CE1-OH 3.24Å; H16-Y100 AromaticContact CD2-CD2 3.62Å; H16-Y100 AromaticContact NE2-CD2 3.68Å; H16-F103 HydrophobicContact CB-CD1 3.7Å; H16-F103 HydrophobicContact CB-CE1 4.05Å; H16-F103 HydrophobicContact CB-CG 3.98Å
17A96.8Very high96.2Very high31 Ų3164 Ų6426%0.25633%0.333SS..Hα-helixtrans-66.1-35.7171.500000112.9V13 V14 V15 K21 F103V13-A17 VanDerWaalsContact O-CB 3.3Å; V13-A17 WeakPolarHBondContact O-CB 3.33Å; V13-A17 PolarHBondContact O-N 2.93Å; V14-A17 PolarHBondContact O-N 2.74Å; V15-A17 VanDerWaalsContact C-N 3.33Å; V15-A17 PolarHBondContact O-N 3.08Å; A17-K21 WeakPolarHBondContact O-CG 3.39Å; A17-K21 PolarHBondContact O-N 3.25Å; A17-F103 HydrophobicContact CB-CD2 4.34Å; A17-F103 HydrophobicContact CB-CE2 3.7Å; A17-F103 HydrophobicContact CB-CZ 4.38Å
18L97.5Very high96.3Very high96 Ų9660.3 Ų60.350%0.50332%0.324SS..Hα-helixtrans-69-45.1173.3-70173.1000111.2V14 V15 D20 K21 I22V14-L18 HydrophobicContact CG1-CD1 4.16Å; V14-L18 WeakPolarHBondContact O-CG 3.2Å; V14-L18 PolarHBondContact O-N 3.08Å; V15-L18 WeakPolarHBondContact O-CB 3.49Å; V15-L18 PolarHBondContact O-N 3.39Å; V15-L18 VanDerWaalsContact O-N 3.15Å; L18-D20 VanDerWaalsContact C-N 3.29Å; L18-D20 PolarHBondContact O-N 3.04Å; L18-K21 PolarHBondContact O-N 2.91Å; L18-I22 WeakPolarHBondContact O-CB 3.44Å; L18-I22 VanDerWaalsContact O-CG1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.88Å
19V97.7Very high96.4Very high27 Ų2762.2 Ų62.216%0.16433%0.331CS..Hα-helixtrans-58.7-42.6175.5172.20000110.6V15 H16 I22 A23 V56 V59V15-V19 HydrophobicContact CG1-CG2 4.38Å; V15-V19 WeakPolarHBondContact O-CG2 3.5Å; V15-V19 PolarHBondContact O-N 2.89Å; H16-V19 PolarHBondContact O-N 2.89Å; V19-I22 PolarHBondContact O-N 2.69Å; V19-A23 WeakPolarHBondContact O-CB 3.24Å; V19-A23 PolarHBondContact O-N 3.4Å; V19-V56 HydrophobicContact CB-CG2 4.48Å; V19-V56 HydrophobicContact CG1-CG2 4.01Å; V19-V59 HydrophobicContact CG1-CB 4.39Å; V19-V59 HydrophobicContact CG1-CG2 3.89Å; V19-V59 HydrophobicContact CG2-CB 4.48Å; V19-V59 HydrophobicContact CG2-CG1 4.2Å; V19-V59 HydrophobicContact CG2-CG2 4.23Å
20D96.5Very high96.4Very high24 Ų2466.1 Ų66.113%0.12834%0.343CS..Hα-helixtrans-58.6-48.8176.5179.160.7000112.3H16 L18 I22 A23 K24 Q52 V56 F103 H107H16-D20 WeakPolarHBondContact O-CB 3.35Å; H16-D20 PolarHBondContact O-N 3.27Å; L18-D20 VanDerWaalsContact C-N 3.29Å; L18-D20 PolarHBondContact O-N 3.04Å; D20-I22 PolarHBondContact O-N 3.39Å; D20-A23 PolarHBondContact O-N 2.98Å; D20-K24 WeakPolarHBondContact O-CB 3.36Å; D20-K24 PolarHBondContact O-N 2.84Å; D20-Q52 VanDerWaalsContact CG-NE2 3.3Å; D20-Q52 WeakPolarHBondContact OD1-CB 3.32Å; D20-Q52 PolarHBondContact OD1-NE2 3.22Å; D20-Q52 PolarHBondContact OD2-NE2 2.77Å; D20-V56 HydrophobicContact CB-CG2 3.86Å; D20-F103 HydrophobicContact CB-CE1 4.34Å; D20-F103 HydrophobicContact CB-CZ 3.82Å; D20-H107 IonicContact OD1-CE1 2.77Å; D20-H107 IonicContact OD1-NE2 3.21Å; D20-H107 PolarHBondContact OD1-NE2 3.49Å
21K96.4Very high96.3Very high150 Ų15067.6 Ų67.665%0.65235%0.347SS*.Hα-helixtrans-61.7-43.5176.9-72.7179.4-178.6-1790112.2A17 L18 K24 C25A17-K21 WeakPolarHBondContact O-CG 3.39Å; A17-K21 PolarHBondContact O-N 3.25Å; L18-K21 PolarHBondContact O-N 2.91Å; K21-K24 PolarHBondContact O-N 2.91Å; K21-C25 PolarHBondContact O-N 3.39Å; K21-C25 VanDerWaalsContact O-N 3.13Å
22I97.7Very high96.3Very high97 Ų9767.5 Ų67.550%0.49735%0.347SS..Hα-helixtrans-64.4-46.2177.3-69167.3000109.9L18 V19 D20 K24 C25 L26L18-I22 WeakPolarHBondContact O-CB 3.44Å; L18-I22 VanDerWaalsContact O-CG1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 2.88Å; V19-I22 PolarHBondContact O-N 2.69Å; D20-I22 PolarHBondContact O-N 3.39Å; I22-K24 VanDerWaalsContact C-N 3.3Å; I22-K24 PolarHBondContact O-N 3.22Å; I22-C25 WeakPolarHBondContact O-CA 3.39Å; I22-C25 WeakPolarHBondContact O-CB 3.38Å; I22-C25 PolarHBondContact O-N 3.2Å; I22-L26 HydrophobicContact CG2-CD1 3.53Å; I22-L26 HydrophobicContact CG2-CG 4.04Å; I22-L26 WeakPolarHBondContact O-CB 2.95Å; I22-L26 WeakPolarHBondContact O-CG 3.08Å; I22-L26 PolarHBondContact O-N 3.28Å
23A96.7Very high96.2Very high6 Ų667.7 Ų67.75%0.0535%0.349CS..Hα-helixtrans-59.3-41.8178.500000111.4V19 D20 C25 L26 N27 W51 Q52 C55V19-A23 WeakPolarHBondContact O-CB 3.24Å; V19-A23 PolarHBondContact O-N 3.4Å; D20-A23 PolarHBondContact O-N 2.98Å; A23-C25 VanDerWaalsContact C-N 3.32Å; A23-C25 PolarHBondContact O-N 2.93Å; A23-L26 CarbonylContact O-C 3.41Å; A23-L26 PolarHBondContact O-N 2.96Å; A23-N27 PolarHBondContact O-N 3.47Å; A23-W51 PolarHBondContact O-NE1 3.16Å; A23-Q52 HydrophobicContact CB-CG 4.41Å; A23-C55 HydrophobicContact CB-CB 3.63Å
24K94.6Very high96Very high117 Ų11769 Ų6951%0.50936%0.36SS..Hα-helixtrans-60.2-40.7173.9-169.3176-177.4175.60112.5D20 K21 I22 Q52D20-K24 WeakPolarHBondContact O-CB 3.36Å; D20-K24 PolarHBondContact O-N 2.84Å; K21-K24 PolarHBondContact O-N 2.91Å; I22-K24 VanDerWaalsContact C-N 3.3Å; I22-K24 PolarHBondContact O-N 3.22Å; K24-Q52 HydrophobicContact CB-CG 4.2Å
25C95.6Very high96Very high86 Ų8668.9 Ų68.958%0.58137%0.368SS*.Hα-helixtrans-68.7-42.5177.3-168.40000111.8K21 I22 A23 N27K21-C25 PolarHBondContact O-N 3.39Å; K21-C25 VanDerWaalsContact O-N 3.13Å; I22-C25 WeakPolarHBondContact O-CA 3.39Å; I22-C25 WeakPolarHBondContact O-CB 3.38Å; I22-C25 PolarHBondContact O-N 3.2Å; A23-C25 VanDerWaalsContact C-N 3.32Å; A23-C25 PolarHBondContact O-N 2.93Å; C25-N27 VanDerWaalsContact C-N 3.26Å; C25-N27 PolarHBondContact O-N 3.5Å
26L95.3Very high95.8Very high118 Ų11869.7 Ų69.762%0.61837%0.371SS*.THydrogen-bonded Turntrans-83.810.6-178.4-62.9-178.3000113.8I22 A23 P28I22-L26 HydrophobicContact CG2-CD1 3.53Å; I22-L26 HydrophobicContact CG2-CG 4.04Å; I22-L26 WeakPolarHBondContact O-CB 2.95Å; I22-L26 WeakPolarHBondContact O-CG 3.08Å; I22-L26 PolarHBondContact O-N 3.28Å; A23-L26 CarbonylContact O-C 3.41Å; A23-L26 PolarHBondContact O-N 2.96Å; L26-P28 VanDerWaalsContact O-CD 3.25Å; L26-P28 WeakPolarHBondContact O-CD 3.49Å
27N96.2Very high95.6Very high6 Ų674.1 Ų74.13%0.03239%0.391CS..  trans-65.4115.9176.4-172.4-16.6000109.3A23 C25 F29 R30 L33 N48 W51 Y165A23-N27 PolarHBondContact O-N 3.47Å; C25-N27 VanDerWaalsContact C-N 3.26Å; C25-N27 PolarHBondContact O-N 3.5Å; N27-F29 PolarHBondContact O-N 3Å; N27-F29 PolarHBondContact OD1-N 3.38Å; N27-R30 HydrophobicContact CB-CB 4.32Å; N27-R30 WeakPolarHBondContact O-CB 3.47Å; N27-R30 PolarHBondContact O-N 2.9Å; N27-L33 WeakPolarHBondContact ND2-CD1 3.37Å; N27-N48 PolarHBondContact ND2-OD1 3.49Å; N27-W51 HydrophobicContact CB-CG 4.4Å; N27-Y165 PolarHBondContact ND2-OH 2.79Å; N27-Y165 PolarHBondContact OD1-OH 3.33Å; N27-Y165 VanDerWaalsContact OD1-OH 3.05Å
28P95Very high95.5Very high72 Ų7281.6 Ų81.647%0.46842%0.421SS..THydrogen-bonded Turntrans-65.2-24.5-17522.8-30.8000112.9L26 R30 L166L26-P28 VanDerWaalsContact O-CD 3.25Å; L26-P28 WeakPolarHBondContact O-CD 3.49Å; P28-R30 VanDerWaalsContact C-N 3.34Å; P28-L166 HydrophobicContact CB-CD2 4.42Å; P28-L166 HydrophobicContact CG-CD2 3.38Å
29F95.6Very high95.4Very high50 Ų5080.8 Ų80.822%0.21943%0.429CS..THydrogen-bonded Turntrans-94.313.3176.7-54.8-68.7000112.6N27 H31 E32 L33 Y165 H167N27-F29 PolarHBondContact O-N 3Å; N27-F29 PolarHBondContact OD1-N 3.38Å; F29-H31 VanDerWaalsContact C-N 3.31Å; F29-H31 PolarHBondContact O-N 3.49Å; F29-E32 PolarHBondContact O-N 3.05Å; F29-L33 HydrophobicContact CB-CD1 4.13Å; F29-L33 HydrophobicContact CB-CG 4.14Å; F29-L33 VanDerWaalsContact O-CB 3.28Å; F29-L33 WeakPolarHBondContact O-CB 3.34Å; F29-L33 WeakPolarHBondContact O-CG 3.17Å; F29-L33 PolarHBondContact O-N 3.42Å; F29-Y165 HydrophobicContact CD2-CD1 4.32Å; F29-Y165 AromaticContact CD2-CE1 3.59Å; F29-Y165 HydrophobicContact CD2-CE1 3.59Å; F29-Y165 AromaticContact CD2-CZ 3.97Å; F29-Y165 HydrophobicContact CE2-CD1 4.15Å; F29-Y165 AromaticContact CE2-CE1 3.88Å; F29-Y165 HydrophobicContact CE2-CE1 3.88Å; F29-Y165 WeakPolarHBondContact CE2-O 3.19Å; F29-H167 AromaticContact CZ-CE1 3.94Å; F29-H167 AromaticContact CZ-ND1 3.58Å
30R94.9Very high95.2Very high123 Ų12385.5 Ų85.546%0.46445%0.447SS..Hα-helixtrans-51.4-45.5-176176.2177.2-177.7-101.7-1.4113.3N27 P28 S34N27-R30 HydrophobicContact CB-CB 4.32Å; N27-R30 WeakPolarHBondContact O-CB 3.47Å; N27-R30 PolarHBondContact O-N 2.9Å; P28-R30 VanDerWaalsContact C-N 3.34Å; R30-S34 WeakPolarHBondContact O-CB 3.12Å; R30-S34 PolarHBondContact O-N 2.92Å; R30-S34 PolarHBondContact O-OG 3.36Å
31H94.5Very high95Very high146 Ų14687.5 Ų87.568%0.67646%0.461SS*.Hα-helixtrans-70.1-44.5-178-71.1-76.6000112.2F29 L33 S34 A35F29-H31 VanDerWaalsContact C-N 3.31Å; F29-H31 PolarHBondContact O-N 3.49Å; H31-L33 VanDerWaalsContact C-N 3.33Å; H31-L33 PolarHBondContact O-N 3.35Å; H31-S34 PolarHBondContact O-N 3.19Å; H31-A35 PolarHBondContact O-N 3.24Å
32E94.7Very high94.7Very high105 Ų10587.6 Ų87.649%0.49146%0.462SS..Hα-helixtrans-61.4-42.6175.2-176.9-175165.200111.8F29 A35 N36F29-E32 PolarHBondContact O-N 3.05Å; E32-A35 PolarHBondContact O-N 3.29Å; E32-N36 PolarHBondContact O-N 3.33Å; E32-N36 VanDerWaalsContact O-N 3.11Å; E32-N36 PolarHBondContact O-ND2 3.27Å
33L94.8Very high94.4Very high5 Ų587.8 Ų87.83%0.02646%0.457CS..Hα-helixtrans-65.4-39.9176.2-71.6175.8000111.6N27 F29 H31 N36 Q37 Y43 V44 Q47N27-L33 WeakPolarHBondContact ND2-CD1 3.37Å; F29-L33 HydrophobicContact CB-CD1 4.13Å; F29-L33 HydrophobicContact CB-CG 4.14Å; F29-L33 VanDerWaalsContact O-CB 3.28Å; F29-L33 WeakPolarHBondContact O-CB 3.34Å; F29-L33 WeakPolarHBondContact O-CG 3.17Å; F29-L33 PolarHBondContact O-N 3.42Å; H31-L33 VanDerWaalsContact C-N 3.33Å; H31-L33 PolarHBondContact O-N 3.35Å; L33-N36 CarbonylContact O-C 3.57Å; L33-N36 PolarHBondContact O-N 3.3Å; L33-Q37 PolarHBondContact O-N 3.02Å; L33-Q37 VanDerWaalsContact O-N 3.07Å; L33-Y43 HydrophobicContact CD2-CD1 4.41Å; L33-Y43 HydrophobicContact CD2-CE1 3.88Å; L33-V44 HydrophobicContact CB-CG1 3.85Å; L33-V44 HydrophobicContact CB-CG2 4.47Å; L33-V44 HydrophobicContact CD2-CB 4.4Å; L33-V44 HydrophobicContact CD2-CG1 4.25Å; L33-V44 HydrophobicContact CD2-CG2 4.11Å; L33-V44 VanDerWaalsContact O-CG2 3.26Å; L33-V44 WeakPolarHBondContact O-CG2 3.34Å; L33-Q47 HydrophobicContact CD1-CB 4Å; L33-Q47 HydrophobicContact CD2-CB 3.74Å; L33-Q47 HydrophobicContact CD2-CG 3.97Å
34S94.1Very high94.2Very high72 Ų7287.5 Ų87.550%0.50346%0.455SS..Hα-helixtrans-64.6-40.3176.5-58.20000111.6R30 H31 N36 Q37R30-S34 WeakPolarHBondContact O-CB 3.12Å; R30-S34 PolarHBondContact O-N 2.92Å; R30-S34 PolarHBondContact O-OG 3.36Å; H31-S34 PolarHBondContact O-N 3.19Å; S34-N36 VanDerWaalsContact C-N 3.27Å; S34-N36 PolarHBondContact O-N 3.04Å; S34-Q37 VanDerWaalsContact O-CB 3.3Å; S34-Q37 WeakPolarHBondContact O-CB 3.32Å; S34-Q37 PolarHBondContact O-N 3.29Å
35A95.7Very high94Very high83 Ų8385.9 Ų85.969%0.68645%0.449SS*.Hα-helixtrans-65.1-30.7175.500000112.8H31 E32H31-A35 PolarHBondContact O-N 3.24Å; E32-A35 PolarHBondContact O-N 3.29Å
36N94Very high93.8Very high50 Ų5086.3 Ų86.327%0.26744%0.438SS..THydrogen-bonded Turntrans-91.51.7178.4-75-63.4000114.1E32 L33 S34 E38 A39 K40 V44E32-N36 PolarHBondContact O-N 3.33Å; E32-N36 VanDerWaalsContact O-N 3.11Å; E32-N36 PolarHBondContact O-ND2 3.27Å; L33-N36 CarbonylContact O-C 3.57Å; L33-N36 PolarHBondContact O-N 3.3Å; S34-N36 VanDerWaalsContact C-N 3.27Å; S34-N36 PolarHBondContact O-N 3.04Å; N36-E38 PolarHBondContact O-N 3.29Å; N36-A39 PolarHBondContact O-N 3.21Å; N36-K40 PolarHBondContact O-N 2.97Å; N36-V44 HydrophobicContact CB-CG2 4.01Å
37Q94.1Very high93.7Very high92 Ų9282.1 Ų82.143%0.4342%0.415SS..THydrogen-bonded Turntrans-61.5-43.3-172.6179.962.225.300112.5L33 S34 P41L33-Q37 PolarHBondContact O-N 3.02Å; L33-Q37 VanDerWaalsContact O-N 3.07Å; S34-Q37 VanDerWaalsContact O-CB 3.3Å; S34-Q37 WeakPolarHBondContact O-CB 3.32Å; S34-Q37 PolarHBondContact O-N 3.29Å; Q37-P41 VanDerWaalsContact O-CA 3.3Å; Q37-P41 WeakPolarHBondContact O-CA 3.41Å; Q37-P41 WeakPolarHBondContact O-CB 3.28Å; Q37-P41 WeakPolarHBondContact O-CD 3.42Å
38E93.4Very high93.5Very high188 Ų18883.3 Ų83.388%0.87942%0.422SS*.THydrogen-bonded Turntrans-73-43.6-179.9-64.9-177.1175.700111.6N36N36-E38 PolarHBondContact O-N 3.29Å
39A95.2Very high93.4Very high80 Ų8080.2 Ų80.266%0.66140%0.401SS*.THydrogen-bonded Turntrans-72.9-36.3-17700000113.1N36N36-A39 PolarHBondContact O-N 3.21Å
40K94.3Very high93.3Very high125 Ų12579.2 Ų79.254%0.54340%0.397SS..  trans-140.761.4-172.7-58.5-175.5-177.5174.70112.5N36 K42 Y43 V44N36-K40 PolarHBondContact O-N 2.97Å; K40-K42 PolarHBondContact O-N 2.98Å; K40-Y43 WeakPolarHBondContact O-CB 3.47Å; K40-Y43 PolarHBondContact O-N 3.43Å; K40-Y43 VanDerWaalsContact O-N 3.11Å; K40-V44 PolarHBondContact O-N 3.05Å; K40-V44 VanDerWaalsContact O-N 3.08Å
41P92.2Very high93.3Very high66 Ų6674.6 Ų74.643%0.42938%0.38SS..Hα-helixtrans-59.2-40.9-172.721.7-33.5000113.5Q37 Y43 V44 Q45Q37-P41 VanDerWaalsContact O-CA 3.3Å; Q37-P41 WeakPolarHBondContact O-CA 3.41Å; Q37-P41 WeakPolarHBondContact O-CB 3.28Å; Q37-P41 WeakPolarHBondContact O-CD 3.42Å; P41-Y43 PolarHBondContact O-N 3.47Å; P41-V44 PolarHBondContact O-N 2.99Å; P41-Q45 WeakPolarHBondContact O-CB 3.29Å; P41-Q45 PolarHBondContact O-N 3.24Å
42K90.7Very high93.3Very high153 Ų15368.1 Ų68.167%0.66535%0.35SS*.Hα-helixtrans-66-36.7179-67.7-175.4178.8179.60112.9K40 R46K40-K42 PolarHBondContact O-N 2.98Å; K42-R46 WeakPolarHBondContact O-CB 3.22Å; K42-R46 PolarHBondContact O-N 3.13Å; K42-R46 VanDerWaalsContact O-N 3.08Å
43Y90.6Very high93.3Very high100 Ų10063.2 Ų63.239%0.39233%0.327SS..Hα-helixtrans-66.2-46.5175.4167.1-94.4000110.2L33 K40 P41 Q45 R46 Q47L33-Y43 HydrophobicContact CD2-CD1 4.41Å; L33-Y43 HydrophobicContact CD2-CE1 3.88Å; K40-Y43 WeakPolarHBondContact O-CB 3.47Å; K40-Y43 PolarHBondContact O-N 3.43Å; K40-Y43 VanDerWaalsContact O-N 3.11Å; P41-Y43 PolarHBondContact O-N 3.47Å; Y43-Q45 PolarHBondContact O-N 2.89Å; Y43-R46 WeakPolarHBondContact O-CB 3.46Å; Y43-R46 PolarHBondContact O-N 3.21Å; Y43-Q47 HydrophobicContact CD1-CG 4.37Å; Y43-Q47 HydrophobicContact CD2-CG 4.34Å; Y43-Q47 HydrophobicContact CE1-CG 3.91Å; Y43-Q47 HydrophobicContact CE2-CG 3.91Å; Y43-Q47 VanDerWaalsContact CE2-NE2 3.3Å; Y43-Q47 WeakPolarHBondContact O-CG 3.39Å; Y43-Q47 PolarHBondContact O-N 3.02Å
44V92.5Very high93.3Very high1 Ų163 Ų631%0.00633%0.327CS..Hα-helixtrans-63.4-44.8-179.5175.50000111.6L33 N36 K40 P41 R46 Q47 N48L33-V44 HydrophobicContact CB-CG1 3.85Å; L33-V44 HydrophobicContact CB-CG2 4.47Å; L33-V44 HydrophobicContact CD2-CB 4.4Å; L33-V44 HydrophobicContact CD2-CG1 4.25Å; L33-V44 HydrophobicContact CD2-CG2 4.11Å; L33-V44 VanDerWaalsContact O-CG2 3.26Å; L33-V44 WeakPolarHBondContact O-CG2 3.34Å; N36-V44 HydrophobicContact CB-CG2 4.01Å; K40-V44 PolarHBondContact O-N 3.05Å; K40-V44 VanDerWaalsContact O-N 3.08Å; P41-V44 PolarHBondContact O-N 2.99Å; V44-R46 VanDerWaalsContact C-N 3.3Å; V44-R46 PolarHBondContact O-N 3.05Å; V44-Q47 PolarHBondContact O-N 3.3Å; V44-N48 WeakPolarHBondContact CG1-ND2 3.47Å; V44-N48 WeakPolarHBondContact O-CB 3.44Å; V44-N48 PolarHBondContact O-N 3.46Å; V44-N48 PolarHBondContact O-ND2 3.29Å
45Q91.3Very high93.5Very high83 Ų8360.9 Ų60.939%0.38831%0.311SS..Hα-helixtrans-56.8-44.7174.2-175.2178.725.400111.6P41 Y43 F49 L111P41-Q45 WeakPolarHBondContact O-CB 3.29Å; P41-Q45 PolarHBondContact O-N 3.24Å; Y43-Q45 PolarHBondContact O-N 2.89Å; Q45-F49 WeakPolarHBondContact O-CB 3.41Å; Q45-F49 PolarHBondContact O-N 3.47Å; Q45-L111 PolarHBondContact NE2-O 3.32Å
46R90.8Very high93.5Very high94 Ų9456.9 Ų56.936%0.35528%0.278SS..Hα-helixtrans-61.9-45.3177.7175.3168-177.8-109.21112.6K42 Y43 V44 F49 I50 H112K42-R46 WeakPolarHBondContact O-CB 3.22Å; K42-R46 PolarHBondContact O-N 3.13Å; K42-R46 VanDerWaalsContact O-N 3.08Å; Y43-R46 WeakPolarHBondContact O-CB 3.46Å; Y43-R46 PolarHBondContact O-N 3.21Å; V44-R46 VanDerWaalsContact C-N 3.3Å; V44-R46 PolarHBondContact O-N 3.05Å; R46-F49 PolarHBondContact O-N 3.03Å; R46-I50 HydrophobicContact CG-CD1 3.72Å; R46-I50 HydrophobicContact CG-CG1 4.4Å; R46-I50 WeakPolarHBondContact O-CB 3.49Å; R46-I50 WeakPolarHBondContact O-CG1 3.38Å; R46-I50 PolarHBondContact O-N 3.46Å; R46-H112 WeakPolarHBondContact CA-NE2 3.49Å; R46-H112 WeakPolarHBondContact CB-NE2 3.27Å; R46-H112 WeakPolarHBondContact CG-NE2 3.28Å
47Q92.4Very high93.6Very high31 Ų3154.6 Ų54.615%0.14527%0.266CS..Hα-helixtrans-65.9-44.6179.8-65.2-56.1-19.300112L33 Y43 V44 F49 I50 W51 Y165L33-Q47 HydrophobicContact CD1-CB 4Å; L33-Q47 HydrophobicContact CD2-CB 3.74Å; L33-Q47 HydrophobicContact CD2-CG 3.97Å; Y43-Q47 HydrophobicContact CD1-CG 4.37Å; Y43-Q47 HydrophobicContact CD2-CG 4.34Å; Y43-Q47 HydrophobicContact CE1-CG 3.91Å; Y43-Q47 HydrophobicContact CE2-CG 3.91Å; Y43-Q47 VanDerWaalsContact CE2-NE2 3.3Å; Y43-Q47 WeakPolarHBondContact O-CG 3.39Å; Y43-Q47 PolarHBondContact O-N 3.02Å; V44-Q47 PolarHBondContact O-N 3.3Å; Q47-F49 PolarHBondContact O-N 3.25Å; Q47-I50 PolarHBondContact O-N 3.17Å; Q47-W51 PolarHBondContact O-N 2.78Å; Q47-Y165 HydrophobicContact CB-CE2 4.31Å; Q47-Y165 VanDerWaalsContact OE1-CE2 3.27Å
48N93.2Very high93.8Very high31 Ų3152.8 Ų52.817%0.16626%0.257CS..Hα-helixtrans-58.3-48.1174.7-76.7-35.2000111.4N27 V44 I50 W51 Q52N27-N48 PolarHBondContact ND2-OD1 3.49Å; V44-N48 WeakPolarHBondContact CG1-ND2 3.47Å; V44-N48 WeakPolarHBondContact O-CB 3.44Å; V44-N48 PolarHBondContact O-N 3.46Å; V44-N48 PolarHBondContact O-ND2 3.29Å; N48-I50 PolarHBondContact O-N 2.77Å; N48-W51 PolarHBondContact O-N 2.9Å; N48-Q52 VanDerWaalsContact O-CB 3.29Å; N48-Q52 WeakPolarHBondContact O-CB 3.4Å; N48-Q52 VanDerWaalsContact O-CG 3.28Å; N48-Q52 WeakPolarHBondContact O-CG 3.32Å; N48-Q52 PolarHBondContact O-N 3.37Å; N48-Q52 PolarHBondContact O-OE1 2.75Å
49F92.9Very high94Very high6 Ų645.9 Ų45.93%0.02623%0.227CC..Hα-helixtrans-59.6-47176.9171.5-98.2000112.1Q45 R46 Q47 W51 Q52 N53 H107 M108 L111 H112 T117Q45-F49 WeakPolarHBondContact O-CB 3.41Å; Q45-F49 PolarHBondContact O-N 3.47Å; R46-F49 PolarHBondContact O-N 3.03Å; Q47-F49 PolarHBondContact O-N 3.25Å; F49-W51 VanDerWaalsContact C-N 3.31Å; F49-W51 PolarHBondContact O-N 3.42Å; F49-Q52 PolarHBondContact O-N 2.99Å; F49-N53 HydrophobicContact CD2-CB 4.48Å; F49-N53 HydrophobicContact CE1-CB 4.39Å; F49-N53 HydrophobicContact CE2-CB 4.05Å; F49-N53 HydrophobicContact CZ-CB 3.98Å; F49-N53 WeakPolarHBondContact O-CB 3.5Å; F49-N53 PolarHBondContact O-N 3.36Å; F49-H107 AromaticContact CD2-CE1 3.96Å; F49-H107 AromaticContact CE2-ND1 3.9Å; F49-M108 HydrophobicContact CE2-CG 4.03Å; F49-M108 HydrophobicContact CZ-CG 3.82Å; F49-L111 HydrophobicContact CD2-CB 4.07Å; F49-H112 HydrophobicContact CB-CB 4.26Å; F49-H112 HydrophobicContact CD1-CB 3.54Å; F49-H112 AromaticContact CD1-CD2 3.66Å; F49-H112 AromaticContact CD1-CG 3.37Å; F49-H112 AromaticContact CD1-ND1 3.75Å; F49-H112 HydrophobicContact CD2-CB 3.66Å; F49-H112 HydrophobicContact CE1-CB 3.75Å; F49-H112 AromaticContact CE1-CG 3.79Å; F49-H112 AromaticContact CE1-ND1 3.88Å; F49-H112 HydrophobicContact CE2-CB 3.86Å; F49-H112 HydrophobicContact CG-CB 3.51Å; F49-H112 AromaticContact CG-CD2 3.86Å; F49-H112 AromaticContact CG-CG 3.71Å; F49-H112 HydrophobicContact CZ-CB 3.91Å; F49-T117 HydrophobicContact CE1-CG2 3.87Å; F49-T117 HydrophobicContact CZ-CG2 3.97Å
50I92.1Very high94.2Very high29 Ų2942.1 Ų42.115%0.14920%0.196CC..Hα-helixtrans-57.1-46.9179.2-73.3165.5000110.5R46 Q47 N48 T54 Y165R46-I50 HydrophobicContact CG-CD1 3.72Å; R46-I50 HydrophobicContact CG-CG1 4.4Å; R46-I50 WeakPolarHBondContact O-CB 3.49Å; R46-I50 WeakPolarHBondContact O-CG1 3.38Å; R46-I50 PolarHBondContact O-N 3.46Å; Q47-I50 PolarHBondContact O-N 3.17Å; N48-I50 PolarHBondContact O-N 2.77Å; I50-T54 VanDerWaalsContact O-CB 3.23Å; I50-T54 WeakPolarHBondContact O-CB 3.09Å; I50-T54 PolarHBondContact O-N 3.07Å; I50-T54 PolarHBondContact O-OG1 3.32Å; I50-Y165 HydrophobicContact CG2-CD2 3.77Å; I50-Y165 HydrophobicContact CG2-CE2 4.26Å
51W95.4Very high94.3Very high27 Ų2736.1 Ų36.110%0.10217%0.17CC..Hα-helixtrans-65.2-54.2179.7177.7-110.8000112A23 N27 Q47 N48 F49 N53 T54 C55 A162 Y165 L166A23-W51 PolarHBondContact O-NE1 3.16Å; N27-W51 HydrophobicContact CB-CG 4.4Å; Q47-W51 PolarHBondContact O-N 2.78Å; N48-W51 PolarHBondContact O-N 2.9Å; F49-W51 VanDerWaalsContact C-N 3.31Å; F49-W51 PolarHBondContact O-N 3.42Å; W51-N53 PolarHBondContact O-N 3.46Å; W51-T54 WeakPolarHBondContact O-CB 3.41Å; W51-T54 PolarHBondContact O-N 3.03Å; W51-T54 VanDerWaalsContact O-N 3.16Å; W51-C55 PolarHBondContact O-N 2.86Å; W51-C55 PolarHBondContact O-SG 3.18Å; W51-A162 HydrophobicContact CZ3-CB 4.47Å; W51-Y165 HydrophobicContact CB-CE1 3.95Å; W51-Y165 HydrophobicContact CB-CE2 4.1Å; W51-Y165 HydrophobicContact CD2-CD1 4.13Å; W51-Y165 AromaticContact CD2-CE1 3.9Å; W51-Y165 HydrophobicContact CD2-CE1 3.9Å; W51-Y165 AromaticContact CE3-CD1 3.31Å; W51-Y165 HydrophobicContact CE3-CD1 3.31Å; W51-Y165 AromaticContact CE3-CE1 3.56Å; W51-Y165 HydrophobicContact CE3-CE1 3.56Å; W51-Y165 HydrophobicContact CE3-CG 4.03Å; W51-Y165 HydrophobicContact CG-CE1 4.09Å; W51-Y165 AromaticContact CZ3-CD1 3.84Å; W51-Y165 HydrophobicContact CZ3-CD1 3.84Å; W51-Y165 HydrophobicContact CZ3-CE1 4.34Å; W51-L166 HydrophobicContact CH2-CD2 4.15Å; W51-L166 HydrophobicContact CZ3-CD2 4.02Å; W51-L166 HydrophobicContact CZ3-CG 4.17Å
52Q95.2Very high94.6Very high9 Ų935.7 Ų35.74%0.04216%0.164CC..Hα-helixtrans-57.8-52.8-178.4-75.5176-94.300111.9D20 A23 K24 N48 F49 T54 C55 V56D20-Q52 VanDerWaalsContact CG-NE2 3.3Å; D20-Q52 WeakPolarHBondContact OD1-CB 3.32Å; D20-Q52 PolarHBondContact OD1-NE2 3.22Å; D20-Q52 PolarHBondContact OD2-NE2 2.77Å; A23-Q52 HydrophobicContact CB-CG 4.41Å; K24-Q52 HydrophobicContact CB-CG 4.2Å; N48-Q52 VanDerWaalsContact O-CB 3.29Å; N48-Q52 WeakPolarHBondContact O-CB 3.4Å; N48-Q52 VanDerWaalsContact O-CG 3.28Å; N48-Q52 WeakPolarHBondContact O-CG 3.32Å; N48-Q52 PolarHBondContact O-N 3.37Å; N48-Q52 PolarHBondContact O-OE1 2.75Å; F49-Q52 PolarHBondContact O-N 2.99Å; Q52-T54 VanDerWaalsContact C-N 3.29Å; Q52-T54 PolarHBondContact O-N 3.46Å; Q52-C55 PolarHBondContact O-N 3.12Å; Q52-V56 VanDerWaalsContact O-CG2 3.27Å; Q52-V56 WeakPolarHBondContact O-CG2 3.5Å; Q52-V56 PolarHBondContact O-N 3.21Å
53N94Very high95Very high2 Ų231 Ų311%0.01115%0.148CC..Hα-helixtrans-59.1-41.1176.6172.3-106.5000111.1F49 W51 C55 V56 S57 D104 R161F49-N53 HydrophobicContact CD2-CB 4.48Å; F49-N53 HydrophobicContact CE1-CB 4.39Å; F49-N53 HydrophobicContact CE2-CB 4.05Å; F49-N53 HydrophobicContact CZ-CB 3.98Å; F49-N53 WeakPolarHBondContact O-CB 3.5Å; F49-N53 PolarHBondContact O-N 3.36Å; W51-N53 PolarHBondContact O-N 3.46Å; N53-C55 PolarHBondContact O-N 2.98Å; N53-V56 PolarHBondContact O-N 3.48Å; N53-S57 VanDerWaalsContact O-CB 3.29Å; N53-S57 WeakPolarHBondContact O-CB 3.27Å; N53-S57 PolarHBondContact O-N 3.39Å; N53-S57 PolarHBondContact O-OG 3.22Å; N53-D104 VanDerWaalsContact ND2-CG 3.3Å; N53-D104 PolarHBondContact ND2-OD1 3.26Å; N53-D104 PolarHBondContact ND2-OD2 3.21Å; N53-R161 PolarHBondContact OD1-NH1 3.35Å; N53-R161 VanDerWaalsContact OD1-NH1 3.08Å
54T95.1Very high95.3Very high2 Ų226.2 Ų26.21%0.01213%0.129CC..Hα-helixtrans-61.2-45176.8-59.70000111.9I50 W51 Q52 F58 H158 R161 A162I50-T54 VanDerWaalsContact O-CB 3.23Å; I50-T54 WeakPolarHBondContact O-CB 3.09Å; I50-T54 PolarHBondContact O-N 3.07Å; I50-T54 PolarHBondContact O-OG1 3.32Å; W51-T54 WeakPolarHBondContact O-CB 3.41Å; W51-T54 PolarHBondContact O-N 3.03Å; W51-T54 VanDerWaalsContact O-N 3.16Å; Q52-T54 VanDerWaalsContact C-N 3.29Å; Q52-T54 PolarHBondContact O-N 3.46Å; T54-F58 WeakPolarHBondContact O-CB 3.28Å; T54-F58 PolarHBondContact O-N 2.8Å; T54-H158 HydrophobicContact CG2-CB 4.42Å; T54-R161 HydrophobicContact CG2-CB 4.07Å; T54-R161 HydrophobicContact CG2-CG 4.09Å; T54-R161 VanDerWaalsContact OG1-CD 3.28Å; T54-R161 WeakPolarHBondContact OG1-CD 3.36Å; T54-R161 PolarHBondContact OG1-NE 3.38Å; T54-A162 HydrophobicContact CG2-CB 4.02Å
55C97.4Very high95.5Very high26 Ų2626.1 Ų26.118%0.17613%0.129CC..Hα-helixtrans-66.4-45.6178.8-680000112.4A23 W51 Q52 N53 F58 V59A23-C55 HydrophobicContact CB-CB 3.63Å; W51-C55 PolarHBondContact O-N 2.86Å; W51-C55 PolarHBondContact O-SG 3.18Å; Q52-C55 PolarHBondContact O-N 3.12Å; N53-C55 PolarHBondContact O-N 2.98Å; C55-F58 PolarHBondContact O-N 2.94Å; C55-V59 WeakPolarHBondContact O-CG2 3.3Å; C55-V59 PolarHBondContact O-N 3.49Å
56V97.1Very high95.8Very high0 Ų027.3 Ų27.30%014%0.137CC..Hα-helixtrans-62-50.7179.7174.60000110.3H16 V19 D20 Q52 N53 F58 V59 H60 Y100 F103H16-V56 HydrophobicContact CB-CG1 3.96Å; V19-V56 HydrophobicContact CB-CG2 4.48Å; V19-V56 HydrophobicContact CG1-CG2 4.01Å; D20-V56 HydrophobicContact CB-CG2 3.86Å; Q52-V56 VanDerWaalsContact O-CG2 3.27Å; Q52-V56 WeakPolarHBondContact O-CG2 3.5Å; Q52-V56 PolarHBondContact O-N 3.21Å; N53-V56 PolarHBondContact O-N 3.48Å; V56-F58 VanDerWaalsContact C-N 3.3Å; V56-F58 PolarHBondContact O-N 3.42Å; V56-V59 PolarHBondContact O-N 2.8Å; V56-H60 PolarHBondContact O-N 2.75Å; V56-Y100 HydrophobicContact CG1-CD2 4.24Å; V56-Y100 HydrophobicContact CG1-CE2 3.99Å; V56-F103 HydrophobicContact CG1-CD1 3.98Å; V56-F103 HydrophobicContact CG1-CE1 3.78Å; V56-F103 HydrophobicContact CG2-CE1 4.33Å
57S96.2Very high96.1Very high2 Ų226.5 Ų26.51%0.01413%0.134CC..Hα-helixtrans-64.6-33177.6-55.70000112.7N53 H60 A61 Y100 H158N53-S57 VanDerWaalsContact O-CB 3.29Å; N53-S57 WeakPolarHBondContact O-CB 3.27Å; N53-S57 PolarHBondContact O-N 3.39Å; N53-S57 PolarHBondContact O-OG 3.22Å; S57-H60 PolarHBondContact O-N 3.05Å; S57-A61 VanDerWaalsContact O-CB 3.27Å; S57-A61 WeakPolarHBondContact O-CB 3.17Å; S57-A61 PolarHBondContact O-N 2.84Å; S57-Y100 WeakPolarHBondContact CA-OH 3.44Å; S57-Y100 WeakPolarHBondContact CB-OH 3.4Å; S57-Y100 PolarHBondContact OG-OH 3.2Å; S57-H158 WeakPolarHBondContact CB-CE1 3.33Å; S57-H158 VanDerWaalsContact CB-NE2 3.31Å; S57-H158 WeakPolarHBondContact CB-NE2 3.25Å
58F97.7Very high96.3Very high54 Ų5425 Ų2524%0.23713%0.127CC..Hα-helixtrans-63.8-44.5174.3-179.2-112.5000112.2T54 C55 V56 A61 L62 I155 H158 L159T54-F58 WeakPolarHBondContact O-CB 3.28Å; T54-F58 PolarHBondContact O-N 2.8Å; C55-F58 PolarHBondContact O-N 2.94Å; V56-F58 VanDerWaalsContact C-N 3.3Å; V56-F58 PolarHBondContact O-N 3.42Å; F58-A61 PolarHBondContact O-N 3.15Å; F58-L62 HydrophobicContact CD1-CD1 3.8Å; F58-L62 HydrophobicContact CD1-CG 4.46Å; F58-L62 HydrophobicContact CD2-CG 4.49Å; F58-L62 HydrophobicContact CE1-CD1 3.3Å; F58-L62 HydrophobicContact CE1-CG 4.12Å; F58-L62 HydrophobicContact CE2-CD1 4.2Å; F58-L62 HydrophobicContact CE2-CD2 4.46Å; F58-L62 HydrophobicContact CE2-CG 4.14Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 3.54Å; F58-L62 HydrophobicContact CZ-CD2 4.25Å; F58-L62 HydrophobicContact CZ-CG 3.95Å; F58-L62 WeakPolarHBondContact O-CB 3.48Å; F58-L62 WeakPolarHBondContact O-CG 3.21Å; F58-L62 PolarHBondContact O-N 3.01Å; F58-I155 HydrophobicContact CE2-CG2 3.89Å; F58-I155 WeakPolarHBondContact CE2-O 3.49Å; F58-H158 HydrophobicContact CB-CB 3.83Å; F58-H158 HydrophobicContact CD2-CB 3.82Å; F58-H158 HydrophobicContact CG-CB 4.3Å; F58-L159 HydrophobicContact CE2-CB 4Å
59V98.1Very high96.5Very high42 Ų4227.2 Ų27.226%0.25514%0.138SC..Hα-helixtrans-64-43.8176.9171.80000110.7V19 C55 V56 L62 V63V19-V59 HydrophobicContact CG1-CB 4.39Å; V19-V59 HydrophobicContact CG1-CG2 3.89Å; V19-V59 HydrophobicContact CG2-CB 4.48Å; V19-V59 HydrophobicContact CG2-CG1 4.2Å; V19-V59 HydrophobicContact CG2-CG2 4.23Å; C55-V59 WeakPolarHBondContact O-CG2 3.3Å; C55-V59 PolarHBondContact O-N 3.49Å; V56-V59 PolarHBondContact O-N 2.8Å; V59-L62 PolarHBondContact O-N 3.32Å; V59-V63 HydrophobicContact CG1-CG2 4.48Å; V59-V63 WeakPolarHBondContact O-CG2 3.22Å; V59-V63 PolarHBondContact O-N 3.22Å
60H98.1Very high96.6Very high1 Ų128.9 Ų28.91%0.00515%0.15CC..Hα-helixtrans-57-52.4173.3169.5-98.1000111.3H16 V56 S57 L62 V63 S64 S97 Y100 E151H16-H60 WeakPolarHBondContact NE2-CB 3.49Å; V56-H60 PolarHBondContact O-N 2.75Å; S57-H60 PolarHBondContact O-N 3.05Å; H60-L62 VanDerWaalsContact C-N 3.32Å; H60-L62 PolarHBondContact O-N 3.13Å; H60-V63 PolarHBondContact O-N 3.43Å; H60-S64 PolarHBondContact CE1-OG 2.93Å; H60-S64 WeakPolarHBondContact O-CB 3.28Å; H60-S64 PolarHBondContact O-N 3.36Å; H60-S64 PolarHBondContact O-OG 3.45Å; H60-S97 PolarHBondContact NE2-OG 3.18Å; H60-Y100 HydrophobicContact CB-CD1 3.91Å; H60-Y100 HydrophobicContact CB-CD2 3.48Å; H60-Y100 VanDerWaalsContact CB-CD2 3.48Å; H60-Y100 HydrophobicContact CB-CE1 4.03Å; H60-Y100 HydrophobicContact CB-CE2 3.62Å; H60-Y100 HydrophobicContact CB-CG 3.62Å; H60-Y100 VanDerWaalsContact CD2-CB 3.46Å; H60-Y100 WeakPolarHBondContact CD2-CB 3.38Å; H60-Y100 AromaticContact CD2-CD1 3.29Å; H60-Y100 WeakPolarHBondContact CD2-CD1 3.31Å; H60-Y100 AromaticContact CD2-CG 3.34Å; H60-Y100 AromaticContact CE1-CD1 3.56Å; H60-Y100 AromaticContact CE1-CE1 3.75Å; H60-Y100 AromaticContact CG-CD1 3.24Å; H60-Y100 AromaticContact CG-CD2 3.79Å; H60-Y100 AromaticContact CG-CE1 3.53Å; H60-Y100 AromaticContact CG-CG 3.36Å; H60-Y100 AromaticContact CG-CZ 3.92Å; H60-Y100 AromaticContact ND1-CD1 3.47Å; H60-Y100 WeakPolarHBondContact ND1-CD1 3.24Å; H60-Y100 AromaticContact ND1-CE1 3.38Å; H60-Y100 WeakPolarHBondContact ND1-CE1 3.16Å; H60-Y100 AromaticContact ND1-CZ 3.95Å; H60-Y100 AromaticContact NE2-CD1 3.49Å; H60-Y100 WeakPolarHBondContact NE2-CD1 3.47Å; H60-E151 IonicContact CE1-OE1 2.74Å
61A98.1Very high96.7Very high0 Ų027.5 Ų27.50%014%0.143CC..Hα-helixtrans-61-39.6-177.300000112.5S57 F58 G65 I155S57-A61 VanDerWaalsContact O-CB 3.27Å; S57-A61 WeakPolarHBondContact O-CB 3.17Å; S57-A61 PolarHBondContact O-N 2.84Å; F58-A61 PolarHBondContact O-N 3.15Å; A61-G65 VanDerWaalsContact O-CA 3.3Å; A61-G65 WeakPolarHBondContact O-CA 3.28Å; A61-G65 PolarHBondContact O-N 2.85Å; A61-I155 HydrophobicContact CB-CG1 4.02Å; A61-I155 WeakPolarHBondContact O-CG1 3.43Å
62L98Very high96.6Very high57 Ų5727.9 Ų27.930%0.29815%0.146SC..Hα-helixtrans-60.7-51.6174.4-81.9175.6000111.4F58 V59 H60 I66 I155F58-L62 HydrophobicContact CD1-CD1 3.8Å; F58-L62 HydrophobicContact CD1-CG 4.46Å; F58-L62 HydrophobicContact CD2-CG 4.49Å; F58-L62 HydrophobicContact CE1-CD1 3.3Å; F58-L62 HydrophobicContact CE1-CG 4.12Å; F58-L62 HydrophobicContact CE2-CD1 4.2Å; F58-L62 HydrophobicContact CE2-CD2 4.46Å; F58-L62 HydrophobicContact CE2-CG 4.14Å; F58-L62 HydrophobicContact CG-CD1 4.44Å; F58-L62 HydrophobicContact CZ-CD1 3.54Å; F58-L62 HydrophobicContact CZ-CD2 4.25Å; F58-L62 HydrophobicContact CZ-CG 3.95Å; F58-L62 WeakPolarHBondContact O-CB 3.48Å; F58-L62 WeakPolarHBondContact O-CG 3.21Å; F58-L62 PolarHBondContact O-N 3.01Å; V59-L62 PolarHBondContact O-N 3.32Å; H60-L62 VanDerWaalsContact C-N 3.32Å; H60-L62 PolarHBondContact O-N 3.13Å; L62-I66 WeakPolarHBondContact O-CB 3.23Å; L62-I66 WeakPolarHBondContact O-CD1 3.27Å; L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.49Å; L62-I66 PolarHBondContact O-N 3.38Å; L62-I155 HydrophobicContact CD2-CB 4.49Å; L62-I155 HydrophobicContact CD2-CD1 4.07Å; L62-I155 HydrophobicContact CD2-CG1 4.05Å; L62-I155 HydrophobicContact CD2-CG2 3.62Å; L62-I155 HydrophobicContact CG-CG1 4.37Å; L62-I155 HydrophobicContact CG-CG2 4.33Å
63V97.9Very high96.5Very high53 Ų5336.3 Ų36.332%0.32118%0.178SC..Hα-helixtrans-68.1-51.9-176.5174.30000110.5V59 H60 W67 Y96V59-V63 HydrophobicContact CG1-CG2 4.48Å; V59-V63 WeakPolarHBondContact O-CG2 3.22Å; V59-V63 PolarHBondContact O-N 3.22Å; H60-V63 PolarHBondContact O-N 3.43Å; V63-W67 HydrophobicContact CG1-CE3 4.05Å; V63-W67 WeakPolarHBondContact O-CB 3.36Å; V63-W67 PolarHBondContact O-N 3.32Å; V63-Y96 HydrophobicContact CB-CE1 3.96Å; V63-Y96 HydrophobicContact CG1-CD1 4.26Å; V63-Y96 HydrophobicContact CG1-CE1 3.59Å; V63-Y96 HydrophobicContact CG1-CE2 4.43Å
64S97.8Very high96.4Very high0 Ų041.6 Ų41.60%020%0.202CC..Hα-helixtrans-70.7-37.5-176.366.60000112.7H60 S68 E151H60-S64 PolarHBondContact CE1-OG 2.93Å; H60-S64 WeakPolarHBondContact O-CB 3.28Å; H60-S64 PolarHBondContact O-N 3.36Å; H60-S64 PolarHBondContact O-OG 3.45Å; S64-S68 VanDerWaalsContact O-CB 3.23Å; S64-S68 WeakPolarHBondContact O-CB 3.4Å; S64-S68 PolarHBondContact O-N 3.35Å; S64-S68 PolarHBondContact O-OG 3.46Å; S64-S68 VanDerWaalsContact O-OG 3.06Å; S64-E151 WeakPolarHBondContact OG-CB 3.32Å; S64-E151 WeakPolarHBondContact OG-CG 3.49Å
65G97.2Very high96.2Very high0 Ų042.6 Ų42.60%021%0.206CC..Hα-helixtrans-64.6-50.1176.800000112.1A61 S68 L69A61-G65 VanDerWaalsContact O-CA 3.3Å; A61-G65 WeakPolarHBondContact O-CA 3.28Å; A61-G65 PolarHBondContact O-N 2.85Å; G65-S68 PolarHBondContact O-OG 2.84Å; G65-L69 PolarHBondContact O-N 3.06Å
66I97.3Very high95.8Very high108 Ų10844.7 Ų44.755%0.55422%0.219SC*.Hα-helixtrans-66.7-42177.9-64.6171.1000110.7L62 L69 S70L62-I66 WeakPolarHBondContact O-CB 3.23Å; L62-I66 WeakPolarHBondContact O-CD1 3.27Å; L62-I66 VanDerWaalsContact O-CG1 3.25Å; L62-I66 WeakPolarHBondContact O-CG1 3.49Å; L62-I66 PolarHBondContact O-N 3.38Å; I66-L69 PolarHBondContact O-N 2.87Å; I66-S70 WeakPolarHBondContact O-CB 3.46Å; I66-S70 PolarHBondContact O-N 3.27Å
67W97.8Very high95.4Very high77 Ų7749.5 Ų49.529%0.29225%0.245SC..Hα-helixtrans-69-36.1-178.5-166.9-5.9000112.2V63 S70 T71 L93V63-W67 HydrophobicContact CG1-CE3 4.05Å; V63-W67 WeakPolarHBondContact O-CB 3.36Å; V63-W67 PolarHBondContact O-N 3.32Å; W67-S70 PolarHBondContact O-N 3.09Å; W67-T71 WeakPolarHBondContact O-CB 3.32Å; W67-T71 PolarHBondContact O-N 3.23Å; W67-T71 PolarHBondContact O-OG1 2.91Å; W67-L93 HydrophobicContact CB-CD1 3.89Å; W67-L93 HydrophobicContact CB-CD2 4.46Å; W67-L93 HydrophobicContact CD2-CB 4.11Å; W67-L93 HydrophobicContact CD2-CD1 3.99Å; W67-L93 HydrophobicContact CE3-CD1 4.12Å; W67-L93 HydrophobicContact CG-CB 4.34Å; W67-L93 HydrophobicContact CG-CD1 3.9Å; W67-L93 HydrophobicContact CG-CD2 4.28Å; W67-L93 HydrophobicContact CG-CG 4.4Å
68S96.7Very high95Very high0 Ų049.5 Ų49.50%025%0.245CC..Hα-helixtrans-61.9-46.5174.563.50000111.8S64 G65 S70 T71 F72S64-S68 VanDerWaalsContact O-CB 3.23Å; S64-S68 WeakPolarHBondContact O-CB 3.4Å; S64-S68 PolarHBondContact O-N 3.35Å; S64-S68 PolarHBondContact O-OG 3.46Å; S64-S68 VanDerWaalsContact O-OG 3.06Å; G65-S68 PolarHBondContact O-OG 2.84Å; S68-S70 PolarHBondContact O-N 3.18Å; S68-T71 WeakPolarHBondContact O-CB 3.44Å; S68-T71 PolarHBondContact O-N 3.35Å; S68-F72 VanDerWaalsContact O-CD2 3.27Å; S68-F72 WeakPolarHBondContact O-CD2 3.5Å; S68-F72 PolarHBondContact O-N 3.45Å
69L95.8Very high94.3Very high76 Ų7652.5 Ų52.540%0.39826%0.263SS..Hα-helixtrans-60.3-45.3173.7-69.7174.2000112.1G65 I66 T71 F72 Y73 L149 V152 F189G65-L69 PolarHBondContact O-N 3.06Å; I66-L69 PolarHBondContact O-N 2.87Å; L69-T71 PolarHBondContact O-N 3.05Å; L69-F72 PolarHBondContact O-N 2.62Å; L69-Y73 PolarHBondContact O-N 3.18Å; L69-Y73 VanDerWaalsContact O-N 3.14Å; L69-L149 HydrophobicContact CD2-CD2 3.75Å; L69-L149 HydrophobicContact CG-CD2 4.29Å; L69-V152 HydrophobicContact CD1-CG1 4.43Å; L69-V152 HydrophobicContact CD1-CG2 3.69Å; L69-V152 HydrophobicContact CD2-CG2 4.48Å; L69-V152 HydrophobicContact CG-CG2 3.92Å; L69-F189 HydrophobicContact CD2-CE1 4.1Å; L69-F189 HydrophobicContact CD2-CZ 4.49Å
70S95.8Very high93.8Very high41 Ų4156.2 Ų56.229%0.28729%0.286SS..Hα-helixtrans-61.2-34.4178179.60000112.3I66 W67 S68 Y73 F74I66-S70 WeakPolarHBondContact O-CB 3.46Å; I66-S70 PolarHBondContact O-N 3.27Å; W67-S70 PolarHBondContact O-N 3.09Å; S68-S70 PolarHBondContact O-N 3.18Å; S70-Y73 PolarHBondContact O-N 3.05Å; S70-F74 WeakPolarHBondContact O-CD2 3.26Å; S70-F74 PolarHBondContact O-N 3Å; S70-F74 VanDerWaalsContact OG-CD2 3.24Å; S70-F74 WeakPolarHBondContact OG-CD2 3.44Å; S70-F74 WeakPolarHBondContact OG-CE2 3.14Å
71T94.8Very high93.4Very high1 Ų158.6 Ų58.61%0.00630%0.298CS..Hα-helixtrans-63.5-45177.7-57.40000111W67 S68 L69 Y73 F74 E75 F78 V145W67-T71 WeakPolarHBondContact O-CB 3.32Å; W67-T71 PolarHBondContact O-N 3.23Å; W67-T71 PolarHBondContact O-OG1 2.91Å; S68-T71 WeakPolarHBondContact O-CB 3.44Å; S68-T71 PolarHBondContact O-N 3.35Å; L69-T71 PolarHBondContact O-N 3.05Å; T71-Y73 VanDerWaalsContact C-N 3.31Å; T71-Y73 PolarHBondContact O-N 3.17Å; T71-F74 PolarHBondContact O-N 2.79Å; T71-E75 WeakPolarHBondContact O-CA 3.42Å; T71-E75 WeakPolarHBondContact O-CB 3.34Å; T71-E75 PolarHBondContact O-N 3.08Å; T71-F78 HydrophobicContact CG2-CD2 3.88Å; T71-F78 HydrophobicContact CG2-CE2 3.59Å; T71-V145 HydrophobicContact CG2-CG1 4.09Å
72F92.2Very high93.1Very high35 Ų3558.7 Ų58.715%0.15430%0.299CS..Hα-helixtrans-67.4-31175.5-73-72.3000113.6S68 L69 F78 L79 V145 V146 L149S68-F72 VanDerWaalsContact O-CD2 3.27Å; S68-F72 WeakPolarHBondContact O-CD2 3.5Å; S68-F72 PolarHBondContact O-N 3.45Å; L69-F72 PolarHBondContact O-N 2.62Å; F72-F78 HydrophobicContact CD1-CB 4.02Å; F72-F78 HydrophobicContact CE1-CB 3.71Å; F72-L79 HydrophobicContact CD1-CD2 3.84Å; F72-L79 HydrophobicContact CD1-CG 4.45Å; F72-L79 HydrophobicContact CE1-CD2 4.21Å; F72-V145 HydrophobicContact CD2-CG1 4.49Å; F72-V145 HydrophobicContact CE2-CG1 3.74Å; F72-V145 HydrophobicContact CZ-CG1 4.02Å; F72-V146 HydrophobicContact CE1-CG2 4.14Å; F72-V146 HydrophobicContact CE2-CG2 4.34Å; F72-V146 HydrophobicContact CZ-CB 4.35Å; F72-V146 HydrophobicContact CZ-CG2 3.44Å; F72-V146 VanDerWaalsContact CZ-CG2 3.44Å; F72-L149 HydrophobicContact CD2-CD1 4.48Å; F72-L149 HydrophobicContact CD2-CD2 4.11Å; F72-L149 HydrophobicContact CE2-CD1 3.95Å; F72-L149 HydrophobicContact CE2-CD2 4.07Å; F72-L149 HydrophobicContact CE2-CG 4.1Å
73Y92.4Very high92.8Very high185 Ų18556.9 Ų56.973%0.72529%0.289SS*.Hα-helixtrans-68.4-42.9176.2-179.3-98.6000112.1L69 S70 T71L69-Y73 PolarHBondContact O-N 3.18Å; L69-Y73 VanDerWaalsContact O-N 3.14Å; S70-Y73 PolarHBondContact O-N 3.05Å; T71-Y73 VanDerWaalsContact C-N 3.31Å; T71-Y73 PolarHBondContact O-N 3.17Å
74F92.4Very high92.4Very high114 Ų11459.2 Ų59.250%0.530%0.3SS..Hα-helixtrans-89.5-21-177-70.3-60.9000114.6S70 T71 P76S70-F74 WeakPolarHBondContact O-CD2 3.26Å; S70-F74 PolarHBondContact O-N 3Å; S70-F74 VanDerWaalsContact OG-CD2 3.24Å; S70-F74 WeakPolarHBondContact OG-CD2 3.44Å; S70-F74 WeakPolarHBondContact OG-CE2 3.14Å; T71-F74 PolarHBondContact O-N 2.79Å; F74-P76 VanDerWaalsContact C-CD 3.47Å
75E90.3Very high92Very high22 Ų2261.3 Ų61.310%0.10331%0.311CS..  trans-13068.1-177.2-59.1179.8174.400108.9T71 D77 F78 T87 R89T71-E75 WeakPolarHBondContact O-CA 3.42Å; T71-E75 WeakPolarHBondContact O-CB 3.34Å; T71-E75 PolarHBondContact O-N 3.08Å; E75-D77 PolarHBondContact O-N 3.16Å; E75-D77 VanDerWaalsContact O-N 3.1Å; E75-F78 HydrophobicContact CB-CD2 3.77Å; E75-F78 HydrophobicContact CB-CE2 3.95Å; E75-F78 WeakPolarHBondContact O-CD2 3.31Å; E75-F78 PolarHBondContact O-N 2.88Å; E75-F78 VanDerWaalsContact O-N 3.15Å; E75-F78 WeakPolarHBondContact OE2-CE2 3.47Å; E75-T87 VanDerWaalsContact CD-CG2 3.49Å; E75-T87 VanDerWaalsContact CD-OG1 3.28Å; E75-T87 WeakPolarHBondContact OE1-CB 3.37Å; E75-T87 PolarHBondContact OE1-OG1 2.82Å; E75-T87 WeakPolarHBondContact OE2-CB 3.28Å; E75-T87 WeakPolarHBondContact OE2-CG2 3.35Å; E75-T87 PolarHBondContact OE2-OG1 3.39Å; E75-R89 IonicContact OE1-CZ 3.15Å; E75-R89 IonicContact OE1-NE 3.23Å; E75-R89 PolarHBondContact OE1-NE 3.35Å; E75-R89 IonicContact OE1-NH2 3.63Å; E75-R89 PolarHBondContact OE1-NH2 2.93Å
76P89.5Confident91.7Very high71 Ų7162.8 Ų62.846%0.46132%0.321SS..G310 helixtrans-63.2-16.8-177.327.3-36000113F74 F78 L79F74-P76 VanDerWaalsContact C-CD 3.47Å; P76-F78 PolarHBondContact O-N 3.5Å; P76-F78 VanDerWaalsContact O-N 3.13Å; P76-L79 VanDerWaalsContact O-CB 3.26Å; P76-L79 WeakPolarHBondContact O-CB 3.46Å; P76-L79 WeakPolarHBondContact O-CG 3.33Å; P76-L79 PolarHBondContact O-N 3.42Å
77D89.6Confident91.4Very high101 Ų10159 Ų5954%0.5430%0.303SS..G310 helixtrans-59.1-21.1174.4-61-32.9000112.7E75 L79 T80 D81 L85E75-D77 PolarHBondContact O-N 3.16Å; E75-D77 VanDerWaalsContact O-N 3.1Å; D77-L79 PolarHBondContact O-N 2.94Å; D77-T80 PolarHBondContact O-N 3.3Å; D77-T80 VanDerWaalsContact O-N 3.08Å; D77-T80 PolarHBondContact O-OG1 3.21Å; D77-D81 PolarHBondContact O-N 3.01Å; D77-L85 VanDerWaalsContact C-CD2 3.48Å; D77-L85 HydrophobicContact CB-CD2 3.49Å; D77-L85 VanDerWaalsContact CB-CD2 3.49Å
78F86.6Confident91.1Very high1 Ų157.7 Ų57.70%0.00431%0.314CS..G310 helixtrans-64-18.5170.5-80.5-58.1000114T71 F72 E75 P76 T80 L82 L85 T87 S90 G142T71-F78 HydrophobicContact CG2-CD2 3.88Å; T71-F78 HydrophobicContact CG2-CE2 3.59Å; F72-F78 HydrophobicContact CD1-CB 4.02Å; F72-F78 HydrophobicContact CE1-CB 3.71Å; E75-F78 HydrophobicContact CB-CD2 3.77Å; E75-F78 HydrophobicContact CB-CE2 3.95Å; E75-F78 WeakPolarHBondContact O-CD2 3.31Å; E75-F78 PolarHBondContact O-N 2.88Å; E75-F78 VanDerWaalsContact O-N 3.15Å; E75-F78 WeakPolarHBondContact OE2-CE2 3.47Å; P76-F78 PolarHBondContact O-N 3.5Å; P76-F78 VanDerWaalsContact O-N 3.13Å; F78-T80 VanDerWaalsContact C-N 3.27Å; F78-L82 WeakPolarHBondContact O-CD1 3.36Å; F78-L82 VanDerWaalsContact O-CG 3.27Å; F78-L82 WeakPolarHBondContact O-CG 3.28Å; F78-L85 HydrophobicContact CD1-CB 4.2Å; F78-L85 HydrophobicContact CD1-CD2 3.72Å; F78-L85 HydrophobicContact CD1-CG 4.13Å; F78-L85 HydrophobicContact CD2-CD2 4.34Å; F78-L85 HydrophobicContact CE1-CB 3.99Å; F78-L85 HydrophobicContact CE1-CD2 3.88Å; F78-L85 HydrophobicContact CE1-CG 3.82Å; F78-L85 WeakPolarHBondContact CE1-O 3.3Å; F78-L85 HydrophobicContact CG-CD2 3.94Å; F78-L85 HydrophobicContact CZ-CD2 4.26Å; F78-L85 HydrophobicContact CZ-CG 4.21Å; F78-T87 HydrophobicContact CE2-CG2 4.47Å; F78-T87 HydrophobicContact CZ-CG2 4.29Å; F78-S90 VanDerWaalsContact CZ-CB 3.47Å; F78-S90 WeakPolarHBondContact CZ-OG 3.49Å; F78-G142 VanDerWaalsContact CD1-CA 3.41Å; F78-G142 VanDerWaalsContact CE1-CA 3.47Å
79L84Confident90.8Very high117 Ų11762.5 Ų62.561%0.61333%0.332SS*.G310 helixtrans-75.2-20.2175.3-59.4176.9000112.1F72 P76 D77F72-L79 HydrophobicContact CD1-CD2 3.84Å; F72-L79 HydrophobicContact CD1-CG 4.45Å; F72-L79 HydrophobicContact CE1-CD2 4.21Å; P76-L79 VanDerWaalsContact O-CB 3.26Å; P76-L79 WeakPolarHBondContact O-CB 3.46Å; P76-L79 WeakPolarHBondContact O-CG 3.33Å; P76-L79 PolarHBondContact O-N 3.42Å; D77-L79 PolarHBondContact O-N 2.94Å
80T87Confident90.8Very high120 Ų12058.9 Ų58.974%0.73631%0.313SS*.THydrogen-bonded Turntrans-104.1-41.9-17859.10000112.2D77 F78D77-T80 PolarHBondContact O-N 3.3Å; D77-T80 VanDerWaalsContact O-N 3.08Å; D77-T80 PolarHBondContact O-OG1 3.21Å; F78-T80 VanDerWaalsContact C-N 3.27Å
81D89.9Confident90.7Very high51 Ų5157.4 Ų57.427%0.27330%0.302SS..  trans-125.8103.6177.7-170.4-2000112D77 I83 N84 L85D77-D81 PolarHBondContact O-N 3.01Å; D81-I83 WeakPolarHBondContact OD1-CA 3.48Å; D81-I83 PolarHBondContact OD1-N 3.3Å; D81-N84 PolarHBondContact OD1-N 3.5Å; D81-N84 WeakPolarHBondContact OD2-CB 3.37Å; D81-N84 PolarHBondContact OD2-ND2 3.35Å; D81-L85 HydrophobicContact CB-CB 4.39Å; D81-L85 VanDerWaalsContact O-CB 3.3Å; D81-L85 WeakPolarHBondContact O-CB 3.42Å
82L91.5Very high90.8Very high3 Ų358.4 Ų58.42%0.01631%0.309CS..SBendtrans-93.2-5.6173.7-71.588.4000113.1F78 Y140 Y143 V146 W196 W200F78-L82 WeakPolarHBondContact O-CD1 3.36Å; F78-L82 VanDerWaalsContact O-CG 3.27Å; F78-L82 WeakPolarHBondContact O-CG 3.28Å; L82-Y140 WeakPolarHBondContact O-CA 3.31Å; L82-Y143 HydrophobicContact CD2-CD2 4.26Å; L82-V146 HydrophobicContact CD2-CG2 3.59Å; L82-W196 HydrophobicContact CD1-CH2 4.17Å; L82-W196 HydrophobicContact CD2-CH2 3.69Å; L82-W196 HydrophobicContact CD2-CZ3 3.97Å; L82-W200 HydrophobicContact CB-CH2 4.34Å; L82-W200 HydrophobicContact CB-CZ2 3.8Å
83I91.8Very high91Very high19 Ų1956.8 Ų56.810%0.09730%0.302CS..SBendtrans-94.2-57.4-172.6-63.3175.4000110.3D81 N139 Y140 W200 R207D81-I83 WeakPolarHBondContact OD1-CA 3.48Å; D81-I83 PolarHBondContact OD1-N 3.3Å; I83-N139 CarbonylContact O-C 3.55Å; I83-N139 WeakPolarHBondContact O-CA 3.49Å; I83-Y140 HydrophobicContact CB-CD1 4.39Å; I83-Y140 HydrophobicContact CB-CE1 4.23Å; I83-Y140 HydrophobicContact CG1-CD1 4.22Å; I83-Y140 HydrophobicContact CG1-CE1 4.02Å; I83-Y140 HydrophobicContact CG2-CD1 4.17Å; I83-Y140 HydrophobicContact CG2-CE1 3.64Å; I83-Y140 PolarHBondContact O-N 2.81Å; I83-W200 HydrophobicContact CD1-CH2 4Å; I83-W200 HydrophobicContact CD1-CZ2 4.2Å; I83-W200 HydrophobicContact CG1-CH2 3.59Å; I83-W200 HydrophobicContact CG1-CZ2 3.87Å; I83-R207 HydrophobicContact CD1-CB 4.11Å
84N90.4Very high91.3Very high101 Ų10148 Ų4854%0.5427%0.267SS..SBendtrans-100.4-24-170.2-45.5-72.7000112.7D81 S86D81-N84 PolarHBondContact OD1-N 3.5Å; D81-N84 WeakPolarHBondContact OD2-CB 3.37Å; D81-N84 PolarHBondContact OD2-ND2 3.35Å; N84-S86 PolarHBondContact O-N 2.88Å
85L88.7Confident91.5Very high44 Ų4442.5 Ų42.523%0.2324%0.243CC..  trans-68125.7-178-170.263.9000110.1D77 F78 D81D77-L85 VanDerWaalsContact C-CD2 3.48Å; D77-L85 HydrophobicContact CB-CD2 3.49Å; D77-L85 VanDerWaalsContact CB-CD2 3.49Å; F78-L85 HydrophobicContact CD1-CB 4.2Å; F78-L85 HydrophobicContact CD1-CD2 3.72Å; F78-L85 HydrophobicContact CD1-CG 4.13Å; F78-L85 HydrophobicContact CD2-CD2 4.34Å; F78-L85 HydrophobicContact CE1-CB 3.99Å; F78-L85 HydrophobicContact CE1-CD2 3.88Å; F78-L85 HydrophobicContact CE1-CG 3.82Å; F78-L85 WeakPolarHBondContact CE1-O 3.3Å; F78-L85 HydrophobicContact CG-CD2 3.94Å; F78-L85 HydrophobicContact CZ-CD2 4.26Å; F78-L85 HydrophobicContact CZ-CG 4.21Å; D81-L85 HydrophobicContact CB-CB 4.39Å; D81-L85 VanDerWaalsContact O-CB 3.3Å; D81-L85 WeakPolarHBondContact O-CB 3.42Å
86S90.2Very high91.8Very high31 Ų3141.9 Ų41.922%0.21724%0.24CC..  trans-144.6137.8171.8620000109.3M1 N84M1-S86 WeakPolarHBondContact CE-OG 3.32Å; N84-S86 PolarHBondContact O-N 2.88Å
87T91.7Very high92.2Very high28 Ų2838.5 Ų38.517%0.17222%0.218CC..  trans-130.6158.5-176.364.70000109.4E75 F78 R89 S90 I91E75-T87 VanDerWaalsContact CD-CG2 3.49Å; E75-T87 VanDerWaalsContact CD-OG1 3.28Å; E75-T87 WeakPolarHBondContact OE1-CB 3.37Å; E75-T87 PolarHBondContact OE1-OG1 2.82Å; E75-T87 WeakPolarHBondContact OE2-CB 3.28Å; E75-T87 WeakPolarHBondContact OE2-CG2 3.35Å; E75-T87 PolarHBondContact OE2-OG1 3.39Å; F78-T87 HydrophobicContact CE2-CG2 4.47Å; F78-T87 HydrophobicContact CZ-CG2 4.29Å; T87-R89 PolarHBondContact O-N 3.33Å; T87-S90 PolarHBondContact N-OG 3.38Å; T87-S90 PolarHBondContact O-N 3.47Å; T87-S90 PolarHBondContact O-OG 2.98Å; T87-S90 WeakPolarHBondContact OG1-CB 3.28Å; T87-S90 PolarHBondContact OG1-N 3.35Å; T87-S90 PolarHBondContact OG1-OG 3.01Å; T87-I91 WeakPolarHBondContact O-CB 3.39Å; T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.37Å; T87-I91 PolarHBondContact O-N 2.97Å
88G91Very high92.6Very high50 Ų5034 Ų3452%0.51519%0.194SC..Hα-helixtrans-55.8-36.2176.800000112.6S92G88-S92 VanDerWaalsContact O-CB 3.26Å; G88-S92 WeakPolarHBondContact O-CB 3.44Å; G88-S92 PolarHBondContact O-N 3.37Å; G88-S92 PolarHBondContact O-OG 3.02Å
89R91.7Very high93.1Very high102 Ų10234 Ų3439%0.38519%0.194SC..Hα-helixtrans-68.5-50.2178.7-71.4-173.7-74.5-162.2-4.7112.3E75 T87 S92 L93E75-R89 IonicContact OE1-CZ 3.15Å; E75-R89 IonicContact OE1-NE 3.23Å; E75-R89 PolarHBondContact OE1-NE 3.35Å; E75-R89 IonicContact OE1-NH2 3.63Å; E75-R89 PolarHBondContact OE1-NH2 2.93Å; T87-R89 PolarHBondContact O-N 3.33Å; R89-S92 PolarHBondContact O-N 3.08Å; R89-L93 WeakPolarHBondContact O-CB 3.21Å; R89-L93 PolarHBondContact O-N 2.87Å
90S94.4Very high93.7Very high0 Ų028.8 Ų28.80%017%0.166CC..Hα-helixtrans-65.1-43.218056.60000112.4F78 T87 S92 L93 V94 I141F78-S90 VanDerWaalsContact CZ-CB 3.47Å; F78-S90 WeakPolarHBondContact CZ-OG 3.49Å; T87-S90 PolarHBondContact N-OG 3.38Å; T87-S90 PolarHBondContact O-N 3.47Å; T87-S90 PolarHBondContact O-OG 2.98Å; T87-S90 WeakPolarHBondContact OG1-CB 3.28Å; T87-S90 PolarHBondContact OG1-N 3.35Å; T87-S90 PolarHBondContact OG1-OG 3.01Å; S90-S92 VanDerWaalsContact C-N 3.32Å; S90-S92 PolarHBondContact O-N 2.93Å; S90-L93 PolarHBondContact O-N 3.32Å; S90-V94 WeakPolarHBondContact O-CG2 3.48Å; S90-V94 PolarHBondContact O-N 3.06Å; S90-I141 WeakPolarHBondContact OG-CG2 3.38Å
91I95.1Very high94.1Very high10 Ų1023.2 Ų23.25%0.05113%0.132CC..Hα-helixtrans-61.1-43.6174.7-67.2169.3000110.5M1 T87 V94 S95 L135 I141M1-I91 HydrophobicContact CB-CD1 4.41Å; M1-I91 HydrophobicContact CE-CD1 3.46Å; M1-I91 VanDerWaalsContact CE-CD1 3.46Å; M1-I91 HydrophobicContact CG-CD1 4Å; M1-I91 HydrophobicContact SD-CD1 4.49Å; T87-I91 WeakPolarHBondContact O-CB 3.39Å; T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.37Å; T87-I91 PolarHBondContact O-N 2.97Å; I91-V94 PolarHBondContact O-N 2.99Å; I91-S95 WeakPolarHBondContact O-CB 3.15Å; I91-S95 PolarHBondContact O-N 2.99Å; I91-S95 PolarHBondContact O-OG 3.41Å; I91-L135 HydrophobicContact CG2-CD2 4.07Å; I91-I141 HydrophobicContact CG1-CD1 4.48Å; I91-I141 HydrophobicContact CG1-CG1 4.37Å; I91-I141 HydrophobicContact CG1-CG2 4.25Å
92S96.3Very high94.4Very high22 Ų2223.4 Ų23.415%0.15413%0.132CC..Hα-helixtrans-63.4-42177.8-61.20000111.7V4 G88 R89 S90 S95 Y96V4-S92 VanDerWaalsContact CG1-OG 3.29Å; V4-S92 WeakPolarHBondContact CG1-OG 3.45Å; G88-S92 VanDerWaalsContact O-CB 3.26Å; G88-S92 WeakPolarHBondContact O-CB 3.44Å; G88-S92 PolarHBondContact O-N 3.37Å; G88-S92 PolarHBondContact O-OG 3.02Å; R89-S92 PolarHBondContact O-N 3.08Å; S90-S92 VanDerWaalsContact C-N 3.32Å; S90-S92 PolarHBondContact O-N 2.93Å; S92-S95 PolarHBondContact O-N 3.3Å; S92-Y96 WeakPolarHBondContact O-CB 3.48Å; S92-Y96 PolarHBondContact O-N 2.91Å
93L97Very high94.6Very high0 Ų024.8 Ų24.80%014%0.138CC..Hα-helixtrans-62.7-47.6177.2171.558.4000112.4W67 R89 S90 Y96 S97 V145 L148W67-L93 HydrophobicContact CB-CD1 3.89Å; W67-L93 HydrophobicContact CB-CD2 4.46Å; W67-L93 HydrophobicContact CD2-CB 4.11Å; W67-L93 HydrophobicContact CD2-CD1 3.99Å; W67-L93 HydrophobicContact CE3-CD1 4.12Å; W67-L93 HydrophobicContact CG-CB 4.34Å; W67-L93 HydrophobicContact CG-CD1 3.9Å; W67-L93 HydrophobicContact CG-CD2 4.28Å; W67-L93 HydrophobicContact CG-CG 4.4Å; R89-L93 WeakPolarHBondContact O-CB 3.21Å; R89-L93 PolarHBondContact O-N 2.87Å; S90-L93 PolarHBondContact O-N 3.32Å; L93-Y96 PolarHBondContact O-N 3.18Å; L93-S97 WeakPolarHBondContact O-CB 3.3Å; L93-S97 PolarHBondContact O-N 3.3Å; L93-S97 PolarHBondContact O-OG 3.48Å; L93-V145 HydrophobicContact CD2-CG1 4.07Å; L93-V145 HydrophobicContact CD2-CG2 4.3Å; L93-L148 HydrophobicContact CD1-CD1 4.04Å; L93-L148 HydrophobicContact CD2-CD1 4.24Å; L93-L148 HydrophobicContact CG-CD1 3.75Å
94V97.1Very high94.7Very high0 Ų023.9 Ų23.90%013%0.133CC..Hα-helixtrans-65.5-41.4178.1176.70000110.3S90 I91 S97 L98 F131 L135 I141 A144 V145S90-V94 WeakPolarHBondContact O-CG2 3.48Å; S90-V94 PolarHBondContact O-N 3.06Å; I91-V94 PolarHBondContact O-N 2.99Å; V94-S97 PolarHBondContact O-N 3.38Å; V94-L98 WeakPolarHBondContact O-CB 3.43Å; V94-L98 PolarHBondContact O-N 2.87Å; V94-F131 HydrophobicContact CG1-CB 4.02Å; V94-F131 HydrophobicContact CG1-CD1 4.41Å; V94-F131 HydrophobicContact CG1-CD2 3.83Å; V94-F131 HydrophobicContact CG1-CE2 4.39Å; V94-F131 HydrophobicContact CG1-CG 3.84Å; V94-L135 HydrophobicContact CB-CD2 4.23Å; V94-L135 HydrophobicContact CG1-CD1 4.12Å; V94-L135 HydrophobicContact CG1-CD2 4.01Å; V94-L135 HydrophobicContact CG1-CG 3.9Å; V94-I141 HydrophobicContact CG2-CG2 4.33Å; V94-A144 HydrophobicContact CG1-CB 4.09Å; V94-A144 HydrophobicContact CG2-CB 3.74Å; V94-V145 HydrophobicContact CG2-CG2 3.96Å
95S97.3Very high94.8Very high0 Ų020.2 Ų20.20%012%0.116CC..Hα-helixtrans-67.1-41.1177.7-56.80000112.6S5 I91 S92 S97 L98 G99 L135S5-S95 VanDerWaalsContact CA-OG 3.27Å; S5-S95 WeakPolarHBondContact CA-OG 3.41Å; S5-S95 WeakPolarHBondContact CB-OG 3.41Å; S5-S95 WeakPolarHBondContact O-CB 3.48Å; I91-S95 WeakPolarHBondContact O-CB 3.15Å; I91-S95 PolarHBondContact O-N 2.99Å; I91-S95 PolarHBondContact O-OG 3.41Å; S92-S95 PolarHBondContact O-N 3.3Å; S95-S97 VanDerWaalsContact C-N 3.34Å; S95-L98 PolarHBondContact O-N 3.5Å; S95-G99 PolarHBondContact O-N 3.44Å; S95-L135 WeakPolarHBondContact OG-CD2 3.47Å
96Y97.7Very high95Very high8 Ų821.9 Ų21.93%0.03113%0.128CC..Hα-helixtrans-59.6-46.6173.5173.9-91.3000110.6F11 S12 H16 V63 S92 L93 G99 Y100F11-Y96 HydrophobicContact CD1-CD2 4.37Å; F11-Y96 HydrophobicContact CD1-CE2 4.48Å; F11-Y96 HydrophobicContact CE1-CE2 4.45Å; S12-Y96 WeakPolarHBondContact CB-O 3.43Å; S12-Y96 PolarHBondContact OG-O 3.33Å; H16-Y96 AromaticContact CE1-CE1 4Å; H16-Y96 AromaticContact CE1-CZ 3.53Å; H16-Y96 PolarHBondContact CE1-OH 3.45Å; H16-Y96 VanDerWaalsContact CE1-OH 3.24Å; V63-Y96 HydrophobicContact CB-CE1 3.96Å; V63-Y96 HydrophobicContact CG1-CD1 4.26Å; V63-Y96 HydrophobicContact CG1-CE1 3.59Å; V63-Y96 HydrophobicContact CG1-CE2 4.43Å; S92-Y96 WeakPolarHBondContact O-CB 3.48Å; S92-Y96 PolarHBondContact O-N 2.91Å; L93-Y96 PolarHBondContact O-N 3.18Å; Y96-G99 PolarHBondContact O-N 3.08Å; Y96-Y100 PolarHBondContact O-N 3.28Å; Y96-Y100 VanDerWaalsContact O-N 3.11Å
97S97.9Very high95.1Very high0 Ų021.1 Ų21.10%012%0.12CC..Hα-helixtrans-65.6-41.1178.6-59.70000111.7H60 L93 V94 S95 G99 Y100 F101 L148H60-S97 PolarHBondContact NE2-OG 3.18Å; L93-S97 WeakPolarHBondContact O-CB 3.3Å; L93-S97 PolarHBondContact O-N 3.3Å; L93-S97 PolarHBondContact O-OG 3.48Å; V94-S97 PolarHBondContact O-N 3.38Å; S95-S97 VanDerWaalsContact C-N 3.34Å; S97-G99 VanDerWaalsContact C-N 3.33Å; S97-G99 PolarHBondContact O-N 3.22Å; S97-Y100 WeakPolarHBondContact O-CB 3.29Å; S97-Y100 PolarHBondContact O-N 3.46Å; S97-F101 WeakPolarHBondContact O-CD2 3.32Å; S97-F101 PolarHBondContact O-N 3.44Å; S97-L148 WeakPolarHBondContact OG-CD1 3.19Å
98L97.1Very high95Very high7 Ų719.9 Ų19.94%0.03711%0.113CC..Hα-helixtrans-59.2-42.9174.1-177.660.1000111.9L9 V94 S95 Y100 F101 I102 F128 F131 L135L9-L98 HydrophobicContact CD1-CD2 4.01Å; L9-L98 HydrophobicContact CD1-CG 4.2Å; V94-L98 WeakPolarHBondContact O-CB 3.43Å; V94-L98 PolarHBondContact O-N 2.87Å; S95-L98 PolarHBondContact O-N 3.5Å; L98-Y100 VanDerWaalsContact C-N 3.32Å; L98-Y100 PolarHBondContact O-N 2.98Å; L98-F101 PolarHBondContact O-N 3.5Å; L98-I102 HydrophobicContact CD1-CD1 4.37Å; L98-I102 HydrophobicContact CD1-CG1 4.46Å; L98-I102 HydrophobicContact CG-CD1 4.08Å; L98-I102 VanDerWaalsContact O-CG1 3.32Å; L98-I102 WeakPolarHBondContact O-CG1 3.27Å; L98-I102 PolarHBondContact O-N 2.98Å; L98-F128 HydrophobicContact CD1-CB 4.49Å; L98-F128 HydrophobicContact CD1-CD2 3.6Å; L98-F128 HydrophobicContact CD1-CE2 4.18Å; L98-F128 HydrophobicContact CD1-CG 4.35Å; L98-F131 HydrophobicContact CB-CD2 4.48Å; L98-F131 HydrophobicContact CD1-CB 4.23Å; L98-L135 HydrophobicContact CB-CD1 4.46Å; L98-L135 HydrophobicContact CD2-CD1 3.63Å
99G97.2Very high94.9Very high0 Ų020.5 Ų20.50%011%0.113CC..Hα-helixtrans-59.5-40.8175.200000113V13 S95 Y96 S97 F103V13-G99 WeakPolarHBondContact CG2-O 3.3Å; S95-G99 PolarHBondContact O-N 3.44Å; Y96-G99 PolarHBondContact O-N 3.08Å; S97-G99 VanDerWaalsContact C-N 3.33Å; S97-G99 PolarHBondContact O-N 3.22Å; G99-F103 WeakPolarHBondContact O-CB 3.47Å; G99-F103 PolarHBondContact O-N 3.38Å
100Y97.3Very high94.6Very high9 Ų921.5 Ų21.54%0.03513%0.125CC..Hα-helixtrans-62.5-48.9172.6159.3-101.4000111.8S12 H16 V56 S57 H60 Y96 S97 L98 I102 F103 D104S12-Y100 PolarHBondContact OG-N 2.91Å; H16-Y100 AromaticContact CD2-CD2 3.62Å; H16-Y100 AromaticContact NE2-CD2 3.68Å; V56-Y100 HydrophobicContact CG1-CD2 4.24Å; V56-Y100 HydrophobicContact CG1-CE2 3.99Å; S57-Y100 WeakPolarHBondContact CA-OH 3.44Å; S57-Y100 WeakPolarHBondContact CB-OH 3.4Å; S57-Y100 PolarHBondContact OG-OH 3.2Å; H60-Y100 HydrophobicContact CB-CD1 3.91Å; H60-Y100 HydrophobicContact CB-CD2 3.48Å; H60-Y100 VanDerWaalsContact CB-CD2 3.48Å; H60-Y100 HydrophobicContact CB-CE1 4.03Å; H60-Y100 HydrophobicContact CB-CE2 3.62Å; H60-Y100 HydrophobicContact CB-CG 3.62Å; H60-Y100 VanDerWaalsContact CD2-CB 3.46Å; H60-Y100 WeakPolarHBondContact CD2-CB 3.38Å; H60-Y100 AromaticContact CD2-CD1 3.29Å; H60-Y100 WeakPolarHBondContact CD2-CD1 3.31Å; H60-Y100 AromaticContact CD2-CG 3.34Å; H60-Y100 AromaticContact CE1-CD1 3.56Å; H60-Y100 AromaticContact CE1-CE1 3.75Å; H60-Y100 AromaticContact CG-CD1 3.24Å; H60-Y100 AromaticContact CG-CD2 3.79Å; H60-Y100 AromaticContact CG-CE1 3.53Å; H60-Y100 AromaticContact CG-CG 3.36Å; H60-Y100 AromaticContact CG-CZ 3.92Å; H60-Y100 AromaticContact ND1-CD1 3.47Å; H60-Y100 WeakPolarHBondContact ND1-CD1 3.24Å; H60-Y100 AromaticContact ND1-CE1 3.38Å; H60-Y100 WeakPolarHBondContact ND1-CE1 3.16Å; H60-Y100 AromaticContact ND1-CZ 3.95Å; H60-Y100 AromaticContact NE2-CD1 3.49Å; H60-Y100 WeakPolarHBondContact NE2-CD1 3.47Å; Y96-Y100 PolarHBondContact O-N 3.28Å; Y96-Y100 VanDerWaalsContact O-N 3.11Å; S97-Y100 WeakPolarHBondContact O-CB 3.29Å; S97-Y100 PolarHBondContact O-N 3.46Å; L98-Y100 VanDerWaalsContact C-N 3.32Å; L98-Y100 PolarHBondContact O-N 2.98Å; Y100-I102 VanDerWaalsContact C-N 3.27Å; Y100-I102 PolarHBondContact O-N 2.67Å; Y100-F103 WeakPolarHBondContact O-CB 3.47Å; Y100-F103 PolarHBondContact O-N 3.21Å; Y100-F103 VanDerWaalsContact O-N 3.1Å; Y100-D104 HydrophobicContact CD2-CB 4.5Å; Y100-D104 HydrophobicContact CE2-CB 4Å; Y100-D104 PolarHBondContact O-N 3.06Å
101F95.6Very high93.9Very high3 Ų324 Ų241%0.01314%0.138CC..Hα-helixtrans-62.3-36.1-178.5-69.6-58.9000112.2S97 L98 S105 H124 I127 F131S97-F101 WeakPolarHBondContact O-CD2 3.32Å; S97-F101 PolarHBondContact O-N 3.44Å; L98-F101 PolarHBondContact O-N 3.5Å; F101-S105 WeakPolarHBondContact O-CB 3.41Å; F101-S105 PolarHBondContact O-N 3.47Å; F101-S105 PolarHBondContact O-OG 3.41Å; F101-H124 AromaticContact CD1-CD2 3.47Å; F101-H124 VanDerWaalsContact CD1-CD2 3.47Å; F101-H124 WeakPolarHBondContact CD1-CD2 3.46Å; F101-H124 AromaticContact CD1-CG 3.91Å; F101-H124 AromaticContact CD1-NE2 3.62Å; F101-H124 AromaticContact CE1-CD2 3.82Å; F101-H124 AromaticContact CE1-NE2 3.84Å; F101-I127 HydrophobicContact CD2-CB 4.47Å; F101-I127 HydrophobicContact CD2-CG2 3.55Å; F101-I127 HydrophobicContact CE1-CD1 3.89Å; F101-I127 HydrophobicContact CE2-CB 4.46Å; F101-I127 HydrophobicContact CE2-CD1 4.34Å; F101-I127 HydrophobicContact CE2-CG2 3.43Å; F101-I127 VanDerWaalsContact CE2-CG2 3.43Å; F101-I127 HydrophobicContact CG-CG2 4.24Å; F101-I127 HydrophobicContact CZ-CD1 3.77Å; F101-I127 HydrophobicContact CZ-CG2 3.98Å; F101-F131 HydrophobicContact CD2-CD2 4.45Å; F101-F131 HydrophobicContact CD2-CE2 4.36Å; F101-F131 HydrophobicContact CE2-CD2 4.39Å; F101-F131 AromaticContact CE2-CE2 3.87Å; F101-F131 HydrophobicContact CE2-CE2 3.87Å
102I95.4Very high92.9Very high54 Ų5423.9 Ų23.928%0.27714%0.137SC..Hα-helixtrans-63-51.4172.2-67.9165.9000110L9 L98 Y100 D104 S105 V106 F128L9-I102 HydrophobicContact CD1-CD1 4.25Å; L9-I102 HydrophobicContact CD2-CD1 4.45Å; L98-I102 HydrophobicContact CD1-CD1 4.37Å; L98-I102 HydrophobicContact CD1-CG1 4.46Å; L98-I102 HydrophobicContact CG-CD1 4.08Å; L98-I102 VanDerWaalsContact O-CG1 3.32Å; L98-I102 WeakPolarHBondContact O-CG1 3.27Å; L98-I102 PolarHBondContact O-N 2.98Å; Y100-I102 VanDerWaalsContact C-N 3.27Å; Y100-I102 PolarHBondContact O-N 2.67Å; I102-D104 PolarHBondContact O-N 2.93Å; I102-S105 PolarHBondContact O-N 2.74Å; I102-V106 WeakPolarHBondContact O-CG2 3.47Å; I102-V106 PolarHBondContact O-N 2.76Å; I102-V106 VanDerWaalsContact O-N 3.09Å; I102-F128 HydrophobicContact CD1-CD2 4.49Å; I102-F128 HydrophobicContact CD1-CE2 4.09Å; I102-F128 HydrophobicContact CG1-CD2 3.99Å; I102-F128 HydrophobicContact CG1-CE2 3.94Å
103F95.6Very high91.3Very high32 Ų3228 Ų2814%0.1416%0.163CC..Hα-helixtrans-57-51.8179175.5-91.7000111.7V13 H16 A17 D20 V56 G99 Y100 S105 V106 H107V13-F103 HydrophobicContact CG1-CD2 4.48Å; H16-F103 HydrophobicContact CB-CD1 3.7Å; H16-F103 HydrophobicContact CB-CE1 4.05Å; H16-F103 HydrophobicContact CB-CG 3.98Å; A17-F103 HydrophobicContact CB-CD2 4.34Å; A17-F103 HydrophobicContact CB-CE2 3.7Å; A17-F103 HydrophobicContact CB-CZ 4.38Å; D20-F103 HydrophobicContact CB-CE1 4.34Å; D20-F103 HydrophobicContact CB-CZ 3.82Å; V56-F103 HydrophobicContact CG1-CD1 3.98Å; V56-F103 HydrophobicContact CG1-CE1 3.78Å; V56-F103 HydrophobicContact CG2-CE1 4.33Å; G99-F103 WeakPolarHBondContact O-CB 3.47Å; G99-F103 PolarHBondContact O-N 3.38Å; Y100-F103 WeakPolarHBondContact O-CB 3.47Å; Y100-F103 PolarHBondContact O-N 3.21Å; Y100-F103 VanDerWaalsContact O-N 3.1Å; F103-S105 VanDerWaalsContact C-N 3.34Å; F103-S105 PolarHBondContact O-N 2.97Å; F103-V106 PolarHBondContact O-N 3.32Å; F103-H107 HydrophobicContact CE1-CB 4.35Å; F103-H107 VanDerWaalsContact O-CB 3.3Å; F103-H107 WeakPolarHBondContact O-CB 2.92Å; F103-H107 PolarHBondContact O-N 2.91Å
104D94.1Very high90Very high0 Ų032.4 Ų32.40%018%0.18CC..Hα-helixtrans-69-33-176-161.354.2000112N53 Y100 I102 H107 M108 H124N53-D104 VanDerWaalsContact ND2-CG 3.3Å; N53-D104 PolarHBondContact ND2-OD1 3.26Å; N53-D104 PolarHBondContact ND2-OD2 3.21Å; Y100-D104 HydrophobicContact CD2-CB 4.5Å; Y100-D104 HydrophobicContact CE2-CB 4Å; Y100-D104 PolarHBondContact O-N 3.06Å; I102-D104 PolarHBondContact O-N 2.93Å; D104-H107 PolarHBondContact O-N 3.41Å; D104-H107 IonicContact OD1-ND1 2.75Å; D104-M108 WeakPolarHBondContact O-CB 3.4Å; D104-M108 VanDerWaalsContact O-CG 3.28Å; D104-M108 WeakPolarHBondContact O-CG 3.29Å; D104-M108 PolarHBondContact O-N 2.81Å; D104-H124 IonicContact OD2-CE1 3.78Å; D104-H124 PolarHBondContact OD2-CE1 3.32Å; D104-H124 IonicContact OD2-ND1 3.9Å
105S92.9Very high88.7Confident25 Ų2543.8 Ų43.818%0.17522%0.224CC..Hα-helixtrans-62.1-45.6172.9-61.20000112.1F101 I102 F103 A109 H124F101-S105 WeakPolarHBondContact O-CB 3.41Å; F101-S105 PolarHBondContact O-N 3.47Å; F101-S105 PolarHBondContact O-OG 3.41Å; I102-S105 PolarHBondContact O-N 2.74Å; F103-S105 VanDerWaalsContact C-N 3.34Å; F103-S105 PolarHBondContact O-N 2.97Å; S105-A109 VanDerWaalsContact O-CB 3.32Å; S105-A109 WeakPolarHBondContact O-CB 3.23Å; S105-A109 PolarHBondContact O-N 3.1Å; S105-H124 VanDerWaalsContact OG-CB 3.3Å; S105-H124 WeakPolarHBondContact OG-CB 3.35Å; S105-H124 PolarHBondContact OG-ND1 2.87Å
106V92.9Very high87.3Confident79 Ų7948 Ų4848%0.47925%0.253SS..Hα-helixtrans-65.6-43.7176.11730000110.7I102 F103 M108 A109 I110I102-V106 WeakPolarHBondContact O-CG2 3.47Å; I102-V106 PolarHBondContact O-N 2.76Å; I102-V106 VanDerWaalsContact O-N 3.09Å; F103-V106 PolarHBondContact O-N 3.32Å; V106-M108 PolarHBondContact O-N 3.43Å; V106-A109 PolarHBondContact O-N 3.4Å; V106-I110 HydrophobicContact CG1-CD1 3.57Å; V106-I110 HydrophobicContact CG1-CG1 4.32Å; V106-I110 WeakPolarHBondContact O-CG1 3.44Å; V106-I110 PolarHBondContact O-N 3.32Å
107H91.2Very high86.4Confident14 Ų1448.4 Ų48.47%0.06526%0.256CS..Hα-helixtrans-59.6-44.7178.2-176.6-115.6000112D20 F49 F103 D104 L111D20-H107 IonicContact OD1-CE1 2.77Å; D20-H107 IonicContact OD1-NE2 3.21Å; D20-H107 PolarHBondContact OD1-NE2 3.49Å; F49-H107 AromaticContact CD2-CE1 3.96Å; F49-H107 AromaticContact CE2-ND1 3.9Å; F103-H107 HydrophobicContact CE1-CB 4.35Å; F103-H107 VanDerWaalsContact O-CB 3.3Å; F103-H107 WeakPolarHBondContact O-CB 2.92Å; F103-H107 PolarHBondContact O-N 2.91Å; D104-H107 PolarHBondContact O-N 3.41Å; D104-H107 IonicContact OD1-ND1 2.75Å; H107-L111 WeakPolarHBondContact CD2-CD1 3.49Å; H107-L111 WeakPolarHBondContact NE2-CD1 3.33Å; H107-L111 WeakPolarHBondContact O-CB 3.43Å; H107-L111 PolarHBondContact O-N 3.45Å
108M90.5Very high85.7Confident3 Ų350.9 Ų50.92%0.01528%0.277CS..Hα-helixtrans-63.6-44.3173.5-75.6-165.4-77.200113F49 D104 V106 I110 H112 T117 L120 L121 H124F49-M108 HydrophobicContact CE2-CG 4.03Å; F49-M108 HydrophobicContact CZ-CG 3.82Å; D104-M108 WeakPolarHBondContact O-CB 3.4Å; D104-M108 VanDerWaalsContact O-CG 3.28Å; D104-M108 WeakPolarHBondContact O-CG 3.29Å; D104-M108 PolarHBondContact O-N 2.81Å; V106-M108 PolarHBondContact O-N 3.43Å; M108-I110 VanDerWaalsContact C-N 3.34Å; M108-I110 PolarHBondContact O-N 2.96Å; M108-H112 CarbonylContact O-C 3.55Å; M108-H112 PolarHBondContact O-N 3.03Å; M108-H112 VanDerWaalsContact O-N 3.13Å; M108-T117 HydrophobicContact SD-CG2 4.41Å; M108-L120 HydrophobicContact CE-CB 4.39Å; M108-L120 HydrophobicContact CE-CD2 4.09Å; M108-L120 HydrophobicContact CE-CG 3.93Å; M108-L120 HydrophobicContact SD-CB 4.06Å; M108-L120 HydrophobicContact SD-CD2 3.62Å; M108-L120 HydrophobicContact SD-CG 3.92Å; M108-L121 HydrophobicContact CE-CD1 4.42Å; M108-H124 VanDerWaalsContact CE-CE1 3.49Å; M108-H124 WeakPolarHBondContact CE-CE1 3.49Å; M108-H124 WeakPolarHBondContact CE-ND1 3.23Å
109A87.8Confident85.1Confident62 Ų6252.9 Ų52.951%0.51229%0.286SS..Hα-helixtrans-64.2-38.1-17800000112.5S105 V106S105-A109 VanDerWaalsContact O-CB 3.32Å; S105-A109 WeakPolarHBondContact O-CB 3.23Å; S105-A109 PolarHBondContact O-N 3.1Å; V106-A109 PolarHBondContact O-N 3.4Å
110I86.1Confident84.7Confident123 Ų12355.4 Ų55.463%0.63130%0.299SS*.Hα-helixtrans-80.5-48-178.8-64171.5000111.5V106 M108V106-I110 HydrophobicContact CG1-CD1 3.57Å; V106-I110 HydrophobicContact CG1-CG1 4.32Å; V106-I110 WeakPolarHBondContact O-CG1 3.44Å; V106-I110 PolarHBondContact O-N 3.32Å; M108-I110 VanDerWaalsContact C-N 3.34Å; M108-I110 PolarHBondContact O-N 2.96Å
111L78.9Confident84.3Confident54 Ų5458.4 Ų58.428%0.28332%0.315SS..Hα-helixtrans-94.4-21.5-165.8-65.1-179.8000114.7Q45 F49 H107Q45-L111 PolarHBondContact NE2-O 3.32Å; F49-L111 HydrophobicContact CD2-CB 4.07Å; H107-L111 WeakPolarHBondContact CD2-CD1 3.49Å; H107-L111 WeakPolarHBondContact NE2-CD1 3.33Å; H107-L111 WeakPolarHBondContact O-CB 3.43Å; H107-L111 PolarHBondContact O-N 3.45Å
112H74.7Confident84.1Confident6 Ų662 Ų623%0.02834%0.337CS..  trans-155.172.7-169.2-149.4-93.1000114.6R46 F49 M108 Y114 T117R46-H112 WeakPolarHBondContact CA-NE2 3.49Å; R46-H112 WeakPolarHBondContact CB-NE2 3.27Å; R46-H112 WeakPolarHBondContact CG-NE2 3.28Å; F49-H112 HydrophobicContact CB-CB 4.26Å; F49-H112 HydrophobicContact CD1-CB 3.54Å; F49-H112 AromaticContact CD1-CD2 3.66Å; F49-H112 AromaticContact CD1-CG 3.37Å; F49-H112 AromaticContact CD1-ND1 3.75Å; F49-H112 HydrophobicContact CD2-CB 3.66Å; F49-H112 HydrophobicContact CE1-CB 3.75Å; F49-H112 AromaticContact CE1-CG 3.79Å; F49-H112 AromaticContact CE1-ND1 3.88Å; F49-H112 HydrophobicContact CE2-CB 3.86Å; F49-H112 HydrophobicContact CG-CB 3.51Å; F49-H112 AromaticContact CG-CD2 3.86Å; F49-H112 AromaticContact CG-CG 3.71Å; F49-H112 HydrophobicContact CZ-CB 3.91Å; M108-H112 CarbonylContact O-C 3.55Å; M108-H112 PolarHBondContact O-N 3.03Å; M108-H112 VanDerWaalsContact O-N 3.13Å; H112-Y114 HydrophobicContact CB-CD2 4.49Å; H112-Y114 AromaticContact CD2-CD2 3.75Å; H112-Y114 AromaticContact CD2-CE2 3.62Å; H112-Y114 AromaticContact CE1-CD2 2.95Å; H112-Y114 WeakPolarHBondContact CE1-CD2 3.35Å; H112-Y114 AromaticContact CE1-CE2 3.35Å; H112-Y114 WeakPolarHBondContact CE1-CE2 3.33Å; H112-Y114 AromaticContact CE1-CG 3.59Å; H112-Y114 AromaticContact CG-CD2 3.56Å; H112-Y114 AromaticContact CG-CE2 3.92Å; H112-Y114 AromaticContact ND1-CD2 3.08Å; H112-Y114 WeakPolarHBondContact ND1-CD2 3.43Å; H112-Y114 AromaticContact ND1-CE2 3.78Å; H112-Y114 AromaticContact ND1-CG 3.83Å; H112-Y114 AromaticContact NE2-CD2 3.39Å; H112-Y114 WeakPolarHBondContact NE2-CD2 3.16Å; H112-Y114 AromaticContact NE2-CE2 3.24Å; H112-Y114 WeakPolarHBondContact NE2-CE2 3.34Å; H112-Y114 PolarHBondContact O-N 2.64Å; H112-T117 PolarHBondContact O-OG1 3.45Å
113P63.1Low83.9Confident109 Ų10961.1 Ų61.171%0.70833%0.332SS*.  trans-79.962.8179.334.6-36.7000112.2
114Y69.9Low83.8Confident92 Ų9259.7 Ų59.736%0.36133%0.326SS..  trans-104.9155176.1-72.1-96000111.2H112 S116 T117 A118H112-Y114 HydrophobicContact CB-CD2 4.49Å; H112-Y114 AromaticContact CD2-CD2 3.75Å; H112-Y114 AromaticContact CD2-CE2 3.62Å; H112-Y114 AromaticContact CE1-CD2 2.95Å; H112-Y114 WeakPolarHBondContact CE1-CD2 3.35Å; H112-Y114 AromaticContact CE1-CE2 3.35Å; H112-Y114 WeakPolarHBondContact CE1-CE2 3.33Å; H112-Y114 AromaticContact CE1-CG 3.59Å; H112-Y114 AromaticContact CG-CD2 3.56Å; H112-Y114 AromaticContact CG-CE2 3.92Å; H112-Y114 AromaticContact ND1-CD2 3.08Å; H112-Y114 WeakPolarHBondContact ND1-CD2 3.43Å; H112-Y114 AromaticContact ND1-CE2 3.78Å; H112-Y114 AromaticContact ND1-CG 3.83Å; H112-Y114 AromaticContact NE2-CD2 3.39Å; H112-Y114 WeakPolarHBondContact NE2-CD2 3.16Å; H112-Y114 AromaticContact NE2-CE2 3.24Å; H112-Y114 WeakPolarHBondContact NE2-CE2 3.34Å; H112-Y114 PolarHBondContact O-N 2.64Å; Y114-S116 PolarHBondContact O-N 2.92Å; Y114-T117 PolarHBondContact N-OG1 2.75Å; Y114-T117 PolarHBondContact O-N 2.95Å; Y114-T117 PolarHBondContact O-OG1 3.07Å; Y114-A118 PolarHBondContact O-N 3.32Å
115R68.7Low83.8Confident240 Ų24065.7 Ų65.791%0.90635%0.352SS*.Hα-helixtrans-54.9-30.9179.6-75.9-169.7171.3150.5-1.5114T117 A118R115-T117 VanDerWaalsContact C-N 3.29Å; R115-T117 PolarHBondContact O-N 2.94Å; R115-A118 WeakPolarHBondContact O-CB 3.38Å; R115-A118 PolarHBondContact O-N 3.4Å
116S69.3Low83.9Confident88 Ų8865.4 Ų65.462%0.61535%0.349SS*.Hα-helixtrans-67-28.1177.2620000113.5Y114Y114-S116 PolarHBondContact O-N 2.92Å
117T78.1Confident84Confident17 Ų1762.4 Ų62.410%0.10433%0.33CS..Hα-helixtrans-84.7-19.8176.355.40000111.9F49 M108 H112 Y114 R115 E119 L120 L121F49-T117 HydrophobicContact CE1-CG2 3.87Å; F49-T117 HydrophobicContact CZ-CG2 3.97Å; M108-T117 HydrophobicContact SD-CG2 4.41Å; H112-T117 PolarHBondContact O-OG1 3.45Å; Y114-T117 PolarHBondContact N-OG1 2.75Å; Y114-T117 PolarHBondContact O-N 2.95Å; Y114-T117 PolarHBondContact O-OG1 3.07Å; R115-T117 VanDerWaalsContact C-N 3.29Å; R115-T117 PolarHBondContact O-N 2.94Å; T117-E119 VanDerWaalsContact C-N 3.33Å; T117-E119 PolarHBondContact O-N 3.09Å; T117-L120 PolarHBondContact O-N 3.46Å; T117-L121 WeakPolarHBondContact O-CB 3.4Å; T117-L121 PolarHBondContact O-N 3.04Å
118A82.3Confident84.1Confident52 Ų5265.5 Ų65.543%0.4334%0.344SS..Hα-helixtrans-61.2-40.8176.700000112.4Y114 R115 L120 L121 V122Y114-A118 PolarHBondContact O-N 3.32Å; R115-A118 WeakPolarHBondContact O-CB 3.38Å; R115-A118 PolarHBondContact O-N 3.4Å; A118-L120 VanDerWaalsContact C-N 3.33Å; A118-L120 PolarHBondContact O-N 3.34Å; A118-L121 PolarHBondContact O-N 3.38Å; A118-V122 WeakPolarHBondContact O-CG2 3.21Å; A118-V122 PolarHBondContact O-N 3.46Å
119E86.3Confident84.4Confident49 Ų4968.5 Ų68.523%0.22936%0.359CS..Hα-helixtrans-58.1-46.7174.3178.3179.5172.300110.9T117 L121 V122 H123 M226 R233T117-E119 VanDerWaalsContact C-N 3.33Å; T117-E119 PolarHBondContact O-N 3.09Å; E119-L121 VanDerWaalsContact C-N 3.34Å; E119-L121 PolarHBondContact O-N 3.04Å; E119-V122 PolarHBondContact O-N 3.09Å; E119-H123 PolarHBondContact O-N 3.03Å; E119-M226 HydrophobicContact CG-CE 3.57Å; E119-M226 HydrophobicContact CG-SD 4.46Å; E119-M226 VanDerWaalsContact O-CE 3.28Å; E119-M226 WeakPolarHBondContact O-CE 3.33Å; E119-R233 IonicContact OE1-NH1 3.95Å; E119-R233 IonicContact OE2-CZ 3.77Å; E119-R233 IonicContact OE2-NH1 3.17Å; E119-R233 PolarHBondContact OE2-NH1 3.37Å; E119-R233 IonicContact OE2-NH2 3.83Å; E119-R233 PolarHBondContact OE2-NH2 2.79Å
120L87.2Confident84.7Confident53 Ų5367.1 Ų67.128%0.27735%0.346SS..Hα-helixtrans-68.5-32.5178.7-170.560.3000112.7M108 T117 A118 H123 H124M108-L120 HydrophobicContact CE-CB 4.39Å; M108-L120 HydrophobicContact CE-CD2 4.09Å; M108-L120 HydrophobicContact CE-CG 3.93Å; M108-L120 HydrophobicContact SD-CB 4.06Å; M108-L120 HydrophobicContact SD-CD2 3.62Å; M108-L120 HydrophobicContact SD-CG 3.92Å; T117-L120 PolarHBondContact O-N 3.46Å; A118-L120 VanDerWaalsContact C-N 3.33Å; A118-L120 PolarHBondContact O-N 3.34Å; L120-H123 WeakPolarHBondContact O-CB 3.23Å; L120-H123 PolarHBondContact O-N 2.68Å; L120-H124 PolarHBondContact O-N 3.4Å
121L89.2Confident85.2Confident72 Ų7261.5 Ų61.538%0.37732%0.317SS..Hα-helixtrans-68.1-37.4176-169.165.7000111.9M108 T117 A118 E119 H123 H124 F125M108-L121 HydrophobicContact CE-CD1 4.42Å; T117-L121 WeakPolarHBondContact O-CB 3.4Å; T117-L121 PolarHBondContact O-N 3.04Å; A118-L121 PolarHBondContact O-N 3.38Å; E119-L121 VanDerWaalsContact C-N 3.34Å; E119-L121 PolarHBondContact O-N 3.04Å; L121-H123 VanDerWaalsContact C-N 3.32Å; L121-H124 PolarHBondContact O-N 3.33Å; L121-F125 WeakPolarHBondContact O-CB 3.34Å; L121-F125 PolarHBondContact O-N 3.42Å
122V91.1Very high86Confident77 Ų7760.1 Ų60.147%0.46731%0.312SS..Hα-helixtrans-61.8-42.9172.2171.80000110.6A118 E119 H124 F125 V126 V222A118-V122 WeakPolarHBondContact O-CG2 3.21Å; A118-V122 PolarHBondContact O-N 3.46Å; E119-V122 PolarHBondContact O-N 3.09Å; V122-H124 PolarHBondContact O-N 2.94Å; V122-F125 PolarHBondContact O-N 3.46Å; V122-V126 WeakPolarHBondContact O-CG2 3.46Å; V122-V126 PolarHBondContact O-N 3.2Å; V122-V222 HydrophobicContact CG1-CG1 4.07Å
123H92.3Very high86.9Confident36 Ų3661.1 Ų61.117%0.16732%0.32CS..Hα-helixtrans-56.8-49.9173.717176.7000112.3E119 L120 L121 F125 V126 I127 L223 M226E119-H123 PolarHBondContact O-N 3.03Å; L120-H123 WeakPolarHBondContact O-CB 3.23Å; L120-H123 PolarHBondContact O-N 2.68Å; L121-H123 VanDerWaalsContact C-N 3.32Å; H123-F125 VanDerWaalsContact C-N 3.31Å; H123-F125 PolarHBondContact O-N 2.86Å; H123-V126 PolarHBondContact O-N 3.26Å; H123-I127 WeakPolarHBondContact CE1-CD1 3.34Å; H123-I127 VanDerWaalsContact NE2-CD1 3.32Å; H123-I127 WeakPolarHBondContact NE2-CD1 3.48Å; H123-I127 WeakPolarHBondContact O-CG1 3.39Å; H123-I127 PolarHBondContact O-N 2.84Å; H123-L223 WeakPolarHBondContact ND1-CD2 3.45Å; H123-M226 HydrophobicContact CB-CE 3.46Å; H123-M226 VanDerWaalsContact CB-CE 3.46Å; H123-M226 HydrophobicContact CB-SD 3.8Å
124H93.4Very high88.4Confident3 Ų356.1 Ų56.11%0.01429%0.287CS..Hα-helixtrans-64.7-37.1178.9-69.3-174.5000112.5F101 D104 S105 M108 L120 L121 V122 I127 F128F101-H124 AromaticContact CD1-CD2 3.47Å; F101-H124 VanDerWaalsContact CD1-CD2 3.47Å; F101-H124 WeakPolarHBondContact CD1-CD2 3.46Å; F101-H124 AromaticContact CD1-CG 3.91Å; F101-H124 AromaticContact CD1-NE2 3.62Å; F101-H124 AromaticContact CE1-CD2 3.82Å; F101-H124 AromaticContact CE1-NE2 3.84Å; D104-H124 IonicContact OD2-CE1 3.78Å; D104-H124 PolarHBondContact OD2-CE1 3.32Å; D104-H124 IonicContact OD2-ND1 3.9Å; S105-H124 VanDerWaalsContact OG-CB 3.3Å; S105-H124 WeakPolarHBondContact OG-CB 3.35Å; S105-H124 PolarHBondContact OG-ND1 2.87Å; M108-H124 VanDerWaalsContact CE-CE1 3.49Å; M108-H124 WeakPolarHBondContact CE-CE1 3.49Å; M108-H124 WeakPolarHBondContact CE-ND1 3.23Å; L120-H124 PolarHBondContact O-N 3.4Å; L121-H124 PolarHBondContact O-N 3.33Å; V122-H124 PolarHBondContact O-N 2.94Å; H124-I127 PolarHBondContact O-N 3.05Å; H124-F128 WeakPolarHBondContact O-CB 3.46Å; H124-F128 PolarHBondContact O-N 2.99Å
125F93.3Very high89.6Confident125 Ų12553.5 Ų53.555%0.54828%0.279SS..Hα-helixtrans-63.4-44.5176.9-177.9-108000112L121 V122 H123 F128 L129L121-F125 WeakPolarHBondContact O-CB 3.34Å; L121-F125 PolarHBondContact O-N 3.42Å; V122-F125 PolarHBondContact O-N 3.46Å; H123-F125 VanDerWaalsContact C-N 3.31Å; H123-F125 PolarHBondContact O-N 2.86Å; F125-F128 WeakPolarHBondContact O-CB 3.48Å; F125-F128 PolarHBondContact O-N 3.48Å; F125-L129 HydrophobicContact CD1-CD1 4.22Å; F125-L129 HydrophobicContact CE1-CD1 3.65Å; F125-L129 HydrophobicContact CE1-CG 4.4Å; F125-L129 HydrophobicContact CE2-CG 4.48Å; F125-L129 HydrophobicContact CZ-CD1 3.82Å; F125-L129 HydrophobicContact CZ-CD2 4.41Å; F125-L129 HydrophobicContact CZ-CG 4.25Å; F125-L129 WeakPolarHBondContact O-CG 3.32Å; F125-L129 PolarHBondContact O-N 3.45Å; F125-L129 VanDerWaalsContact O-N 3.09Å
126V95.2Very high90.8Very high19 Ų1949.1 Ų49.112%0.11527%0.273CS..Hα-helixtrans-61.1-47.7175.5170.30000110.9V122 H123 F128 L129 C130 V222V122-V126 WeakPolarHBondContact O-CG2 3.46Å; V122-V126 PolarHBondContact O-N 3.2Å; H123-V126 PolarHBondContact O-N 3.26Å; V126-F128 VanDerWaalsContact C-N 3.33Å; V126-F128 PolarHBondContact O-N 3.47Å; V126-L129 PolarHBondContact O-N 2.9Å; V126-C130 PolarHBondContact O-N 3.07Å; V126-C130 VanDerWaalsContact O-N 3.07Å; V126-C130 PolarHBondContact O-SG 3.47Å; V126-C130 VanDerWaalsContact O-SG 3.38Å; V126-V222 HydrophobicContact CG2-CG1 4.27Å
127I94.6Very high91.9Very high16 Ų1646.6 Ų46.68%0.08226%0.255CS..Hα-helixtrans-63.8-41.6179.2-66170.6000111F101 H123 H124 L129 C130 F131F101-I127 HydrophobicContact CD2-CB 4.47Å; F101-I127 HydrophobicContact CD2-CG2 3.55Å; F101-I127 HydrophobicContact CE1-CD1 3.89Å; F101-I127 HydrophobicContact CE2-CB 4.46Å; F101-I127 HydrophobicContact CE2-CD1 4.34Å; F101-I127 HydrophobicContact CE2-CG2 3.43Å; F101-I127 VanDerWaalsContact CE2-CG2 3.43Å; F101-I127 HydrophobicContact CG-CG2 4.24Å; F101-I127 HydrophobicContact CZ-CD1 3.77Å; F101-I127 HydrophobicContact CZ-CG2 3.98Å; H123-I127 WeakPolarHBondContact CE1-CD1 3.34Å; H123-I127 VanDerWaalsContact NE2-CD1 3.32Å; H123-I127 WeakPolarHBondContact NE2-CD1 3.48Å; H123-I127 WeakPolarHBondContact O-CG1 3.39Å; H123-I127 PolarHBondContact O-N 2.84Å; H124-I127 PolarHBondContact O-N 3.05Å; I127-L129 VanDerWaalsContact C-N 3.32Å; I127-L129 PolarHBondContact O-N 3.21Å; I127-C130 PolarHBondContact O-N 2.95Å; I127-F131 HydrophobicContact CG2-CD1 3.97Å; I127-F131 HydrophobicContact CG2-CD2 3.79Å; I127-F131 HydrophobicContact CG2-CE1 3.89Å; I127-F131 HydrophobicContact CG2-CE2 3.73Å; I127-F131 HydrophobicContact CG2-CG 3.91Å; I127-F131 HydrophobicContact CG2-CZ 3.77Å; I127-F131 WeakPolarHBondContact O-CB 3.49Å; I127-F131 PolarHBondContact O-N 3.24Å
128F94.9Very high92.5Very high79 Ų7946.9 Ų46.935%0.34626%0.262SS..Hα-helixtrans-55.3-47.6177.1173.8-91000111.4L98 I102 H124 F125 V126 S132L98-F128 HydrophobicContact CD1-CB 4.49Å; L98-F128 HydrophobicContact CD1-CD2 3.6Å; L98-F128 HydrophobicContact CD1-CE2 4.18Å; L98-F128 HydrophobicContact CD1-CG 4.35Å; I102-F128 HydrophobicContact CD1-CD2 4.49Å; I102-F128 HydrophobicContact CD1-CE2 4.09Å; I102-F128 HydrophobicContact CG1-CD2 3.99Å; I102-F128 HydrophobicContact CG1-CE2 3.94Å; H124-F128 WeakPolarHBondContact O-CB 3.46Å; H124-F128 PolarHBondContact O-N 2.99Å; F125-F128 WeakPolarHBondContact O-CB 3.48Å; F125-F128 PolarHBondContact O-N 3.48Å; V126-F128 VanDerWaalsContact C-N 3.33Å; V126-F128 PolarHBondContact O-N 3.47Å; F128-S132 WeakPolarHBondContact O-CB 2.95Å; F128-S132 PolarHBondContact O-N 3.46Å; F128-S132 PolarHBondContact O-OG 3.04Å
129L95.6Very high93Very high66 Ų6647.4 Ų47.435%0.34626%0.257SS..Hα-helixtrans-63.4-48.9177.5-67.9177.7000111.7F125 V126 I127 F131 S133 L215F125-L129 HydrophobicContact CD1-CD1 4.22Å; F125-L129 HydrophobicContact CE1-CD1 3.65Å; F125-L129 HydrophobicContact CE1-CG 4.4Å; F125-L129 HydrophobicContact CE2-CG 4.48Å; F125-L129 HydrophobicContact CZ-CD1 3.82Å; F125-L129 HydrophobicContact CZ-CD2 4.41Å; F125-L129 HydrophobicContact CZ-CG 4.25Å; F125-L129 WeakPolarHBondContact O-CG 3.32Å; F125-L129 PolarHBondContact O-N 3.45Å; F125-L129 VanDerWaalsContact O-N 3.09Å; V126-L129 PolarHBondContact O-N 2.9Å; I127-L129 VanDerWaalsContact C-N 3.32Å; I127-L129 PolarHBondContact O-N 3.21Å; L129-F131 PolarHBondContact O-N 2.97Å; L129-S133 VanDerWaalsContact O-CB 3.31Å; L129-S133 WeakPolarHBondContact O-CB 3.33Å; L129-S133 PolarHBondContact O-N 2.91Å; L129-S133 PolarHBondContact O-OG 3.2Å; L129-L215 HydrophobicContact CB-CD1 3.88Å; L129-L215 HydrophobicContact CD1-CD1 4.36Å
130C95.6Very high93.3Very high34 Ų3446.5 Ų46.523%0.2325%0.252CS..Hα-helixtrans-59-50.3179.4-70.30000111.7V126 I127 S133 A134V126-C130 PolarHBondContact O-N 3.07Å; V126-C130 VanDerWaalsContact O-N 3.07Å; V126-C130 PolarHBondContact O-SG 3.47Å; V126-C130 VanDerWaalsContact O-SG 3.38Å; I127-C130 PolarHBondContact O-N 2.95Å; C130-S133 PolarHBondContact O-N 2.81Å; C130-S133 PolarHBondContact O-OG 2.98Å; C130-A134 PolarHBondContact O-N 3.33Å
131F96.4Very high93.7Very high4 Ų444 Ų442%0.01824%0.239CC..Hα-helixtrans-71.6-39.6-175.1-76.616.5000111.9V94 L98 F101 I127 L129 S133 A134 L135 A144 S147 L148V94-F131 HydrophobicContact CG1-CB 4.02Å; V94-F131 HydrophobicContact CG1-CD1 4.41Å; V94-F131 HydrophobicContact CG1-CD2 3.83Å; V94-F131 HydrophobicContact CG1-CE2 4.39Å; V94-F131 HydrophobicContact CG1-CG 3.84Å; L98-F131 HydrophobicContact CB-CD2 4.48Å; L98-F131 HydrophobicContact CD1-CB 4.23Å; F101-F131 HydrophobicContact CD2-CD2 4.45Å; F101-F131 HydrophobicContact CD2-CE2 4.36Å; F101-F131 HydrophobicContact CE2-CD2 4.39Å; F101-F131 AromaticContact CE2-CE2 3.87Å; F101-F131 HydrophobicContact CE2-CE2 3.87Å; I127-F131 HydrophobicContact CG2-CD1 3.97Å; I127-F131 HydrophobicContact CG2-CD2 3.79Å; I127-F131 HydrophobicContact CG2-CE1 3.89Å; I127-F131 HydrophobicContact CG2-CE2 3.73Å; I127-F131 HydrophobicContact CG2-CG 3.91Å; I127-F131 HydrophobicContact CG2-CZ 3.77Å; I127-F131 WeakPolarHBondContact O-CB 3.49Å; I127-F131 PolarHBondContact O-N 3.24Å; L129-F131 PolarHBondContact O-N 2.97Å; F131-S133 VanDerWaalsContact C-N 3.33Å; F131-S133 PolarHBondContact O-N 3.4Å; F131-A134 PolarHBondContact O-N 3.5Å; F131-L135 WeakPolarHBondContact O-CB 3.49Å; F131-L135 VanDerWaalsContact O-CG 3.31Å; F131-L135 WeakPolarHBondContact O-CG 3.29Å; F131-L135 PolarHBondContact O-N 2.88Å; F131-A144 HydrophobicContact CD1-CB 4.06Å; F131-A144 HydrophobicContact CE1-CB 3.99Å; F131-S147 WeakPolarHBondContact CE1-OG 3.1Å; F131-S147 VanDerWaalsContact CZ-OG 3.32Å; F131-S147 WeakPolarHBondContact CZ-OG 3.42Å; F131-L148 HydrophobicContact CE2-CD1 4.23Å; F131-L148 HydrophobicContact CE2-CD2 3.85Å; F131-L148 HydrophobicContact CE2-CG 4.13Å; F131-L148 HydrophobicContact CZ-CD1 4.27Å; F131-L148 HydrophobicContact CZ-CD2 3.79Å; F131-L148 HydrophobicContact CZ-CG 3.81Å
132S94.9Very high94Very high25 Ų2540.6 Ų40.618%0.17522%0.221CC..Hα-helixtrans-63.1-42.3175.8-61.50000110.6F128 A134 L135 L136F128-S132 WeakPolarHBondContact O-CB 2.95Å; F128-S132 PolarHBondContact O-N 3.46Å; F128-S132 PolarHBondContact O-OG 3.04Å; S132-A134 PolarHBondContact O-N 2.9Å; S132-L135 PolarHBondContact O-N 2.77Å; S132-L136 VanDerWaalsContact O-CB 3.29Å; S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 WeakPolarHBondContact O-CG 3.44Å; S132-L136 PolarHBondContact O-N 3.15Å
133S94.6Very high94.1Very high28 Ų2838.2 Ų38.220%0.19620%0.204CC..Hα-helixtrans-62.7-40.617677.80000112.9L129 C130 F131 S137 L215L129-S133 VanDerWaalsContact O-CB 3.31Å; L129-S133 WeakPolarHBondContact O-CB 3.33Å; L129-S133 PolarHBondContact O-N 2.91Å; L129-S133 PolarHBondContact O-OG 3.2Å; C130-S133 PolarHBondContact O-N 2.81Å; C130-S133 PolarHBondContact O-OG 2.98Å; F131-S133 VanDerWaalsContact C-N 3.33Å; F131-S133 PolarHBondContact O-N 3.4Å; S133-S137 VanDerWaalsContact O-CB 3.31Å; S133-S137 WeakPolarHBondContact O-CB 3.41Å; S133-S137 PolarHBondContact O-N 2.89Å; S133-S137 PolarHBondContact O-OG 3.33Å; S133-L215 WeakPolarHBondContact OG-CD2 3.3Å
134A94.4Very high94.3Very high4 Ų436.8 Ų36.83%0.03320%0.198CC..Hα-helixtrans-67.3-45.3177.500000111.7C130 F131 S132 S137 G138 N139 I141 A144C130-A134 PolarHBondContact O-N 3.33Å; F131-A134 PolarHBondContact O-N 3.5Å; S132-A134 PolarHBondContact O-N 2.9Å; A134-S137 PolarHBondContact O-OG 3.11Å; A134-G138 WeakPolarHBondContact O-CA 3.41Å; A134-G138 PolarHBondContact O-N 3.02Å; A134-N139 VanDerWaalsContact CA-O 3.32Å; A134-N139 WeakPolarHBondContact CA-O 3.46Å; A134-I141 HydrophobicContact CB-CD1 4.06Å; A134-I141 WeakPolarHBondContact O-CD1 3.12Å; A134-A144 HydrophobicContact CB-CB 4.37Å
135L94.6Very high94.5Very high36 Ų3636.7 Ų36.719%0.18820%0.198CC..Hα-helixtrans-67-39178.6-70.7172.6000113I91 V94 S95 L98 F131 S132 I141I91-L135 HydrophobicContact CG2-CD2 4.07Å; V94-L135 HydrophobicContact CB-CD2 4.23Å; V94-L135 HydrophobicContact CG1-CD1 4.12Å; V94-L135 HydrophobicContact CG1-CD2 4.01Å; V94-L135 HydrophobicContact CG1-CG 3.9Å; S95-L135 WeakPolarHBondContact OG-CD2 3.47Å; L98-L135 HydrophobicContact CB-CD1 4.46Å; L98-L135 HydrophobicContact CD2-CD1 3.63Å; F131-L135 WeakPolarHBondContact O-CB 3.49Å; F131-L135 VanDerWaalsContact O-CG 3.31Å; F131-L135 WeakPolarHBondContact O-CG 3.29Å; F131-L135 PolarHBondContact O-N 2.88Å; S132-L135 PolarHBondContact O-N 2.77Å; L135-I141 HydrophobicContact CD2-CD1 4.08Å
136L93.3Very high94.6Very high148 Ų14831 Ų3178%0.77517%0.173SC*.Hα-helixtrans-70.7-38178.9-72.3173.1000112.2S132S132-L136 VanDerWaalsContact O-CB 3.29Å; S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 WeakPolarHBondContact O-CG 3.44Å; S132-L136 PolarHBondContact O-N 3.15Å
137S92.5Very high94.7Very high35 Ų3531.6 Ų31.625%0.24518%0.178CC..Hα-helixtrans-79.9-23.2178.1630000113.4S133 A134 N139 Y212S133-S137 VanDerWaalsContact O-CB 3.31Å; S133-S137 WeakPolarHBondContact O-CB 3.41Å; S133-S137 PolarHBondContact O-N 2.89Å; S133-S137 PolarHBondContact O-OG 3.33Å; A134-S137 PolarHBondContact O-OG 3.11Å; S137-N139 PolarHBondContact O-N 3.3Å; S137-N139 PolarHBondContact OG-N 3.29Å; S137-N139 PolarHBondContact OG-O 2.84Å; S137-Y212 WeakPolarHBondContact CB-OH 3.39Å
138G91.2Very high94.8Very high23 Ų2330.9 Ų30.924%0.23718%0.175CC..SBendtrans71.80.3-169.600000113.9A134A134-G138 WeakPolarHBondContact O-CA 3.41Å; A134-G138 PolarHBondContact O-N 3.02Å
139N91.9Very high94.9Very high63 Ų6328.1 Ų28.134%0.33716%0.163SC..  trans-108.9164.7-178.8-62.8-42.9000110.3I83 A134 S137 I141I83-N139 CarbonylContact O-C 3.55Å; I83-N139 WeakPolarHBondContact O-CA 3.49Å; A134-N139 VanDerWaalsContact CA-O 3.32Å; A134-N139 WeakPolarHBondContact CA-O 3.46Å; S137-N139 PolarHBondContact O-N 3.3Å; S137-N139 PolarHBondContact OG-N 3.29Å; S137-N139 PolarHBondContact OG-O 2.84Å; N139-I141 PolarHBondContact O-N 2.99Å; N139-I141 VanDerWaalsContact O-N 3.12Å
140Y94Very high94.9Very high30 Ų3025.7 Ų25.712%0.11815%0.152CC..SBendtrans61.717.4179-44.4-71.5000114.1L82 I83 G142 Y143 A144 V208 P209 Y212L82-Y140 WeakPolarHBondContact O-CA 3.31Å; I83-Y140 HydrophobicContact CB-CD1 4.39Å; I83-Y140 HydrophobicContact CB-CE1 4.23Å; I83-Y140 HydrophobicContact CG1-CD1 4.22Å; I83-Y140 HydrophobicContact CG1-CE1 4.02Å; I83-Y140 HydrophobicContact CG2-CD1 4.17Å; I83-Y140 HydrophobicContact CG2-CE1 3.64Å; I83-Y140 PolarHBondContact O-N 2.81Å; Y140-G142 VanDerWaalsContact C-N 3.31Å; Y140-G142 PolarHBondContact O-N 3.48Å; Y140-Y143 WeakPolarHBondContact O-CB 3.3Å; Y140-Y143 PolarHBondContact O-N 3.47Å; Y140-Y143 VanDerWaalsContact O-N 3.16Å; Y140-A144 PolarHBondContact O-N 3.31Å; Y140-V208 HydrophobicContact CE1-CG1 4.35Å; Y140-V208 HydrophobicContact CE1-CG2 4.2Å; Y140-P209 WeakPolarHBondContact OH-CD 3.48Å; Y140-Y212 HydrophobicContact CD2-CD1 4.12Å; Y140-Y212 HydrophobicContact CD2-CE1 4.4Å; Y140-Y212 HydrophobicContact CD2-CG 4.31Å; Y140-Y212 AromaticContact CE2-CD1 3.99Å; Y140-Y212 HydrophobicContact CE2-CD1 3.99Å; Y140-Y212 AromaticContact CE2-CD2 3.87Å; Y140-Y212 HydrophobicContact CE2-CD2 3.87Å; Y140-Y212 HydrophobicContact CE2-CE1 4.3Å; Y140-Y212 HydrophobicContact CE2-CE2 4.2Å; Y140-Y212 AromaticContact CE2-CG 3.78Å; Y140-Y212 HydrophobicContact CE2-CG 3.78Å
141I94.9Very high95Very high1 Ų124.8 Ų24.81%0.00514%0.144CC..Hα-helixtrans-62.1-41.7177.9-60.1-62.7000110.1S90 I91 V94 A134 L135 N139 Y143 A144 V145S90-I141 WeakPolarHBondContact OG-CG2 3.38Å; I91-I141 HydrophobicContact CG1-CD1 4.48Å; I91-I141 HydrophobicContact CG1-CG1 4.37Å; I91-I141 HydrophobicContact CG1-CG2 4.25Å; V94-I141 HydrophobicContact CG2-CG2 4.33Å; A134-I141 HydrophobicContact CB-CD1 4.06Å; A134-I141 WeakPolarHBondContact O-CD1 3.12Å; L135-I141 HydrophobicContact CD2-CD1 4.08Å; N139-I141 PolarHBondContact O-N 2.99Å; N139-I141 VanDerWaalsContact O-N 3.12Å; I141-Y143 VanDerWaalsContact C-N 3.29Å; I141-Y143 PolarHBondContact O-N 3.32Å; I141-A144 WeakPolarHBondContact O-CB 3.45Å; I141-A144 PolarHBondContact O-N 2.88Å; I141-A144 VanDerWaalsContact O-N 3.13Å; I141-V145 WeakPolarHBondContact O-CG2 3.27Å; I141-V145 PolarHBondContact O-N 3.26Å
142G94.6Very high95.1Very high0 Ų025.3 Ų25.30%015%0.148CC..Hα-helixtrans-57-43.4174.100000112.4F78 Y140 A144 V145 V146F78-G142 VanDerWaalsContact CD1-CA 3.41Å; F78-G142 VanDerWaalsContact CE1-CA 3.47Å; Y140-G142 VanDerWaalsContact C-N 3.31Å; Y140-G142 PolarHBondContact O-N 3.48Å; G142-A144 PolarHBondContact O-N 3.34Å; G142-V145 PolarHBondContact O-N 3.03Å; G142-V146 WeakPolarHBondContact O-CG2 3.41Å; G142-V146 PolarHBondContact O-N 3.3Å
143Y94.8Very high95.2Very high28 Ų2824.1 Ų24.111%0.1114%0.139CC..Hα-helixtrans-63.2-40.4175.4-163.8-98.8000112.8L82 Y140 I141 V145 V146 S147 M197 W200 L220L82-Y143 HydrophobicContact CD2-CD2 4.26Å; Y140-Y143 WeakPolarHBondContact O-CB 3.3Å; Y140-Y143 PolarHBondContact O-N 3.47Å; Y140-Y143 VanDerWaalsContact O-N 3.16Å; I141-Y143 VanDerWaalsContact C-N 3.29Å; I141-Y143 PolarHBondContact O-N 3.32Å; Y143-V145 VanDerWaalsContact C-N 3.34Å; Y143-V146 PolarHBondContact O-N 2.97Å; Y143-S147 PolarHBondContact O-N 3.48Å; Y143-S147 VanDerWaalsContact O-N 3.08Å; Y143-M197 HydrophobicContact CD1-CE 3.7Å; Y143-M197 HydrophobicContact CD2-CE 4.11Å; Y143-M197 HydrophobicContact CE1-CE 3.32Å; Y143-M197 HydrophobicContact CE2-CB 4.18Å; Y143-M197 HydrophobicContact CE2-CE 3.75Å; Y143-M197 HydrophobicContact CE2-CG 4.45Å; Y143-M197 HydrophobicContact CG-CE 4.1Å; Y143-M197 PolarHBondContact OH-O 3.5Å; Y143-W200 HydrophobicContact CD2-CD2 4.23Å; Y143-W200 AromaticContact CD2-CE3 3.61Å; Y143-W200 HydrophobicContact CD2-CE3 3.61Å; Y143-W200 HydrophobicContact CD2-CH2 4.5Å; Y143-W200 AromaticContact CD2-CZ3 3.77Å; Y143-W200 HydrophobicContact CD2-CZ3 3.77Å; Y143-W200 HydrophobicContact CE2-CD2 4.16Å; Y143-W200 AromaticContact CE2-CE3 3.43Å; Y143-W200 HydrophobicContact CE2-CE3 3.43Å; Y143-W200 VanDerWaalsContact CE2-CE3 3.43Å; Y143-W200 AromaticContact CE2-CZ3 3.94Å; Y143-W200 HydrophobicContact CE2-CZ3 3.94Å; Y143-L220 WeakPolarHBondContact OH-CD1 3.42Å
144A96.2Very high95.3Very high6 Ų623.1 Ų23.15%0.0513%0.132CC..Hα-helixtrans-64-37.5173.500000112.1V94 F131 A134 Y140 I141 G142 S147 L148V94-A144 HydrophobicContact CG1-CB 4.09Å; V94-A144 HydrophobicContact CG2-CB 3.74Å; F131-A144 HydrophobicContact CD1-CB 4.06Å; F131-A144 HydrophobicContact CE1-CB 3.99Å; A134-A144 HydrophobicContact CB-CB 4.37Å; Y140-A144 PolarHBondContact O-N 3.31Å; I141-A144 WeakPolarHBondContact O-CB 3.45Å; I141-A144 PolarHBondContact O-N 2.88Å; I141-A144 VanDerWaalsContact O-N 3.13Å; G142-A144 PolarHBondContact O-N 3.34Å; A144-S147 WeakPolarHBondContact O-CB 3.3Å; A144-S147 PolarHBondContact O-N 3.09Å; A144-S147 PolarHBondContact O-OG 2.97Å; A144-L148 PolarHBondContact O-N 3.24Å
145V96.4Very high95.5Very high0 Ų024 Ų240%014%0.136CC..Hα-helixtrans-65-42.3174.31750000111.6T71 F72 L93 V94 I141 G142 Y143 S147 L148T71-V145 HydrophobicContact CG2-CG1 4.09Å; F72-V145 HydrophobicContact CD2-CG1 4.49Å; F72-V145 HydrophobicContact CE2-CG1 3.74Å; F72-V145 HydrophobicContact CZ-CG1 4.02Å; L93-V145 HydrophobicContact CD2-CG1 4.07Å; L93-V145 HydrophobicContact CD2-CG2 4.3Å; V94-V145 HydrophobicContact CG2-CG2 3.96Å; I141-V145 WeakPolarHBondContact O-CG2 3.27Å; I141-V145 PolarHBondContact O-N 3.26Å; G142-V145 PolarHBondContact O-N 3.03Å; Y143-V145 VanDerWaalsContact C-N 3.34Å; V145-S147 PolarHBondContact O-N 3.31Å; V145-L148 WeakPolarHBondContact O-CB 3.19Å; V145-L148 PolarHBondContact O-N 3.43Å; V145-L148 VanDerWaalsContact O-N 3.08Å
146V96.3Very high95.6Very high5 Ų524.7 Ų24.73%0.0314%0.138CC..Hα-helixtrans-58.5-40173.5-179.10000110.8F72 L82 G142 Y143 L148 L149 V193 W196 M197F72-V146 HydrophobicContact CE1-CG2 4.14Å; F72-V146 HydrophobicContact CE2-CG2 4.34Å; F72-V146 HydrophobicContact CZ-CB 4.35Å; F72-V146 HydrophobicContact CZ-CG2 3.44Å; F72-V146 VanDerWaalsContact CZ-CG2 3.44Å; L82-V146 HydrophobicContact CD2-CG2 3.59Å; G142-V146 WeakPolarHBondContact O-CG2 3.41Å; G142-V146 PolarHBondContact O-N 3.3Å; Y143-V146 PolarHBondContact O-N 2.97Å; V146-L148 PolarHBondContact O-N 2.88Å; V146-L148 VanDerWaalsContact O-N 3.09Å; V146-L149 HydrophobicContact CG1-CD1 4.06Å; V146-L149 WeakPolarHBondContact O-CB 3.49Å; V146-L149 WeakPolarHBondContact O-CG 3.41Å; V146-L149 PolarHBondContact O-N 3.45Å; V146-V193 HydrophobicContact CG1-CG1 3.74Å; V146-W196 HydrophobicContact CB-CZ3 4.48Å; V146-W196 HydrophobicContact CG1-CE3 4.04Å; V146-W196 HydrophobicContact CG1-CZ3 3.85Å; V146-W196 HydrophobicContact CG2-CZ3 4.02Å; V146-M197 HydrophobicContact CB-CE 4.39Å; V146-M197 HydrophobicContact CB-CG 4.43Å; V146-M197 HydrophobicContact CB-SD 4.23Å; V146-M197 HydrophobicContact CG1-CE 4.4Å; V146-M197 HydrophobicContact CG1-CG 3.54Å; V146-M197 HydrophobicContact CG1-SD 3.68Å
147S96.1Very high95.7Very high32 Ų3218.8 Ų18.822%0.22411%0.107CC..THydrogen-bonded Turntrans-64.7-12.9179.5820000114.5F131 Y143 A144 V145 P150F131-S147 WeakPolarHBondContact CE1-OG 3.1Å; F131-S147 VanDerWaalsContact CZ-OG 3.32Å; F131-S147 WeakPolarHBondContact CZ-OG 3.42Å; Y143-S147 PolarHBondContact O-N 3.48Å; Y143-S147 VanDerWaalsContact O-N 3.08Å; A144-S147 WeakPolarHBondContact O-CB 3.3Å; A144-S147 PolarHBondContact O-N 3.09Å; A144-S147 PolarHBondContact O-OG 2.97Å; V145-S147 PolarHBondContact O-N 3.31Å; S147-P150 VanDerWaalsContact O-CD 3.3Å; S147-P150 WeakPolarHBondContact O-CD 3.35Å
148L97Very high95.9Very high1 Ų118.1 Ų18.11%0.00510%0.1CC..THydrogen-bonded Turntrans-92.7-11.3174.8-70.1170000113.5L93 S97 F131 A144 V145 V146 P150 E151L93-L148 HydrophobicContact CD1-CD1 4.04Å; L93-L148 HydrophobicContact CD2-CD1 4.24Å; L93-L148 HydrophobicContact CG-CD1 3.75Å; S97-L148 WeakPolarHBondContact OG-CD1 3.19Å; F131-L148 HydrophobicContact CE2-CD1 4.23Å; F131-L148 HydrophobicContact CE2-CD2 3.85Å; F131-L148 HydrophobicContact CE2-CG 4.13Å; F131-L148 HydrophobicContact CZ-CD1 4.27Å; F131-L148 HydrophobicContact CZ-CD2 3.79Å; F131-L148 HydrophobicContact CZ-CG 3.81Å; A144-L148 PolarHBondContact O-N 3.24Å; V145-L148 WeakPolarHBondContact O-CB 3.19Å; V145-L148 PolarHBondContact O-N 3.43Å; V145-L148 VanDerWaalsContact O-N 3.08Å; V146-L148 PolarHBondContact O-N 2.88Å; V146-L148 VanDerWaalsContact O-N 3.09Å; L148-P150 VanDerWaalsContact C-N 3.3Å; L148-E151 HydrophobicContact CD2-CG 4.14Å; L148-E151 WeakPolarHBondContact O-CB 3.48Å; L148-E151 VanDerWaalsContact O-CG 3.3Å; L148-E151 WeakPolarHBondContact O-CG 3.25Å; L148-E151 PolarHBondContact O-N 3.42Å
149L97.1Very high96.1Very high21 Ų2119.2 Ų19.211%0.1110%0.1CC..THydrogen-bonded Turntrans-56.8-35.3172.8-67.8173.1000114L69 F72 V146 E151 V152 F189 V193L69-L149 HydrophobicContact CD2-CD2 3.75Å; L69-L149 HydrophobicContact CG-CD2 4.29Å; F72-L149 HydrophobicContact CD2-CD1 4.48Å; F72-L149 HydrophobicContact CD2-CD2 4.11Å; F72-L149 HydrophobicContact CE2-CD1 3.95Å; F72-L149 HydrophobicContact CE2-CD2 4.07Å; F72-L149 HydrophobicContact CE2-CG 4.1Å; V146-L149 HydrophobicContact CG1-CD1 4.06Å; V146-L149 WeakPolarHBondContact O-CB 3.49Å; V146-L149 WeakPolarHBondContact O-CG 3.41Å; V146-L149 PolarHBondContact O-N 3.45Å; L149-E151 PolarHBondContact O-N 3.02Å; L149-V152 WeakPolarHBondContact O-CB 3.46Å; L149-V152 WeakPolarHBondContact O-CG2 3.33Å; L149-V152 PolarHBondContact O-N 3.34Å; L149-V152 VanDerWaalsContact O-N 3.08Å; L149-F189 HydrophobicContact CB-CD1 4.26Å; L149-F189 WeakPolarHBondContact O-CD1 3.46Å; L149-V193 HydrophobicContact CB-CG1 4.24Å; L149-V193 HydrophobicContact CB-CG2 4.39Å; L149-V193 HydrophobicContact CD1-CG1 4.22Å; L149-V193 HydrophobicContact CD1-CG2 4.38Å
150P97.2Very high96.3Very high15 Ų1517.6 Ų17.610%0.0979%0.089CC..THydrogen-bonded Turntrans-51.3-22.7168.9-30.937000115.3S147 L148 V152 N153 S154 F189 R190 L194S147-P150 VanDerWaalsContact O-CD 3.3Å; S147-P150 WeakPolarHBondContact O-CD 3.35Å; L148-P150 VanDerWaalsContact C-N 3.3Å; P150-V152 PolarHBondContact O-N 3.49Å; P150-N153 WeakPolarHBondContact O-CB 3.4Å; P150-N153 PolarHBondContact O-N 2.95Å; P150-N153 VanDerWaalsContact O-N 3.09Å; P150-S154 PolarHBondContact O-N 3.27Å; P150-F189 WeakPolarHBondContact CG-O 3.38Å; P150-R190 HydrophobicContact CB-CG 4.22Å; P150-L194 HydrophobicContact CG-CD1 3.63Å
151E96.8Very high96.3Very high16 Ų1619.7 Ų19.78%0.07510%0.097CC..Hα-helixtrans-67.1-23.1178.6-60.1-62.5175.200113.1H60 S64 L148 L149 N153 S154 I155H60-E151 IonicContact CE1-OE1 2.74Å; S64-E151 WeakPolarHBondContact OG-CB 3.32Å; S64-E151 WeakPolarHBondContact OG-CG 3.49Å; L148-E151 HydrophobicContact CD2-CG 4.14Å; L148-E151 WeakPolarHBondContact O-CB 3.48Å; L148-E151 VanDerWaalsContact O-CG 3.3Å; L148-E151 WeakPolarHBondContact O-CG 3.25Å; L148-E151 PolarHBondContact O-N 3.42Å; L149-E151 PolarHBondContact O-N 3.02Å; E151-N153 PolarHBondContact O-N 3.15Å; E151-S154 WeakPolarHBondContact O-CA 3Å; E151-S154 WeakPolarHBondContact O-CB 3.12Å; E151-S154 PolarHBondContact O-N 3.11Å; E151-S154 WeakPolarHBondContact OE2-CB 3.32Å; E151-S154 PolarHBondContact OE2-OG 2.88Å; E151-I155 PolarHBondContact O-N 2.96Å; E151-I155 VanDerWaalsContact O-N 3.09Å
152V97.8Very high96.4Very high15 Ų1520.6 Ų20.69%0.09110%0.104CC..Hα-helixtrans-59.6-39.4171.5-178.60000110.8L69 L149 P150 F156 F189L69-V152 HydrophobicContact CD1-CG1 4.43Å; L69-V152 HydrophobicContact CD1-CG2 3.69Å; L69-V152 HydrophobicContact CD2-CG2 4.48Å; L69-V152 HydrophobicContact CG-CG2 3.92Å; L149-V152 WeakPolarHBondContact O-CB 3.46Å; L149-V152 WeakPolarHBondContact O-CG2 3.33Å; L149-V152 PolarHBondContact O-N 3.34Å; L149-V152 VanDerWaalsContact O-N 3.08Å; P150-V152 PolarHBondContact O-N 3.49Å; V152-F156 WeakPolarHBondContact O-CD2 3.3Å; V152-F189 HydrophobicContact CB-CD1 4.12Å; V152-F189 HydrophobicContact CB-CD2 3.98Å; V152-F189 HydrophobicContact CB-CE1 4.16Å; V152-F189 HydrophobicContact CB-CE2 4.02Å; V152-F189 HydrophobicContact CB-CG 4.02Å; V152-F189 HydrophobicContact CB-CZ 4.11Å; V152-F189 HydrophobicContact CG1-CD2 3.88Å; V152-F189 HydrophobicContact CG1-CE1 4.3Å; V152-F189 HydrophobicContact CG1-CE2 3.5Å; V152-F189 HydrophobicContact CG1-CG 4.4Å; V152-F189 HydrophobicContact CG1-CZ 3.74Å; V152-F189 HydrophobicContact CG2-CD1 4.33Å; V152-F189 HydrophobicContact CG2-CE1 4.14Å; V152-F189 HydrophobicContact CG2-CZ 4.35Å
153N97.5Very high96.4Very high0 Ų021 Ų210%011%0.106CC..Hα-helixtrans-70.2-39.2171.9169.1-105.8000111.8P150 E151 I155 F156 L157 N182 S185 F186 F189 R190P150-N153 WeakPolarHBondContact O-CB 3.4Å; P150-N153 PolarHBondContact O-N 2.95Å; P150-N153 VanDerWaalsContact O-N 3.09Å; E151-N153 PolarHBondContact O-N 3.15Å; N153-I155 PolarHBondContact O-N 3.28Å; N153-I155 VanDerWaalsContact O-N 3.16Å; N153-F156 PolarHBondContact O-N 3.19Å; N153-L157 PolarHBondContact O-N 3.42Å; N153-N182 PolarHBondContact ND2-O 2.81Å; N153-N182 PolarHBondContact ND2-OD1 2.87Å; N153-N182 VanDerWaalsContact ND2-OD1 3.15Å; N153-S185 PolarHBondContact ND2-OG 2.66Å; N153-F186 WeakPolarHBondContact ND2-CA 3.17Å; N153-F186 PolarHBondContact ND2-N 3.45Å; N153-F186 VanDerWaalsContact ND2-N 3.12Å; N153-F186 WeakPolarHBondContact OD1-CD2 3.31Å; N153-F189 HydrophobicContact CB-CB 4.3Å; N153-R190 HydrophobicContact CB-CG 4.33Å; N153-R190 WeakPolarHBondContact OD1-CD 3.46Å; N153-R190 PolarHBondContact OD1-NE 2.97Å
154S96.6Very high96.4Very high7 Ų722.3 Ų22.35%0.04912%0.115CC..Hα-helixtrans-55.8-31.4178.7-58.10000112.6P150 E151 F156 L157 H158 R190P150-S154 PolarHBondContact O-N 3.27Å; E151-S154 WeakPolarHBondContact O-CA 3Å; E151-S154 WeakPolarHBondContact O-CB 3.12Å; E151-S154 PolarHBondContact O-N 3.11Å; E151-S154 WeakPolarHBondContact OE2-CB 3.32Å; E151-S154 PolarHBondContact OE2-OG 2.88Å; S154-F156 PolarHBondContact O-N 3.18Å; S154-L157 PolarHBondContact O-N 3.42Å; S154-H158 WeakPolarHBondContact O-CB 3.38Å; S154-H158 PolarHBondContact O-CD2 2.95Å; S154-H158 PolarHBondContact O-N 3.32Å; S154-R190 PolarHBondContact OG-NH2 2.97Å
155I97.9Very high96.3Very high22 Ų2223 Ų2311%0.11312%0.117CC..Hα-helixtrans-53.2-54.1172.7-62.2166000110.7F58 A61 L62 E151 N153 L157 H158 L159F58-I155 HydrophobicContact CE2-CG2 3.89Å; F58-I155 WeakPolarHBondContact CE2-O 3.49Å; A61-I155 HydrophobicContact CB-CG1 4.02Å; A61-I155 WeakPolarHBondContact O-CG1 3.43Å; L62-I155 HydrophobicContact CD2-CB 4.49Å; L62-I155 HydrophobicContact CD2-CD1 4.07Å; L62-I155 HydrophobicContact CD2-CG1 4.05Å; L62-I155 HydrophobicContact CD2-CG2 3.62Å; L62-I155 HydrophobicContact CG-CG1 4.37Å; L62-I155 HydrophobicContact CG-CG2 4.33Å; E151-I155 PolarHBondContact O-N 2.96Å; E151-I155 VanDerWaalsContact O-N 3.09Å; N153-I155 PolarHBondContact O-N 3.28Å; N153-I155 VanDerWaalsContact O-N 3.16Å; I155-L157 VanDerWaalsContact C-N 3.35Å; I155-H158 PolarHBondContact O-N 3.18Å; I155-L159 VanDerWaalsContact O-CB 3.29Å; I155-L159 WeakPolarHBondContact O-CB 3.3Å; I155-L159 PolarHBondContact O-N 2.73Å
156F97.1Very high96.2Very high51 Ų5126.5 Ų26.522%0.22414%0.135CC..Hα-helixtrans-69.5-34.8-179-58.1-71000111.9V152 N153 S154 R160 L181 N182 S185V152-F156 WeakPolarHBondContact O-CD2 3.3Å; N153-F156 PolarHBondContact O-N 3.19Å; S154-F156 PolarHBondContact O-N 3.18Å; F156-R160 VanDerWaalsContact O-CB 3.23Å; F156-R160 WeakPolarHBondContact O-CB 3.4Å; F156-R160 PolarHBondContact O-N 2.95Å; F156-L181 HydrophobicContact CD1-CB 3.76Å; F156-L181 HydrophobicContact CD1-CD1 4.25Å; F156-L181 HydrophobicContact CE1-CB 3.89Å; F156-L181 HydrophobicContact CE1-CD1 3.79Å; F156-L181 HydrophobicContact CE1-CG 4.36Å; F156-L181 HydrophobicContact CG-CB 4.15Å; F156-L181 HydrophobicContact CZ-CB 4.37Å; F156-L181 HydrophobicContact CZ-CD1 4.5Å; F156-N182 HydrophobicContact CB-CB 3.85Å; F156-S185 WeakPolarHBondContact CD2-OG 3.17Å
157L95.7Very high96Very high23 Ų2332.3 Ų32.312%0.1216%0.161CC..Hα-helixtrans-62.4-47.1176.3-172150000111.6N153 S154 I155 R160 R161 N182 L230N153-L157 PolarHBondContact O-N 3.42Å; S154-L157 PolarHBondContact O-N 3.42Å; I155-L157 VanDerWaalsContact C-N 3.35Å; L157-R160 WeakPolarHBondContact O-CB 3.37Å; L157-R160 PolarHBondContact O-N 3.22Å; L157-R161 WeakPolarHBondContact O-CB 3.17Å; L157-R161 PolarHBondContact O-N 2.94Å; L157-N182 PolarHBondContact N-OD1 2.62Å; L157-L230 HydrophobicContact CD1-CD1 4.36Å; L157-L230 HydrophobicContact CD1-CD2 3.75Å; L157-L230 HydrophobicContact CD1-CG 4.23Å
158H96.1Very high95.9Very high21 Ų2132.4 Ų32.410%0.09716%0.16CC..Hα-helixtrans-73.4-36.6179.2-72.7-64.3000112.4T54 S57 F58 S154 I155 R160 R161 A162T54-H158 HydrophobicContact CG2-CB 4.42Å; S57-H158 WeakPolarHBondContact CB-CE1 3.33Å; S57-H158 VanDerWaalsContact CB-NE2 3.31Å; S57-H158 WeakPolarHBondContact CB-NE2 3.25Å; F58-H158 HydrophobicContact CB-CB 3.83Å; F58-H158 HydrophobicContact CD2-CB 3.82Å; F58-H158 HydrophobicContact CG-CB 4.3Å; S154-H158 WeakPolarHBondContact O-CB 3.38Å; S154-H158 PolarHBondContact O-CD2 2.95Å; S154-H158 PolarHBondContact O-N 3.32Å; I155-H158 PolarHBondContact O-N 3.18Å; H158-R160 VanDerWaalsContact C-N 3.32Å; H158-R160 PolarHBondContact O-N 3.24Å; H158-R161 PolarHBondContact O-N 2.76Å; H158-A162 WeakPolarHBondContact O-CB 3.41Å; H158-A162 PolarHBondContact O-N 3.41Å
159L96.5Very high95.5Very high46 Ų4636.7 Ų36.724%0.24119%0.189CC..Hα-helixtrans-59.6-44.6171.7-176.759.5000111.1F58 I155 A162 M163 F174 T178F58-L159 HydrophobicContact CE2-CB 4Å; I155-L159 VanDerWaalsContact O-CB 3.29Å; I155-L159 WeakPolarHBondContact O-CB 3.3Å; I155-L159 PolarHBondContact O-N 2.73Å; L159-A162 PolarHBondContact O-N 3.05Å; L159-M163 HydrophobicContact CG-CE 4.34Å; L159-M163 WeakPolarHBondContact O-CG 3.45Å; L159-M163 PolarHBondContact O-N 3.47Å; L159-F174 HydrophobicContact CD2-CZ 4.08Å; L159-T178 HydrophobicContact CB-CG2 4.21Å; L159-T178 HydrophobicContact CD2-CG2 4.02Å; L159-T178 HydrophobicContact CG-CG2 4.03Å
160R95Very high95.1Very high30 Ų3039.4 Ų39.411%0.11320%0.2CC..Hα-helixtrans-59.8-46.4172.8-179.7-173.1165.3-77.9-5.7111.8F156 L157 H158 A162 M163 N164 T178 A237 D238F156-R160 VanDerWaalsContact O-CB 3.23Å; F156-R160 WeakPolarHBondContact O-CB 3.4Å; F156-R160 PolarHBondContact O-N 2.95Å; L157-R160 WeakPolarHBondContact O-CB 3.37Å; L157-R160 PolarHBondContact O-N 3.22Å; H158-R160 VanDerWaalsContact C-N 3.32Å; H158-R160 PolarHBondContact O-N 3.24Å; R160-A162 VanDerWaalsContact C-N 3.35Å; R160-M163 PolarHBondContact O-N 3.06Å; R160-N164 PolarHBondContact O-N 3.26Å; R160-N164 PolarHBondContact O-ND2 2.83Å; R160-N164 VanDerWaalsContact O-ND2 3.08Å; R160-T178 HydrophobicContact CB-CG2 4.07Å; R160-A237 VanDerWaalsContact NH2-CB 3.25Å; R160-D238 IonicContact CZ-OD1 2.74Å; R160-D238 IonicContact CZ-OD2 2.98Å; R160-D238 IonicContact NE-OD1 2.74Å; R160-D238 PolarHBondContact NE-OD1 2.78Å; R160-D238 IonicContact NE-OD2 2.67Å; R160-D238 PolarHBondContact NE-OD2 2.88Å; R160-D238 IonicContact NH2-OD1 3.51Å; R160-D238 PolarHBondContact NH2-OD1 3.19Å; R160-D238 IonicContact NH2-OD2 3.11Å
161R94.7Very high94.7Very high74 Ų7449.4 Ų49.428%0.27924%0.235SC..Hα-helixtrans-61.6-42.6178.8-173.8175.3177.5-163-8.6111.4N53 T54 L157 H158 N164 Y165N53-R161 PolarHBondContact OD1-NH1 3.35Å; N53-R161 VanDerWaalsContact OD1-NH1 3.08Å; T54-R161 HydrophobicContact CG2-CB 4.07Å; T54-R161 HydrophobicContact CG2-CG 4.09Å; T54-R161 VanDerWaalsContact OG1-CD 3.28Å; T54-R161 WeakPolarHBondContact OG1-CD 3.36Å; T54-R161 PolarHBondContact OG1-NE 3.38Å; L157-R161 WeakPolarHBondContact O-CB 3.17Å; L157-R161 PolarHBondContact O-N 2.94Å; H158-R161 PolarHBondContact O-N 2.76Å; R161-N164 PolarHBondContact O-N 2.86Å; R161-Y165 PolarHBondContact O-N 3.26Å
162A96.2Very high94.5Very high19 Ų1951.5 Ų51.516%0.15725%0.247CC..Hα-helixtrans-62.1-47176.100000111.3W51 T54 H158 L159 R160 N164 Y165 L166W51-A162 HydrophobicContact CZ3-CB 4.47Å; T54-A162 HydrophobicContact CG2-CB 4.02Å; H158-A162 WeakPolarHBondContact O-CB 3.41Å; H158-A162 PolarHBondContact O-N 3.41Å; L159-A162 PolarHBondContact O-N 3.05Å; R160-A162 VanDerWaalsContact C-N 3.35Å; A162-N164 VanDerWaalsContact C-N 3.32Å; A162-N164 PolarHBondContact O-N 2.91Å; A162-Y165 WeakPolarHBondContact O-CB 3.21Å; A162-Y165 PolarHBondContact O-N 2.97Å; A162-Y165 VanDerWaalsContact O-N 3.16Å; A162-L166 VanDerWaalsContact O-CG 3.27Å; A162-L166 WeakPolarHBondContact O-CG 3.44Å; A162-L166 PolarHBondContact O-N 2.88Å
163M95.8Very high94.3Very high10 Ų1055.5 Ų55.55%0.04927%0.273CS..Hα-helixtrans-61.9-37.6176.8-72.5-170.7-67.700113.4L159 R160 L166 H167 V168 F174 F175 T178L159-M163 HydrophobicContact CG-CE 4.34Å; L159-M163 WeakPolarHBondContact O-CG 3.45Å; L159-M163 PolarHBondContact O-N 3.47Å; R160-M163 PolarHBondContact O-N 3.06Å; M163-L166 CarbonylContact O-C 3.51Å; M163-L166 PolarHBondContact O-N 3.05Å; M163-H167 PolarHBondContact O-N 3.5Å; M163-V168 HydrophobicContact CB-CB 4.08Å; M163-V168 HydrophobicContact CB-CG2 4Å; M163-V168 HydrophobicContact CG-CG2 4.18Å; M163-V168 PolarHBondContact O-N 3.45Å; M163-F174 HydrophobicContact CE-CE1 4.48Å; M163-F174 HydrophobicContact SD-CD1 3.49Å; M163-F174 WeakPolarHBondContact SD-CD1 3.34Å; M163-F174 HydrophobicContact SD-CE1 3.61Å; M163-F175 HydrophobicContact CB-CD2 3.8Å; M163-F175 HydrophobicContact CB-CE2 4.06Å; M163-F175 HydrophobicContact CE-CB 4.49Å; M163-F175 HydrophobicContact CE-CD2 3.83Å; M163-F175 HydrophobicContact CE-CE2 4.46Å; M163-F175 HydrophobicContact CE-CG 4.43Å; M163-F175 HydrophobicContact SD-CB 4.31Å; M163-F175 HydrophobicContact SD-CD2 4Å; M163-T178 VanDerWaalsContact CE-CB 3.45Å; M163-T178 HydrophobicContact CE-CG2 3.46Å; M163-T178 VanDerWaalsContact CE-CG2 3.46Å; M163-T178 WeakPolarHBondContact CE-OG1 3.28Å
164N93.7Very high94.2Very high55 Ų5561 Ų6129%0.29430%0.297SS..Hα-helixtrans-65-41.4174-78.7-49.2000111.7R160 R161 A162 L166 H167 F175R160-N164 PolarHBondContact O-N 3.26Å; R160-N164 PolarHBondContact O-ND2 2.83Å; R160-N164 VanDerWaalsContact O-ND2 3.08Å; R161-N164 PolarHBondContact O-N 2.86Å; A162-N164 VanDerWaalsContact C-N 3.32Å; A162-N164 PolarHBondContact O-N 2.91Å; N164-L166 VanDerWaalsContact C-N 3.3Å; N164-L166 PolarHBondContact O-N 3.36Å; N164-H167 PolarHBondContact O-N 3.5Å; N164-H167 VanDerWaalsContact O-N 3.12Å; N164-F175 WeakPolarHBondContact OD1-CE2 3.26Å; N164-F175 WeakPolarHBondContact OD1-CZ 3.41Å
165Y93.9Very high94Very high21 Ų2161 Ų618%0.08230%0.296CS..Hα-helixtrans-62.5-37.9174.7-178.7-88.9000111.8N27 F29 Q47 I50 W51 R161 A162 H167N27-Y165 PolarHBondContact ND2-OH 2.79Å; N27-Y165 PolarHBondContact OD1-OH 3.33Å; N27-Y165 VanDerWaalsContact OD1-OH 3.05Å; F29-Y165 HydrophobicContact CD2-CD1 4.32Å; F29-Y165 AromaticContact CD2-CE1 3.59Å; F29-Y165 HydrophobicContact CD2-CE1 3.59Å; F29-Y165 AromaticContact CD2-CZ 3.97Å; F29-Y165 HydrophobicContact CE2-CD1 4.15Å; F29-Y165 AromaticContact CE2-CE1 3.88Å; F29-Y165 HydrophobicContact CE2-CE1 3.88Å; F29-Y165 WeakPolarHBondContact CE2-O 3.19Å; Q47-Y165 HydrophobicContact CB-CE2 4.31Å; Q47-Y165 VanDerWaalsContact OE1-CE2 3.27Å; I50-Y165 HydrophobicContact CG2-CD2 3.77Å; I50-Y165 HydrophobicContact CG2-CE2 4.26Å; W51-Y165 HydrophobicContact CB-CE1 3.95Å; W51-Y165 HydrophobicContact CB-CE2 4.1Å; W51-Y165 HydrophobicContact CD2-CD1 4.13Å; W51-Y165 AromaticContact CD2-CE1 3.9Å; W51-Y165 HydrophobicContact CD2-CE1 3.9Å; W51-Y165 AromaticContact CE3-CD1 3.31Å; W51-Y165 HydrophobicContact CE3-CD1 3.31Å; W51-Y165 AromaticContact CE3-CE1 3.56Å; W51-Y165 HydrophobicContact CE3-CE1 3.56Å; W51-Y165 HydrophobicContact CE3-CG 4.03Å; W51-Y165 HydrophobicContact CG-CE1 4.09Å; W51-Y165 AromaticContact CZ3-CD1 3.84Å; W51-Y165 HydrophobicContact CZ3-CD1 3.84Å; W51-Y165 HydrophobicContact CZ3-CE1 4.34Å; R161-Y165 PolarHBondContact O-N 3.26Å; A162-Y165 WeakPolarHBondContact O-CB 3.21Å; A162-Y165 PolarHBondContact O-N 2.97Å; A162-Y165 VanDerWaalsContact O-N 3.16Å; Y165-H167 PolarHBondContact O-CE1 3.49Å; Y165-H167 PolarHBondContact O-N 3.33Å; Y165-H167 PolarHBondContact O-ND1 3.39Å
166L95.1Very high93.8Very high72 Ų7268.2 Ų68.238%0.37732%0.322SS..THydrogen-bonded Turntrans-76.82.6175.8-63.6175.4000114P28 W51 A162 M163 N164 V168P28-L166 HydrophobicContact CB-CD2 4.42Å; P28-L166 HydrophobicContact CG-CD2 3.38Å; W51-L166 HydrophobicContact CH2-CD2 4.15Å; W51-L166 HydrophobicContact CZ3-CD2 4.02Å; W51-L166 HydrophobicContact CZ3-CG 4.17Å; A162-L166 VanDerWaalsContact O-CG 3.27Å; A162-L166 WeakPolarHBondContact O-CG 3.44Å; A162-L166 PolarHBondContact O-N 2.88Å; M163-L166 CarbonylContact O-C 3.51Å; M163-L166 PolarHBondContact O-N 3.05Å; N164-L166 VanDerWaalsContact C-N 3.3Å; N164-L166 PolarHBondContact O-N 3.36Å; L166-V168 HydrophobicContact CB-CG2 4.08Å; L166-V168 PolarHBondContact O-N 2.88Å
167H92.6Very high93.7Very high127 Ų12767.9 Ų67.959%0.58833%0.329SS*.THydrogen-bonded Turntrans54.333.9-176.5-50108.1000113.7F29 M163 N164 Y165 P169F29-H167 AromaticContact CZ-CE1 3.94Å; F29-H167 AromaticContact CZ-ND1 3.58Å; M163-H167 PolarHBondContact O-N 3.5Å; N164-H167 PolarHBondContact O-N 3.5Å; N164-H167 VanDerWaalsContact O-N 3.12Å; Y165-H167 PolarHBondContact O-CE1 3.49Å; Y165-H167 PolarHBondContact O-N 3.33Å; Y165-H167 PolarHBondContact O-ND1 3.39Å; H167-P169 WeakPolarHBondContact O-CD 3.32Å
168V92.7Very high93.7Very high34 Ų3467 Ų6721%0.20633%0.325CS..  trans-61.2126.2175.51780000108.7M163 L166 K170 N172 F175M163-V168 HydrophobicContact CB-CB 4.08Å; M163-V168 HydrophobicContact CB-CG2 4Å; M163-V168 HydrophobicContact CG-CG2 4.18Å; M163-V168 PolarHBondContact O-N 3.45Å; L166-V168 HydrophobicContact CB-CG2 4.08Å; L166-V168 PolarHBondContact O-N 2.88Å; V168-K170 PolarHBondContact O-N 3.47Å; V168-N172 HydrophobicContact CG1-CB 3.98Å; V168-F175 HydrophobicContact CG1-CB 4.38Å
169P90.6Very high93.6Very high92 Ų9266.5 Ų66.560%0.59732%0.323SS*.  trans-58.8133.6-177.5-25.233.3000111.8H167 R171 N172H167-P169 WeakPolarHBondContact O-CD 3.32Å; P169-R171 PolarHBondContact O-N 3.47Å; P169-N172 WeakPolarHBondContact O-CB 3.44Å; P169-N172 PolarHBondContact O-N 3.01Å
170K88Confident93.5Very high78 Ų7870.1 Ų70.134%0.33934%0.342SS..THydrogen-bonded Turntrans-60.1-18.9178.9-61.8-169.9-177.8-172.40114.1V168 N172 F175 R176 A237 N242V168-K170 PolarHBondContact O-N 3.47Å; K170-N172 VanDerWaalsContact C-N 3.28Å; K170-F175 HydrophobicContact CB-CD1 4.22Å; K170-F175 HydrophobicContact CB-CE1 4.16Å; K170-F175 HydrophobicContact CD-CE1 4.48Å; K170-F175 HydrophobicContact CG-CD1 4.34Å; K170-F175 HydrophobicContact CG-CE1 3.84Å; K170-F175 HydrophobicContact CG-CZ 4.24Å; K170-R176 VanDerWaalsContact O-CG 3.28Å; K170-R176 WeakPolarHBondContact O-CG 3.39Å; K170-A237 PolarHBondContact NZ-O 2.93Å; K170-N242 WeakPolarHBondContact CD-OD1 3.17Å; K170-N242 WeakPolarHBondContact CE-OD1 3.24Å; K170-N242 PolarHBondContact NZ-OD1 3.38Å
171R88.5Confident93.6Very high225 Ų22572.5 Ų72.585%0.84936%0.357SS*.THydrogen-bonded Turntrans-72.6-19.3173.8-169.2172.270.3126.2-0.9112.9P169P169-R171 PolarHBondContact O-N 3.47Å
172N92.8Very high93.6Very high59 Ų5969 Ų6932%0.31634%0.343SS..SBendtrans-59.1125.4179.5-175.5-28.6000109.6V168 P169 K170 F174 F175 R176V168-N172 HydrophobicContact CG1-CB 3.98Å; P169-N172 WeakPolarHBondContact O-CB 3.44Å; P169-N172 PolarHBondContact O-N 3.01Å; K170-N172 VanDerWaalsContact C-N 3.28Å; N172-F174 PolarHBondContact O-N 2.92Å; N172-F174 WeakPolarHBondContact OD1-CB 3.32Å; N172-F174 PolarHBondContact OD1-N 3.05Å; N172-F175 HydrophobicContact CB-CB 4.15Å; N172-F175 WeakPolarHBondContact O-CB 3.49Å; N172-F175 PolarHBondContact O-N 3.31Å; N172-R176 PolarHBondContact O-N 3.25Å; N172-R176 VanDerWaalsContact O-N 3.09Å
173P93.2Very high93.5Very high100 Ų10069.2 Ų69.265%0.64934%0.342SS*.Hα-helixtrans-56.6-35.4-179.923.1-34.7000112.6R176 A177P173-R176 PolarHBondContact O-N 3.09Å; P173-A177 WeakPolarHBondContact O-CB 3.14Å; P173-A177 PolarHBondContact O-N 3.16Å
174F94.6Very high93.5Very high115 Ų11571.4 Ų71.450%0.50436%0.358SS..Hα-helixtrans-64.7-39.9177.1-175.6-108.1000112.4L159 M163 N172 T178L159-F174 HydrophobicContact CD2-CZ 4.08Å; M163-F174 HydrophobicContact CE-CE1 4.48Å; M163-F174 HydrophobicContact SD-CD1 3.49Å; M163-F174 WeakPolarHBondContact SD-CD1 3.34Å; M163-F174 HydrophobicContact SD-CE1 3.61Å; N172-F174 PolarHBondContact O-N 2.92Å; N172-F174 WeakPolarHBondContact OD1-CB 3.32Å; N172-F174 PolarHBondContact OD1-N 3.05Å; F174-T178 WeakPolarHBondContact O-CB 3.2Å; F174-T178 PolarHBondContact O-N 2.95Å; F174-T178 PolarHBondContact O-OG1 3.34Å
175F93.8Very high93.6Very high6 Ų669.1 Ų69.13%0.02635%0.347CS..Hα-helixtrans-64.3-46.2175-174.8-86000111.2M163 N164 V168 K170 N172 T178 C179M163-F175 HydrophobicContact CB-CD2 3.8Å; M163-F175 HydrophobicContact CB-CE2 4.06Å; M163-F175 HydrophobicContact CE-CB 4.49Å; M163-F175 HydrophobicContact CE-CD2 3.83Å; M163-F175 HydrophobicContact CE-CE2 4.46Å; M163-F175 HydrophobicContact CE-CG 4.43Å; M163-F175 HydrophobicContact SD-CB 4.31Å; M163-F175 HydrophobicContact SD-CD2 4Å; N164-F175 WeakPolarHBondContact OD1-CE2 3.26Å; N164-F175 WeakPolarHBondContact OD1-CZ 3.41Å; V168-F175 HydrophobicContact CG1-CB 4.38Å; K170-F175 HydrophobicContact CB-CD1 4.22Å; K170-F175 HydrophobicContact CB-CE1 4.16Å; K170-F175 HydrophobicContact CD-CE1 4.48Å; K170-F175 HydrophobicContact CG-CD1 4.34Å; K170-F175 HydrophobicContact CG-CE1 3.84Å; K170-F175 HydrophobicContact CG-CZ 4.24Å; N172-F175 HydrophobicContact CB-CB 4.15Å; N172-F175 WeakPolarHBondContact O-CB 3.49Å; N172-F175 PolarHBondContact O-N 3.31Å; F175-T178 PolarHBondContact O-N 3.09Å; F175-C179 WeakPolarHBondContact CE1-SG 3.15Å; F175-C179 PolarHBondContact O-N 3.45Å; F175-C179 PolarHBondContact O-SG 2.68Å
176R93.7Very high93.8Very high174 Ų17468.1 Ų68.166%0.65734%0.343SS*.Hα-helixtrans-62.8-43.7178.3-65.8-17771.8-178.12.8112.1K170 N172 P173 T178 C179 L180K170-R176 VanDerWaalsContact O-CG 3.28Å; K170-R176 WeakPolarHBondContact O-CG 3.39Å; N172-R176 PolarHBondContact O-N 3.25Å; N172-R176 VanDerWaalsContact O-N 3.09Å; P173-R176 PolarHBondContact O-N 3.09Å; R176-T178 VanDerWaalsContact C-N 3.34Å; R176-T178 PolarHBondContact O-N 3.02Å; R176-C179 PolarHBondContact O-N 3.31Å; R176-L180 PolarHBondContact O-N 2.89Å
177A95.5Very high93.8Very high44 Ų4468.1 Ų68.136%0.36434%0.343SS..Hα-helixtrans-60.6-44.2176.200000111.4P173 C179 L180 L181P173-A177 WeakPolarHBondContact O-CB 3.14Å; P173-A177 PolarHBondContact O-N 3.16Å; A177-C179 PolarHBondContact O-N 2.88Å; A177-L180 PolarHBondContact O-N 2.95Å; A177-L181 WeakPolarHBondContact O-CB 3.29Å; A177-L181 WeakPolarHBondContact O-CG 3.31Å; A177-L181 PolarHBondContact O-N 3.12Å
178T95Very high94Very high5 Ų565.3 Ų65.33%0.03133%0.334CS..Hα-helixtrans-63.9-40.4177.2-58.10000112.2L159 R160 M163 F174 F175 R176 L181 N182L159-T178 HydrophobicContact CB-CG2 4.21Å; L159-T178 HydrophobicContact CD2-CG2 4.02Å; L159-T178 HydrophobicContact CG-CG2 4.03Å; R160-T178 HydrophobicContact CB-CG2 4.07Å; M163-T178 VanDerWaalsContact CE-CB 3.45Å; M163-T178 HydrophobicContact CE-CG2 3.46Å; M163-T178 VanDerWaalsContact CE-CG2 3.46Å; M163-T178 WeakPolarHBondContact CE-OG1 3.28Å; F174-T178 WeakPolarHBondContact O-CB 3.2Å; F174-T178 PolarHBondContact O-N 2.95Å; F174-T178 PolarHBondContact O-OG1 3.34Å; F175-T178 PolarHBondContact O-N 3.09Å; R176-T178 VanDerWaalsContact C-N 3.34Å; R176-T178 PolarHBondContact O-N 3.02Å; T178-L181 PolarHBondContact O-N 3.03Å; T178-N182 WeakPolarHBondContact O-CB 3.41Å; T178-N182 PolarHBondContact O-N 2.87Å
179C93.7Very high94.2Very high11 Ų1165.8 Ų65.87%0.07433%0.333CS..Hα-helixtrans-63.7-44.1175.6-63.80000111.3F175 R176 A177 N182 I183F175-C179 WeakPolarHBondContact CE1-SG 3.15Å; F175-C179 PolarHBondContact O-N 3.45Å; F175-C179 PolarHBondContact O-SG 2.68Å; R176-C179 PolarHBondContact O-N 3.31Å; A177-C179 PolarHBondContact O-N 2.88Å; C179-N182 WeakPolarHBondContact O-CB 3.44Å; C179-N182 PolarHBondContact O-N 2.61Å; C179-I183 WeakPolarHBondContact O-CD1 3.34Å; C179-I183 WeakPolarHBondContact O-CG1 3.41Å; C179-I183 PolarHBondContact O-N 2.76Å
180L94.3Very high94.4Very high121 Ų12162.4 Ų62.463%0.63431%0.309SS*.Hα-helixtrans-61.3-47.5176.8-179.162.8000111.8R176 A177 N182 I183 S184R176-L180 PolarHBondContact O-N 2.89Å; A177-L180 PolarHBondContact O-N 2.95Å; L180-N182 VanDerWaalsContact C-N 3.32Å; L180-N182 PolarHBondContact O-N 3.44Å; L180-I183 PolarHBondContact O-N 2.91Å; L180-S184 PolarHBondContact O-N 3.01Å; L180-S184 PolarHBondContact O-OG 3.35Å
181L96.3Very high94.8Very high80 Ų8060.9 Ų60.942%0.41930%0.302SS..Hα-helixtrans-63.1-38176.3-74170.5000112F156 A177 T178 S184 S185F156-L181 HydrophobicContact CD1-CB 3.76Å; F156-L181 HydrophobicContact CD1-CD1 4.25Å; F156-L181 HydrophobicContact CE1-CB 3.89Å; F156-L181 HydrophobicContact CE1-CD1 3.79Å; F156-L181 HydrophobicContact CE1-CG 4.36Å; F156-L181 HydrophobicContact CG-CB 4.15Å; F156-L181 HydrophobicContact CZ-CB 4.37Å; F156-L181 HydrophobicContact CZ-CD1 4.5Å; A177-L181 WeakPolarHBondContact O-CB 3.29Å; A177-L181 WeakPolarHBondContact O-CG 3.31Å; A177-L181 PolarHBondContact O-N 3.12Å; T178-L181 PolarHBondContact O-N 3.03Å; L181-S184 WeakPolarHBondContact CA-OG 3.18Å; L181-S184 PolarHBondContact O-OG 3.39Å; L181-S185 WeakPolarHBondContact O-CB 3.43Å; L181-S185 PolarHBondContact O-N 3.27Å; L181-S185 PolarHBondContact O-OG 3.03Å
182N95.4Very high95.2Very high0 Ų056 Ų560%029%0.29CS..Hα-helixtrans-60.1-49.8174.9-179.244.4000110.3N153 F156 L157 T178 C179 L180 S185 F186 V234N153-N182 PolarHBondContact ND2-O 2.81Å; N153-N182 PolarHBondContact ND2-OD1 2.87Å; N153-N182 VanDerWaalsContact ND2-OD1 3.15Å; F156-N182 HydrophobicContact CB-CB 3.85Å; L157-N182 PolarHBondContact N-OD1 2.62Å; T178-N182 WeakPolarHBondContact O-CB 3.41Å; T178-N182 PolarHBondContact O-N 2.87Å; C179-N182 WeakPolarHBondContact O-CB 3.44Å; C179-N182 PolarHBondContact O-N 2.61Å; L180-N182 VanDerWaalsContact C-N 3.32Å; L180-N182 PolarHBondContact O-N 3.44Å; N182-S185 PolarHBondContact O-OG 3.15Å; N182-S185 VanDerWaalsContact O-OG 3.11Å; N182-F186 VanDerWaalsContact O-CB 3.23Å; N182-F186 WeakPolarHBondContact O-CB 3.32Å; N182-F186 PolarHBondContact O-N 2.93Å; N182-V234 VanDerWaalsContact ND2-CG1 3.31Å; N182-V234 WeakPolarHBondContact ND2-CG1 3.4Å
183I95.1Very high95.4Very high24 Ų2454.2 Ų54.212%0.12328%0.282CS..Hα-helixtrans-67-44.3-178.7-66.3150.1000112.1C179 L180 F186 I187 F231 V234 F239C179-I183 WeakPolarHBondContact O-CD1 3.34Å; C179-I183 WeakPolarHBondContact O-CG1 3.41Å; C179-I183 PolarHBondContact O-N 2.76Å; L180-I183 PolarHBondContact O-N 2.91Å; I183-F186 WeakPolarHBondContact O-CB 3.43Å; I183-F186 PolarHBondContact O-N 3.27Å; I183-I187 HydrophobicContact CG2-CD1 4.49Å; I183-I187 PolarHBondContact O-N 3.37Å; I183-F231 HydrophobicContact CG2-CE2 4.39Å; I183-V234 HydrophobicContact CG1-CG1 4.32Å; I183-F239 HydrophobicContact CD1-CD2 4.36Å; I183-F239 HydrophobicContact CD1-CE2 3.15Å; I183-F239 HydrophobicContact CD1-CZ 3.31Å; I183-F239 HydrophobicContact CG1-CE2 4.35Å
184S95.2Very high95.6Very high56 Ų5649.7 Ų49.739%0.39225%0.252SS..Hα-helixtrans-64-47.6-179.764.10000111.3L180 L181 F186 I187 V188L180-S184 PolarHBondContact O-N 3.01Å; L180-S184 PolarHBondContact O-OG 3.35Å; L181-S184 WeakPolarHBondContact CA-OG 3.18Å; L181-S184 PolarHBondContact O-OG 3.39Å; S184-F186 VanDerWaalsContact C-N 3.27Å; S184-F186 PolarHBondContact O-N 3.32Å; S184-I187 PolarHBondContact O-N 3.28Å; S184-V188 PolarHBondContact O-N 3.33Å
185S96.5Very high95.7Very high8 Ų847.3 Ų47.36%0.05625%0.249CC..Hα-helixtrans-66-29.6176.263.20000112.4N153 F156 L181 N182 V188 F189N153-S185 PolarHBondContact ND2-OG 2.66Å; F156-S185 WeakPolarHBondContact CD2-OG 3.17Å; L181-S185 WeakPolarHBondContact O-CB 3.43Å; L181-S185 PolarHBondContact O-N 3.27Å; L181-S185 PolarHBondContact O-OG 3.03Å; N182-S185 PolarHBondContact O-OG 3.15Å; N182-S185 VanDerWaalsContact O-OG 3.11Å; S185-V188 PolarHBondContact O-N 3.41Å; S185-F189 WeakPolarHBondContact O-CB 3.32Å; S185-F189 PolarHBondContact O-N 2.96Å
186F96.8Very high95.8Very high0 Ų051.8 Ų51.80%027%0.266CS..Iπ-helixtrans-61.4-47.3176.3-158.4-69.9000110.6N153 N182 I183 S184 V188 R190 F191 N227 L230 F231N153-F186 WeakPolarHBondContact ND2-CA 3.17Å; N153-F186 PolarHBondContact ND2-N 3.45Å; N153-F186 VanDerWaalsContact ND2-N 3.12Å; N153-F186 WeakPolarHBondContact OD1-CD2 3.31Å; N182-F186 VanDerWaalsContact O-CB 3.23Å; N182-F186 WeakPolarHBondContact O-CB 3.32Å; N182-F186 PolarHBondContact O-N 2.93Å; I183-F186 WeakPolarHBondContact O-CB 3.43Å; I183-F186 PolarHBondContact O-N 3.27Å; S184-F186 VanDerWaalsContact C-N 3.27Å; S184-F186 PolarHBondContact O-N 3.32Å; F186-V188 PolarHBondContact O-N 3.49Å; F186-R190 HydrophobicContact CD1-CB 3.98Å; F186-R190 HydrophobicContact CD1-CG 4.29Å; F186-R190 HydrophobicContact CE1-CB 3.97Å; F186-R190 HydrophobicContact CE1-CG 4.33Å; F186-R190 VanDerWaalsContact CE2-CD 3.43Å; F186-R190 HydrophobicContact CG-CG 4.46Å; F186-R190 WeakPolarHBondContact O-CA 3.32Å; F186-R190 WeakPolarHBondContact O-CB 3.11Å; F186-R190 PolarHBondContact O-N 3.22Å; F186-F191 HydrophobicContact CD1-CD2 4.21Å; F186-F191 AromaticContact CD1-CE2 3.82Å; F186-F191 HydrophobicContact CD1-CE2 3.82Å; F186-F191 HydrophobicContact CD1-CZ 4.27Å; F186-F191 HydrophobicContact CE1-CE1 4.46Å; F186-F191 AromaticContact CE1-CE2 3.88Å; F186-F191 HydrophobicContact CE1-CE2 3.88Å; F186-F191 AromaticContact CE1-CZ 3.85Å; F186-F191 HydrophobicContact CE1-CZ 3.85Å; F186-F191 PolarHBondContact O-N 2.84Å; F186-N227 HydrophobicContact CE1-CB 4.4Å; F186-N227 WeakPolarHBondContact CE1-O 3.08Å; F186-N227 HydrophobicContact CZ-CB 4.43Å; F186-N227 VanDerWaalsContact CZ-O 3.26Å; F186-N227 WeakPolarHBondContact CZ-O 3.4Å; F186-L230 HydrophobicContact CE2-CB 4.45Å; F186-L230 HydrophobicContact CE2-CD2 3.9Å; F186-L230 HydrophobicContact CE2-CG 4.02Å; F186-L230 HydrophobicContact CZ-CB 4.21Å; F186-L230 HydrophobicContact CZ-CD2 4.2Å; F186-L230 HydrophobicContact CZ-CG 4.26Å; F186-F231 HydrophobicContact CB-CD2 4.43Å; F186-F231 HydrophobicContact CD1-CB 4.21Å; F186-F231 AromaticContact CD1-CD2 3.55Å; F186-F231 HydrophobicContact CD1-CD2 3.55Å; F186-F231 HydrophobicContact CD1-CE2 4.36Å; F186-F231 HydrophobicContact CD1-CG 4.27Å; F186-F231 HydrophobicContact CE1-CB 3.62Å; F186-F231 AromaticContact CE1-CD2 3.88Å; F186-F231 HydrophobicContact CE1-CD2 3.88Å; F186-F231 HydrophobicContact CE1-CG 4.15Å; F186-F231 AromaticContact CG-CD2 3.92Å; F186-F231 HydrophobicContact CG-CD2 3.92Å; F186-F231 HydrophobicContact CZ-CB 3.82Å; F186-F231 HydrophobicContact CZ-CD2 4.47Å
187I95.8Very high95.9Very high72 Ų7243.6 Ų43.637%0.36924%0.236SC..Iπ-helixtrans-63.1-46.4-179.6-64167.1000110.6I183 S184 F191 M192 F231I183-I187 HydrophobicContact CG2-CD1 4.49Å; I183-I187 PolarHBondContact O-N 3.37Å; S184-I187 PolarHBondContact O-N 3.28Å; I187-F191 HydrophobicContact CG1-CD2 4.39Å; I187-F191 WeakPolarHBondContact O-CB 3.3Å; I187-F191 PolarHBondContact O-N 3.46Å; I187-M192 HydrophobicContact CG2-CE 4.48Å; I187-M192 PolarHBondContact O-N 3.39Å; I187-F231 HydrophobicContact CG1-CE2 4.28Å
188V96.5Very high95.9Very high68 Ų6844.1 Ų44.141%0.41223%0.234SC..Iπ-helixtrans-68.8-60.6-178.1177.90000111.3S184 S185 F186 M192 V193S184-V188 PolarHBondContact O-N 3.33Å; S185-V188 PolarHBondContact O-N 3.41Å; F186-V188 PolarHBondContact O-N 3.49Å; V188-M192 VanDerWaalsContact O-CB 3.3Å; V188-M192 WeakPolarHBondContact O-CB 3.23Å; V188-M192 PolarHBondContact O-N 3.37Å; V188-V193 PolarHBondContact O-N 3.19Å
189F96.6Very high96Very high43 Ų4351.5 Ų51.519%0.18926%0.261CS..Iπ-helixtrans-82.4-21.2-169.8-70.8-73.9000114.2L69 L149 P150 V152 N153 S185 V193L69-F189 HydrophobicContact CD2-CE1 4.1Å; L69-F189 HydrophobicContact CD2-CZ 4.49Å; L149-F189 HydrophobicContact CB-CD1 4.26Å; L149-F189 WeakPolarHBondContact O-CD1 3.46Å; P150-F189 WeakPolarHBondContact CG-O 3.38Å; V152-F189 HydrophobicContact CB-CD1 4.12Å; V152-F189 HydrophobicContact CB-CD2 3.98Å; V152-F189 HydrophobicContact CB-CE1 4.16Å; V152-F189 HydrophobicContact CB-CE2 4.02Å; V152-F189 HydrophobicContact CB-CG 4.02Å; V152-F189 HydrophobicContact CB-CZ 4.11Å; V152-F189 HydrophobicContact CG1-CD2 3.88Å; V152-F189 HydrophobicContact CG1-CE1 4.3Å; V152-F189 HydrophobicContact CG1-CE2 3.5Å; V152-F189 HydrophobicContact CG1-CG 4.4Å; V152-F189 HydrophobicContact CG1-CZ 3.74Å; V152-F189 HydrophobicContact CG2-CD1 4.33Å; V152-F189 HydrophobicContact CG2-CE1 4.14Å; V152-F189 HydrophobicContact CG2-CZ 4.35Å; N153-F189 HydrophobicContact CB-CB 4.3Å; S185-F189 WeakPolarHBondContact O-CB 3.32Å; S185-F189 PolarHBondContact O-N 2.96Å; F189-V193 HydrophobicContact CD1-CG2 4.49Å; F189-V193 VanDerWaalsContact O-CB 3.3Å; F189-V193 WeakPolarHBondContact O-CB 3.46Å
190R96.2Very high96.1Very high22 Ų2252.4 Ų52.48%0.08326%0.263CS..Iπ-helixtrans-98.1-65175.1-57.4-176.2167.9-130.40.8110.5P150 N153 S154 F186 L194 N227P150-R190 HydrophobicContact CB-CG 4.22Å; N153-R190 HydrophobicContact CB-CG 4.33Å; N153-R190 WeakPolarHBondContact OD1-CD 3.46Å; N153-R190 PolarHBondContact OD1-NE 2.97Å; S154-R190 PolarHBondContact OG-NH2 2.97Å; F186-R190 HydrophobicContact CD1-CB 3.98Å; F186-R190 HydrophobicContact CD1-CG 4.29Å; F186-R190 HydrophobicContact CE1-CB 3.97Å; F186-R190 HydrophobicContact CE1-CG 4.33Å; F186-R190 VanDerWaalsContact CE2-CD 3.43Å; F186-R190 HydrophobicContact CG-CG 4.46Å; F186-R190 WeakPolarHBondContact O-CA 3.32Å; F186-R190 WeakPolarHBondContact O-CB 3.11Å; F186-R190 PolarHBondContact O-N 3.22Å; R190-L194 WeakPolarHBondContact O-CB 3.05Å; R190-L194 WeakPolarHBondContact O-CD1 3.25Å; R190-L194 PolarHBondContact O-N 2.96Å; R190-N227 WeakPolarHBondContact CD-OD1 3.27Å; R190-N227 PolarHBondContact NH1-OD1 3.45Å
191F96.2Very high96.1Very high46 Ų4647 Ų4720%0.20224%0.235CC..Iπ-helixtrans-67.5-49.6-173.5-66.8-52.1000113.2F186 I187 S195 M224 I228 F231F186-F191 HydrophobicContact CD1-CD2 4.21Å; F186-F191 AromaticContact CD1-CE2 3.82Å; F186-F191 HydrophobicContact CD1-CE2 3.82Å; F186-F191 HydrophobicContact CD1-CZ 4.27Å; F186-F191 HydrophobicContact CE1-CE1 4.46Å; F186-F191 AromaticContact CE1-CE2 3.88Å; F186-F191 HydrophobicContact CE1-CE2 3.88Å; F186-F191 AromaticContact CE1-CZ 3.85Å; F186-F191 HydrophobicContact CE1-CZ 3.85Å; F186-F191 PolarHBondContact O-N 2.84Å; I187-F191 HydrophobicContact CG1-CD2 4.39Å; I187-F191 WeakPolarHBondContact O-CB 3.3Å; I187-F191 PolarHBondContact O-N 3.46Å; F191-S195 WeakPolarHBondContact O-CB 3.42Å; F191-S195 PolarHBondContact O-N 3.44Å; F191-S195 PolarHBondContact O-OG 3.44Å; F191-M224 HydrophobicContact CD1-SD 4.04Å; F191-M224 HydrophobicContact CE1-SD 4.41Å; F191-I228 HydrophobicContact CE1-CG1 3.91Å; F191-I228 HydrophobicContact CZ-CG1 4.46Å; F191-F231 HydrophobicContact CE2-CB 4.16Å; F191-F231 HydrophobicContact CE2-CD1 4.11Å; F191-F231 AromaticContact CE2-CD2 3.86Å; F191-F231 HydrophobicContact CE2-CD2 3.86Å; F191-F231 HydrophobicContact CE2-CE1 4.49Å; F191-F231 HydrophobicContact CE2-CE2 4.25Å; F191-F231 AromaticContact CE2-CG 3.77Å; F191-F231 HydrophobicContact CE2-CG 3.77Å; F191-F231 HydrophobicContact CZ-CB 3.83Å; F191-F231 HydrophobicContact CZ-CD1 4.26Å; F191-F231 HydrophobicContact CZ-CD2 4.41Å; F191-F231 AromaticContact CZ-CG 3.92Å; F191-F231 HydrophobicContact CZ-CG 3.92Å
192M97Very high96Very high121 Ų12146.9 Ų46.960%0.59624%0.238SC*.Iπ-helixtrans-68.2-45.7-177.5-58.8-179.2169.400111.9I187 V188 S195 W196I187-M192 HydrophobicContact CG2-CE 4.48Å; I187-M192 PolarHBondContact O-N 3.39Å; V188-M192 VanDerWaalsContact O-CB 3.3Å; V188-M192 WeakPolarHBondContact O-CB 3.23Å; V188-M192 PolarHBondContact O-N 3.37Å; M192-S195 PolarHBondContact O-N 2.9Å; M192-W196 WeakPolarHBondContact O-CB 3.46Å; M192-W196 PolarHBondContact O-N 3.32Å
193V96.7Very high96Very high22 Ų2251.4 Ų51.413%0.13326%0.261CS..Hα-helixtrans-63.6-49178.9177.10000111.5V146 L149 V188 F189 S195 W196 M197V146-V193 HydrophobicContact CG1-CG1 3.74Å; L149-V193 HydrophobicContact CB-CG1 4.24Å; L149-V193 HydrophobicContact CB-CG2 4.39Å; L149-V193 HydrophobicContact CD1-CG1 4.22Å; L149-V193 HydrophobicContact CD1-CG2 4.38Å; V188-V193 PolarHBondContact O-N 3.19Å; F189-V193 HydrophobicContact CD1-CG2 4.49Å; F189-V193 VanDerWaalsContact O-CB 3.3Å; F189-V193 WeakPolarHBondContact O-CB 3.46Å; V193-S195 VanDerWaalsContact C-N 3.29Å; V193-S195 PolarHBondContact O-N 3.47Å; V193-W196 WeakPolarHBondContact O-CB 3.47Å; V193-W196 PolarHBondContact O-N 3.49Å; V193-W196 VanDerWaalsContact O-N 3.14Å; V193-M197 HydrophobicContact CG1-CG 4.3Å; V193-M197 HydrophobicContact CG1-SD 4.23Å; V193-M197 VanDerWaalsContact O-CG 3.3Å; V193-M197 WeakPolarHBondContact O-CG 3.47Å; V193-M197 PolarHBondContact O-N 2.89Å
194L95.9Very high95.9Very high6 Ų651.2 Ų51.23%0.03126%0.26CS..Hα-helixtrans-64.4-36.1179.7-85.870.8000111.9P150 R190 W196 M197 T198 L220 L223 M224 N227P150-L194 HydrophobicContact CG-CD1 3.63Å; R190-L194 WeakPolarHBondContact O-CB 3.05Å; R190-L194 WeakPolarHBondContact O-CD1 3.25Å; R190-L194 PolarHBondContact O-N 2.96Å; L194-W196 VanDerWaalsContact C-N 3.34Å; L194-M197 PolarHBondContact O-N 2.94Å; L194-T198 WeakPolarHBondContact O-CB 3.32Å; L194-T198 PolarHBondContact O-N 2.92Å; L194-T198 PolarHBondContact O-OG1 2.94Å; L194-L220 HydrophobicContact CG-CD2 4.37Å; L194-L223 HydrophobicContact CD2-CB 4.06Å; L194-M224 HydrophobicContact CB-CE 3.53Å; L194-M224 HydrophobicContact CB-SD 4.46Å; L194-M224 HydrophobicContact CD2-CE 4.39Å; L194-M224 HydrophobicContact CD2-SD 4.45Å; L194-N227 WeakPolarHBondContact CD2-ND2 3.47Å
195S96.8Very high95.7Very high64 Ų6455.7 Ų55.745%0.44827%0.268SS..Hα-helixtrans-64.8-41.6174.8-59.10000111.2F191 M192 V193 T198 R199F191-S195 WeakPolarHBondContact O-CB 3.42Å; F191-S195 PolarHBondContact O-N 3.44Å; F191-S195 PolarHBondContact O-OG 3.44Å; M192-S195 PolarHBondContact O-N 2.9Å; V193-S195 VanDerWaalsContact C-N 3.29Å; V193-S195 PolarHBondContact O-N 3.47Å; S195-T198 PolarHBondContact O-N 3.43Å; S195-R199 WeakPolarHBondContact O-CB 3.37Å; S195-R199 PolarHBondContact O-N 2.97Å
196W96.5Very high95.5Very high100 Ų10061.8 Ų61.838%0.37930%0.3SS..Hα-helixtrans-61.8-45.2174.1-179.794000111.7L82 V146 M192 V193 L194 T198 R199 W200L82-W196 HydrophobicContact CD1-CH2 4.17Å; L82-W196 HydrophobicContact CD2-CH2 3.69Å; L82-W196 HydrophobicContact CD2-CZ3 3.97Å; V146-W196 HydrophobicContact CB-CZ3 4.48Å; V146-W196 HydrophobicContact CG1-CE3 4.04Å; V146-W196 HydrophobicContact CG1-CZ3 3.85Å; V146-W196 HydrophobicContact CG2-CZ3 4.02Å; M192-W196 WeakPolarHBondContact O-CB 3.46Å; M192-W196 PolarHBondContact O-N 3.32Å; V193-W196 WeakPolarHBondContact O-CB 3.47Å; V193-W196 PolarHBondContact O-N 3.49Å; V193-W196 VanDerWaalsContact O-N 3.14Å; L194-W196 VanDerWaalsContact C-N 3.34Å; W196-T198 VanDerWaalsContact C-N 3.3Å; W196-T198 PolarHBondContact O-N 3.36Å; W196-R199 PolarHBondContact O-N 3.47Å; W196-W200 HydrophobicContact CH2-CB 4.47Å; W196-W200 AromaticContact CH2-CD1 3.84Å; W196-W200 HydrophobicContact CH2-CG 4.26Å; W196-W200 HydrophobicContact CZ3-CB 4.37Å; W196-W200 HydrophobicContact CZ3-CG 4.48Å; W196-W200 WeakPolarHBondContact O-CB 3.38Å; W196-W200 PolarHBondContact O-N 2.78Å
197M96.1Very high95.2Very high3 Ų370.4 Ų70.42%0.01533%0.333CS..Hα-helixtrans-61.9-39.2177.2-69.5-173.771.400112.2Y143 V146 V193 L194 W200 I201 L220Y143-M197 HydrophobicContact CD1-CE 3.7Å; Y143-M197 HydrophobicContact CD2-CE 4.11Å; Y143-M197 HydrophobicContact CE1-CE 3.32Å; Y143-M197 HydrophobicContact CE2-CB 4.18Å; Y143-M197 HydrophobicContact CE2-CE 3.75Å; Y143-M197 HydrophobicContact CE2-CG 4.45Å; Y143-M197 HydrophobicContact CG-CE 4.1Å; Y143-M197 PolarHBondContact OH-O 3.5Å; V146-M197 HydrophobicContact CB-CE 4.39Å; V146-M197 HydrophobicContact CB-CG 4.43Å; V146-M197 HydrophobicContact CB-SD 4.23Å; V146-M197 HydrophobicContact CG1-CE 4.4Å; V146-M197 HydrophobicContact CG1-CG 3.54Å; V146-M197 HydrophobicContact CG1-SD 3.68Å; V193-M197 HydrophobicContact CG1-CG 4.3Å; V193-M197 HydrophobicContact CG1-SD 4.23Å; V193-M197 VanDerWaalsContact O-CG 3.3Å; V193-M197 WeakPolarHBondContact O-CG 3.47Å; V193-M197 PolarHBondContact O-N 2.89Å; L194-M197 PolarHBondContact O-N 2.94Å; M197-W200 PolarHBondContact O-N 2.81Å; M197-I201 PolarHBondContact O-N 2.78Å; M197-I201 VanDerWaalsContact O-N 3.08Å; M197-L220 HydrophobicContact CB-CD1 4.05Å; M197-L220 HydrophobicContact CB-CD2 4.04Å; M197-L220 HydrophobicContact CE-CD2 4.35Å; M197-L220 HydrophobicContact SD-CD2 4.33Å
198T96.2Very high95Very high54 Ų5467.5 Ų67.533%0.33132%0.318SS..Hα-helixtrans-65.4-45.6175.6-56.10000110.8L194 S195 W196 W200 I201 V202L194-T198 WeakPolarHBondContact O-CB 3.32Å; L194-T198 PolarHBondContact O-N 2.92Å; L194-T198 PolarHBondContact O-OG1 2.94Å; S195-T198 PolarHBondContact O-N 3.43Å; W196-T198 VanDerWaalsContact C-N 3.3Å; W196-T198 PolarHBondContact O-N 3.36Å; T198-W200 VanDerWaalsContact C-N 3.31Å; T198-W200 PolarHBondContact O-N 2.79Å; T198-I201 VanDerWaalsContact O-CG2 3.28Å; T198-I201 WeakPolarHBondContact O-CG2 3.3Å; T198-V202 VanDerWaalsContact O-CG2 3.26Å; T198-V202 WeakPolarHBondContact O-CG2 3.43Å; T198-V202 PolarHBondContact O-N 3.04Å
199R96.4Very high94.9Very high160 Ų16067.7 Ų67.760%0.60432%0.321SS*.Hα-helixtrans-61-42.1174.4178.3176.8172-91-0.9111.4S195 W196 V202 I203S195-R199 WeakPolarHBondContact O-CB 3.37Å; S195-R199 PolarHBondContact O-N 2.97Å; W196-R199 PolarHBondContact O-N 3.47Å; R199-V202 PolarHBondContact O-N 3.38Å; R199-I203 HydrophobicContact CG-CD1 3.66Å; R199-I203 HydrophobicContact CG-CG1 4.37Å; R199-I203 WeakPolarHBondContact O-CG1 3.47Å; R199-I203 PolarHBondContact O-N 2.83Å
200W95.1Very high94.7Very high31 Ų3173.3 Ų73.312%0.11735%0.345CS..Hα-helixtrans-62.2-46.5-178.2-175.797.3000112.2L82 I83 Y143 W196 M197 T198 V202 I203 N204L82-W200 HydrophobicContact CB-CH2 4.34Å; L82-W200 HydrophobicContact CB-CZ2 3.8Å; I83-W200 HydrophobicContact CD1-CH2 4Å; I83-W200 HydrophobicContact CD1-CZ2 4.2Å; I83-W200 HydrophobicContact CG1-CH2 3.59Å; I83-W200 HydrophobicContact CG1-CZ2 3.87Å; Y143-W200 HydrophobicContact CD2-CD2 4.23Å; Y143-W200 AromaticContact CD2-CE3 3.61Å; Y143-W200 HydrophobicContact CD2-CE3 3.61Å; Y143-W200 HydrophobicContact CD2-CH2 4.5Å; Y143-W200 AromaticContact CD2-CZ3 3.77Å; Y143-W200 HydrophobicContact CD2-CZ3 3.77Å; Y143-W200 HydrophobicContact CE2-CD2 4.16Å; Y143-W200 AromaticContact CE2-CE3 3.43Å; Y143-W200 HydrophobicContact CE2-CE3 3.43Å; Y143-W200 VanDerWaalsContact CE2-CE3 3.43Å; Y143-W200 AromaticContact CE2-CZ3 3.94Å; Y143-W200 HydrophobicContact CE2-CZ3 3.94Å; W196-W200 HydrophobicContact CH2-CB 4.47Å; W196-W200 AromaticContact CH2-CD1 3.84Å; W196-W200 HydrophobicContact CH2-CG 4.26Å; W196-W200 HydrophobicContact CZ3-CB 4.37Å; W196-W200 HydrophobicContact CZ3-CG 4.48Å; W196-W200 WeakPolarHBondContact O-CB 3.38Å; W196-W200 PolarHBondContact O-N 2.78Å; M197-W200 PolarHBondContact O-N 2.81Å; T198-W200 VanDerWaalsContact C-N 3.31Å; T198-W200 PolarHBondContact O-N 2.79Å; W200-V202 VanDerWaalsContact C-N 3.32Å; W200-V202 PolarHBondContact O-N 2.85Å; W200-I203 PolarHBondContact O-N 3.38Å; W200-N204 HydrophobicContact CH2-CB 4.4Å; W200-N204 HydrophobicContact CZ2-CB 4.4Å; W200-N204 WeakPolarHBondContact O-CB 3.43Å; W200-N204 PolarHBondContact O-N 3.21Å; W200-N204 PolarHBondContact O-ND2 2.75Å
201I94.4Very high94.6Very high7 Ų774.7 Ų74.74%0.03637%0.367CS..Hα-helixtrans-68.8-32.6-178.9-162.6172000111.8M197 T198 R205 Y213 L220M197-I201 PolarHBondContact O-N 2.78Å; M197-I201 VanDerWaalsContact O-N 3.08Å; T198-I201 VanDerWaalsContact O-CG2 3.28Å; T198-I201 WeakPolarHBondContact O-CG2 3.3Å; I201-R205 PolarHBondContact O-N 3.18Å; I201-Y213 HydrophobicContact CD1-CD2 4.26Å; I201-Y213 HydrophobicContact CG1-CD2 3.8Å; I201-Y213 HydrophobicContact CG1-CE2 4.12Å; I201-L220 HydrophobicContact CG2-CD1 4.26Å
202V95.2Very high94.5Very high78 Ų7876.4 Ų76.447%0.47337%0.372SS..Hα-helixtrans-69.2-44175.6171.60000111.5T198 R199 W200 R205T198-V202 VanDerWaalsContact O-CG2 3.26Å; T198-V202 WeakPolarHBondContact O-CG2 3.43Å; T198-V202 PolarHBondContact O-N 3.04Å; R199-V202 PolarHBondContact O-N 3.38Å; W200-V202 VanDerWaalsContact C-N 3.32Å; W200-V202 PolarHBondContact O-N 2.85Å; V202-R205 WeakPolarHBondContact O-CB 3.45Å; V202-R205 WeakPolarHBondContact O-CG 3.28Å; V202-R205 PolarHBondContact O-N 2.97Å
203I94.5Very high94.4Very high95 Ų9573.7 Ų73.749%0.48736%0.356SS..Hα-helixtrans-67.4-40.2179-70.1172.1000111.4R199 W200 R205R199-I203 HydrophobicContact CG-CD1 3.66Å; R199-I203 HydrophobicContact CG-CG1 4.37Å; R199-I203 WeakPolarHBondContact O-CG1 3.47Å; R199-I203 PolarHBondContact O-N 2.83Å; W200-I203 PolarHBondContact O-N 3.38Å; I203-R205 VanDerWaalsContact C-N 3.3Å; I203-R205 PolarHBondContact O-N 3.02Å
204N92.7Very high94.3Very high20 Ų2074.6 Ų74.611%0.10736%0.363CS..THydrogen-bonded Turntrans-92.518.5-177.6-66.8-84.3000113.1W200 D206 R207 V208W200-N204 HydrophobicContact CH2-CB 4.4Å; W200-N204 HydrophobicContact CZ2-CB 4.4Å; W200-N204 WeakPolarHBondContact O-CB 3.43Å; W200-N204 PolarHBondContact O-N 3.21Å; W200-N204 PolarHBondContact O-ND2 2.75Å; N204-D206 PolarHBondContact O-N 3.43Å; N204-D206 VanDerWaalsContact O-N 3.11Å; N204-R207 PolarHBondContact O-N 3.22Å; N204-R207 PolarHBondContact OD1-NH1 3.06Å; N204-V208 PolarHBondContact O-N 3.48Å
205R91.4Very high94.3Very high150 Ų15076.8 Ų76.857%0.56637%0.374SS*.G310 helixtrans-53.3-36.2-17567.5172.2-131.8172.74.3113.4I201 V202 I203 R207 V208 Y213I201-R205 PolarHBondContact O-N 3.18Å; V202-R205 WeakPolarHBondContact O-CB 3.45Å; V202-R205 WeakPolarHBondContact O-CG 3.28Å; V202-R205 PolarHBondContact O-N 2.97Å; I203-R205 VanDerWaalsContact C-N 3.3Å; I203-R205 PolarHBondContact O-N 3.02Å; R205-R207 VanDerWaalsContact C-N 3.25Å; R205-R207 PolarHBondContact O-N 2.61Å; R205-V208 PolarHBondContact O-N 3.13Å; R205-Y213 HydrophobicContact CB-CD2 4.14Å; R205-Y213 HydrophobicContact CB-CE2 3.82Å
206D92.6Very high94.2Very high135 Ų13574.2 Ų74.272%0.72236%0.358SS*.G310 helixtrans-78.1-13.4-175.4-53.6-43.5000112.2N204N204-D206 PolarHBondContact O-N 3.43Å; N204-D206 VanDerWaalsContact O-N 3.11Å
207R91.3Very high94.1Very high181 Ų18171.1 Ų71.168%0.68335%0.352SS*.G310 helixtrans-95.8-12.7176.3-61.9-179179.8156.9-7.5113.1I83 N204 R205I83-R207 HydrophobicContact CD1-CB 4.11Å; N204-R207 PolarHBondContact O-N 3.22Å; N204-R207 PolarHBondContact OD1-NH1 3.06Å; R205-R207 VanDerWaalsContact C-N 3.25Å; R205-R207 PolarHBondContact O-N 2.61Å
208V91.7Very high94.1Very high12 Ų1275.5 Ų75.57%0.07338%0.378CS..SBendtrans-106.8121-175.8-178.10000108.3Y140 N204 R205Y140-V208 HydrophobicContact CE1-CG1 4.35Å; Y140-V208 HydrophobicContact CE1-CG2 4.2Å; N204-V208 PolarHBondContact O-N 3.48Å; R205-V208 PolarHBondContact O-N 3.13Å
209P93.4Very high94Very high72 Ų7273.1 Ų73.147%0.46836%0.364SS..  trans-55.8144.7175.6-22.232.2000111.1Y140 G211 Y212 Y213Y140-P209 WeakPolarHBondContact OH-CD 3.48Å; P209-G211 PolarHBondContact O-N 3.09Å; P209-Y212 HydrophobicContact CB-CD2 4.1Å; P209-Y212 HydrophobicContact CG-CD2 4.1Å; P209-Y212 PolarHBondContact O-N 3.34Å; P209-Y213 PolarHBondContact O-N 2.98Å
210F93.1Very high94Very high160 Ų16066 Ų6670%0.70234%0.338SS*.Hα-helixtrans-50.1-41-170.9-178.4-107000113.9Y213 C214F210-Y213 PolarHBondContact O-N 3.34Å; F210-C214 VanDerWaalsContact CE2-SG 3.52Å; F210-C214 WeakPolarHBondContact CZ-SG 3.42Å; F210-C214 WeakPolarHBondContact O-CB 3.47Å; F210-C214 PolarHBondContact O-N 3.08Å; F210-C214 PolarHBondContact O-SG 3.04Å
211G93.6Very high94.1Very high51 Ų5167.2 Ų67.253%0.52636%0.355SS..Hα-helixtrans-59.8-48.3178.300000113.8P209 C214 L215P209-G211 PolarHBondContact O-N 3.09Å; G211-C214 PolarHBondContact O-N 3.08Å; G211-L215 WeakPolarHBondContact O-CB 3.36Å; G211-L215 PolarHBondContact O-N 3.03Å
212Y94Very high94.1Very high83 Ų8369.1 Ų69.133%0.32537%0.367SS..Hα-helixtrans-68.7-36.4177.3-65.5-74.8000111.6S137 Y140 P209 L215 G216S137-Y212 WeakPolarHBondContact CB-OH 3.39Å; Y140-Y212 HydrophobicContact CD2-CD1 4.12Å; Y140-Y212 HydrophobicContact CD2-CE1 4.4Å; Y140-Y212 HydrophobicContact CD2-CG 4.31Å; Y140-Y212 AromaticContact CE2-CD1 3.99Å; Y140-Y212 HydrophobicContact CE2-CD1 3.99Å; Y140-Y212 AromaticContact CE2-CD2 3.87Å; Y140-Y212 HydrophobicContact CE2-CD2 3.87Å; Y140-Y212 HydrophobicContact CE2-CE1 4.3Å; Y140-Y212 HydrophobicContact CE2-CE2 4.2Å; Y140-Y212 AromaticContact CE2-CG 3.78Å; Y140-Y212 HydrophobicContact CE2-CG 3.78Å; P209-Y212 HydrophobicContact CB-CD2 4.1Å; P209-Y212 HydrophobicContact CG-CD2 4.1Å; P209-Y212 PolarHBondContact O-N 3.34Å; Y212-L215 PolarHBondContact O-N 3.37Å; Y212-G216 PolarHBondContact O-N 3.45Å
213Y94.9Very high94Very high64 Ų6466.6 Ų66.625%0.25135%0.351SS..Hα-helixtrans-61.3-48.3175.2175.4-96000111.5I201 R205 P209 F210 G216 S217I201-Y213 HydrophobicContact CD1-CD2 4.26Å; I201-Y213 HydrophobicContact CG1-CD2 3.8Å; I201-Y213 HydrophobicContact CG1-CE2 4.12Å; R205-Y213 HydrophobicContact CB-CD2 4.14Å; R205-Y213 HydrophobicContact CB-CE2 3.82Å; P209-Y213 PolarHBondContact O-N 2.98Å; F210-Y213 PolarHBondContact O-N 3.34Å; Y213-G216 PolarHBondContact O-N 3.49Å; Y213-S217 VanDerWaalsContact O-CB 3.25Å; Y213-S217 WeakPolarHBondContact O-CB 3.34Å; Y213-S217 PolarHBondContact O-N 3.02Å; Y213-S217 PolarHBondContact O-OG 3.21Å
214C95.2Very high94.1Very high41 Ų4163.9 Ų63.928%0.27734%0.336SS..Hα-helixtrans-62.5-46.6176.8-75.40000111.8F210 G211 G216 S217 V218F210-C214 VanDerWaalsContact CE2-SG 3.52Å; F210-C214 WeakPolarHBondContact CZ-SG 3.42Å; F210-C214 WeakPolarHBondContact O-CB 3.47Å; F210-C214 PolarHBondContact O-N 3.08Å; F210-C214 PolarHBondContact O-SG 3.04Å; G211-C214 PolarHBondContact O-N 3.08Å; C214-G216 PolarHBondContact O-N 3.46Å; C214-S217 WeakPolarHBondContact CA-OG 3.34Å; C214-S217 PolarHBondContact O-OG 3.08Å; C214-V218 VanDerWaalsContact O-CB 3.28Å; C214-V218 WeakPolarHBondContact O-CB 3.1Å; C214-V218 VanDerWaalsContact O-CG2 3.27Å; C214-V218 WeakPolarHBondContact O-CG2 3.27Å; C214-V218 PolarHBondContact O-N 2.86Å
215L95.4Very high94.2Very high51 Ų5167.2 Ų67.227%0.26736%0.357SS..Hα-helixtrans-59.3-48.9178.3179.161.5000111.6L129 S133 G211 Y212 G219L129-L215 HydrophobicContact CB-CD1 3.88Å; L129-L215 HydrophobicContact CD1-CD1 4.36Å; S133-L215 WeakPolarHBondContact OG-CD2 3.3Å; G211-L215 WeakPolarHBondContact O-CB 3.36Å; G211-L215 PolarHBondContact O-N 3.03Å; Y212-L215 PolarHBondContact O-N 3.37Å; L215-G219 WeakPolarHBondContact O-CA 3.36Å; L215-G219 PolarHBondContact O-N 3.2Å
216G94.4Very high94.3Very high11 Ų1161.5 Ų61.511%0.11334%0.337CS..Hα-helixtrans-66.4-43.8-179.900000113.3Y212 Y213 C214 L220Y212-G216 PolarHBondContact O-N 3.45Å; Y213-G216 PolarHBondContact O-N 3.49Å; C214-G216 PolarHBondContact O-N 3.46Å; G216-L220 VanDerWaalsContact O-CB 3.3Å; G216-L220 WeakPolarHBondContact O-CB 3.34Å; G216-L220 VanDerWaalsContact O-CG 3.32Å; G216-L220 WeakPolarHBondContact O-CG 3.32Å; G216-L220 PolarHBondContact O-N 3.08Å
217S95.3Very high94.3Very high35 Ų3555.6 Ų55.625%0.24531%0.306CS..Hα-helixtrans-69.7-47-178.955.80000112.7Y213 C214 L220 A221Y213-S217 VanDerWaalsContact O-CB 3.25Å; Y213-S217 WeakPolarHBondContact O-CB 3.34Å; Y213-S217 PolarHBondContact O-N 3.02Å; Y213-S217 PolarHBondContact O-OG 3.21Å; C214-S217 WeakPolarHBondContact CA-OG 3.34Å; C214-S217 PolarHBondContact O-OG 3.08Å; S217-L220 PolarHBondContact O-N 2.98Å; S217-A221 WeakPolarHBondContact O-CB 3.26Å; S217-A221 PolarHBondContact O-N 3Å
218V95.6Very high94.5Very high94 Ų9450.7 Ų50.757%0.5729%0.292SS*.Hα-helixtrans-64.4-43.7175.7174.30000110.2C214 L220 A221 V222C214-V218 VanDerWaalsContact O-CB 3.28Å; C214-V218 WeakPolarHBondContact O-CB 3.1Å; C214-V218 VanDerWaalsContact O-CG2 3.27Å; C214-V218 WeakPolarHBondContact O-CG2 3.27Å; C214-V218 PolarHBondContact O-N 2.86Å; V218-L220 PolarHBondContact O-N 3.39Å; V218-A221 PolarHBondContact O-N 3.43Å; V218-V222 WeakPolarHBondContact O-CG2 3.44Å; V218-V222 PolarHBondContact O-N 3.39Å
219G94.7Very high94.6Very high4 Ų452.6 Ų52.64%0.04130%0.304CS..Hα-helixtrans-58.5-49.9177.100000112L215 A221 V222 L223L215-G219 WeakPolarHBondContact O-CA 3.36Å; L215-G219 PolarHBondContact O-N 3.2Å; G219-A221 VanDerWaalsContact C-N 3.33Å; G219-A221 PolarHBondContact O-N 3.38Å; G219-V222 PolarHBondContact O-N 2.89Å; G219-L223 VanDerWaalsContact O-CG 3.23Å; G219-L223 WeakPolarHBondContact O-CG 3.46Å; G219-L223 PolarHBondContact O-N 2.85Å
220L95.7Very high94.5Very high11 Ų1151.3 Ų51.36%0.05829%0.293CS..Hα-helixtrans-60-40.1175.6-82.7176.8000113.3Y143 L194 M197 I201 G216 S217 V218 L223 M224Y143-L220 WeakPolarHBondContact OH-CD1 3.42Å; L194-L220 HydrophobicContact CG-CD2 4.37Å; M197-L220 HydrophobicContact CB-CD1 4.05Å; M197-L220 HydrophobicContact CB-CD2 4.04Å; M197-L220 HydrophobicContact CE-CD2 4.35Å; M197-L220 HydrophobicContact SD-CD2 4.33Å; I201-L220 HydrophobicContact CG2-CD1 4.26Å; G216-L220 VanDerWaalsContact O-CB 3.3Å; G216-L220 WeakPolarHBondContact O-CB 3.34Å; G216-L220 VanDerWaalsContact O-CG 3.32Å; G216-L220 WeakPolarHBondContact O-CG 3.32Å; G216-L220 PolarHBondContact O-N 3.08Å; S217-L220 PolarHBondContact O-N 2.98Å; V218-L220 PolarHBondContact O-N 3.39Å; L220-L223 PolarHBondContact O-N 3.14Å; L220-M224 WeakPolarHBondContact O-CB 3.34Å; L220-M224 PolarHBondContact O-N 2.88Å
221A96.1Very high94.5Very high56 Ų5646.1 Ų46.146%0.46327%0.27SS..Hα-helixtrans-61.9-46.5178.600000111.3S217 V218 G219 L223 M224 V225S217-A221 WeakPolarHBondContact O-CB 3.26Å; S217-A221 PolarHBondContact O-N 3Å; V218-A221 PolarHBondContact O-N 3.43Å; G219-A221 VanDerWaalsContact C-N 3.33Å; G219-A221 PolarHBondContact O-N 3.38Å; A221-L223 PolarHBondContact O-N 2.82Å; A221-M224 PolarHBondContact O-N 3.23Å; A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 3.35Å
222V95.1Very high94.5Very high47 Ų4748.7 Ų48.729%0.28527%0.27SS..Hα-helixtrans-59.2-48.4174.9172.80000110.5V122 V126 V218 G219 M224 V225 M226V122-V222 HydrophobicContact CG1-CG1 4.07Å; V126-V222 HydrophobicContact CG2-CG1 4.27Å; V218-V222 WeakPolarHBondContact O-CG2 3.44Å; V218-V222 PolarHBondContact O-N 3.39Å; G219-V222 PolarHBondContact O-N 2.89Å; V222-M224 VanDerWaalsContact C-N 3.32Å; V222-M224 PolarHBondContact O-N 3.4Å; V222-V225 PolarHBondContact O-N 3Å; V222-M226 HydrophobicContact CG1-CG 4.48Å; V222-M226 HydrophobicContact CG1-SD 4.08Å; V222-M226 VanDerWaalsContact O-CG 3.32Å; V222-M226 WeakPolarHBondContact O-CG 3.48Å; V222-M226 PolarHBondContact O-N 3.35Å
223L94.2Very high94.4Very high26 Ų2650.8 Ų50.814%0.13628%0.278CS..Hα-helixtrans-61.3-38.9178.9-67.4179.1000112.5H123 L194 G219 L220 A221 M226 N227H123-L223 WeakPolarHBondContact ND1-CD2 3.45Å; L194-L223 HydrophobicContact CD2-CB 4.06Å; G219-L223 VanDerWaalsContact O-CG 3.23Å; G219-L223 WeakPolarHBondContact O-CG 3.46Å; G219-L223 PolarHBondContact O-N 2.85Å; L220-L223 PolarHBondContact O-N 3.14Å; A221-L223 PolarHBondContact O-N 2.82Å; L223-M226 PolarHBondContact O-N 3.4Å; L223-N227 WeakPolarHBondContact O-CB 3.34Å; L223-N227 VanDerWaalsContact O-CG 3.27Å; L223-N227 PolarHBondContact O-N 3.44Å; L223-N227 PolarHBondContact O-ND2 2.98Å
224M95.4Very high94.2Very high37 Ų3748 Ų4818%0.18227%0.268CS..Hα-helixtrans-64.9-47.3177.9-174.363.181.500111.2F191 L194 L220 A221 V222 M226 N227 I228F191-M224 HydrophobicContact CD1-SD 4.04Å; F191-M224 HydrophobicContact CE1-SD 4.41Å; L194-M224 HydrophobicContact CB-CE 3.53Å; L194-M224 HydrophobicContact CB-SD 4.46Å; L194-M224 HydrophobicContact CD2-CE 4.39Å; L194-M224 HydrophobicContact CD2-SD 4.45Å; L220-M224 WeakPolarHBondContact O-CB 3.34Å; L220-M224 PolarHBondContact O-N 2.88Å; A221-M224 PolarHBondContact O-N 3.23Å; V222-M224 VanDerWaalsContact C-N 3.32Å; V222-M224 PolarHBondContact O-N 3.4Å; M224-M226 VanDerWaalsContact C-N 3.34Å; M224-M226 PolarHBondContact O-N 2.81Å; M224-N227 PolarHBondContact O-N 3.42Å; M224-I228 HydrophobicContact CG-CD1 4.25Å; M224-I228 WeakPolarHBondContact O-CG1 3.27Å; M224-I228 PolarHBondContact O-N 2.91Å
225V95.4Very high94.1Very high91 Ų9148 Ų4855%0.55227%0.267SS*.Hα-helixtrans-59.5-46.4177.2172.40000110.8A221 V222 N227 I228 V229A221-V225 WeakPolarHBondContact O-CG2 3.39Å; A221-V225 PolarHBondContact O-N 3.35Å; V222-V225 PolarHBondContact O-N 3Å; V225-N227 VanDerWaalsContact C-N 3.32Å; V225-N227 PolarHBondContact O-N 3.08Å; V225-I228 WeakPolarHBondContact O-CB 3.37Å; V225-I228 PolarHBondContact O-N 2.96Å; V225-V229 WeakPolarHBondContact O-CG2 3.49Å; V225-V229 PolarHBondContact O-N 3.49Å; V225-V229 VanDerWaalsContact O-N 3.08Å
226M92.9Very high93.8Very high29 Ų2951.5 Ų51.514%0.14328%0.277CS..Hα-helixtrans-60.3-41176.1-72.5-173.958.700112.6E119 H123 V222 L223 M224 I228 V229 L230E119-M226 HydrophobicContact CG-CE 3.57Å; E119-M226 HydrophobicContact CG-SD 4.46Å; E119-M226 VanDerWaalsContact O-CE 3.28Å; E119-M226 WeakPolarHBondContact O-CE 3.33Å; H123-M226 HydrophobicContact CB-CE 3.46Å; H123-M226 VanDerWaalsContact CB-CE 3.46Å; H123-M226 HydrophobicContact CB-SD 3.8Å; V222-M226 HydrophobicContact CG1-CG 4.48Å; V222-M226 HydrophobicContact CG1-SD 4.08Å; V222-M226 VanDerWaalsContact O-CG 3.32Å; V222-M226 WeakPolarHBondContact O-CG 3.48Å; V222-M226 PolarHBondContact O-N 3.35Å; L223-M226 PolarHBondContact O-N 3.4Å; M224-M226 VanDerWaalsContact C-N 3.34Å; M224-M226 PolarHBondContact O-N 2.81Å; M226-I228 VanDerWaalsContact C-N 3.34Å; M226-I228 PolarHBondContact O-N 3.39Å; M226-V229 PolarHBondContact O-N 3.46Å; M226-L230 WeakPolarHBondContact O-CB 3.39Å; M226-L230 PolarHBondContact O-N 2.92Å
227N93.6Very high93.5Very high11 Ų1152.4 Ų52.46%0.05928%0.284CS..Hα-helixtrans-65.2-36.4177.1-80.7-47.1000112.6F186 R190 L194 L223 M224 V225 F231F186-N227 HydrophobicContact CE1-CB 4.4Å; F186-N227 WeakPolarHBondContact CE1-O 3.08Å; F186-N227 HydrophobicContact CZ-CB 4.43Å; F186-N227 VanDerWaalsContact CZ-O 3.26Å; F186-N227 WeakPolarHBondContact CZ-O 3.4Å; R190-N227 WeakPolarHBondContact CD-OD1 3.27Å; R190-N227 PolarHBondContact NH1-OD1 3.45Å; L194-N227 WeakPolarHBondContact CD2-ND2 3.47Å; L223-N227 WeakPolarHBondContact O-CB 3.34Å; L223-N227 VanDerWaalsContact O-CG 3.27Å; L223-N227 PolarHBondContact O-N 3.44Å; L223-N227 PolarHBondContact O-ND2 2.98Å; M224-N227 PolarHBondContact O-N 3.42Å; V225-N227 VanDerWaalsContact C-N 3.32Å; V225-N227 PolarHBondContact O-N 3.08Å; N227-F231 VanDerWaalsContact O-CB 3.28Å; N227-F231 WeakPolarHBondContact O-CB 3.38Å; N227-F231 PolarHBondContact O-N 2.96Å
228I94.9Very high93Very high79 Ų7951.1 Ų51.141%0.40527%0.274SS..Hα-helixtrans-62.4-48.7173.1-66.8161.5000110.3F191 M224 V225 M226 L230 F231 I232F191-I228 HydrophobicContact CE1-CG1 3.91Å; F191-I228 HydrophobicContact CZ-CG1 4.46Å; M224-I228 HydrophobicContact CG-CD1 4.25Å; M224-I228 WeakPolarHBondContact O-CG1 3.27Å; M224-I228 PolarHBondContact O-N 2.91Å; V225-I228 WeakPolarHBondContact O-CB 3.37Å; V225-I228 PolarHBondContact O-N 2.96Å; M226-I228 VanDerWaalsContact C-N 3.34Å; M226-I228 PolarHBondContact O-N 3.39Å; I228-L230 PolarHBondContact O-N 2.96Å; I228-F231 WeakPolarHBondContact O-CB 3.29Å; I228-F231 PolarHBondContact O-N 2.92Å; I228-I232 HydrophobicContact CG2-CD1 4.08Å; I228-I232 WeakPolarHBondContact O-CG1 3.13Å; I228-I232 PolarHBondContact O-N 3.27Å
229V93.4Very high92.4Very high52 Ų5251.6 Ų51.632%0.31527%0.269SS..Hα-helixtrans-60.6-46.1178.7173.60000111.1V225 M226 F231 I232 R233V225-V229 WeakPolarHBondContact O-CG2 3.49Å; V225-V229 PolarHBondContact O-N 3.49Å; V225-V229 VanDerWaalsContact O-N 3.08Å; M226-V229 PolarHBondContact O-N 3.46Å; V229-F231 VanDerWaalsContact C-N 3.33Å; V229-F231 PolarHBondContact O-N 3.06Å; V229-I232 PolarHBondContact O-N 2.68Å; V229-R233 WeakPolarHBondContact O-CG 3.45Å; V229-R233 PolarHBondContact O-N 3.49Å; V229-R233 VanDerWaalsContact O-N 3.07Å
230L91.5Very high91.5Very high45 Ų4555.4 Ų55.424%0.23629%0.288CS..Hα-helixtrans-63-40.2178.7-17565.2000111.9L157 F186 M226 I228 R233 V234L157-L230 HydrophobicContact CD1-CD1 4.36Å; L157-L230 HydrophobicContact CD1-CD2 3.75Å; L157-L230 HydrophobicContact CD1-CG 4.23Å; F186-L230 HydrophobicContact CE2-CB 4.45Å; F186-L230 HydrophobicContact CE2-CD2 3.9Å; F186-L230 HydrophobicContact CE2-CG 4.02Å; F186-L230 HydrophobicContact CZ-CB 4.21Å; F186-L230 HydrophobicContact CZ-CD2 4.2Å; F186-L230 HydrophobicContact CZ-CG 4.26Å; M226-L230 WeakPolarHBondContact O-CB 3.39Å; M226-L230 PolarHBondContact O-N 2.92Å; I228-L230 PolarHBondContact O-N 2.96Å; L230-R233 PolarHBondContact O-N 3.03Å; L230-V234 WeakPolarHBondContact O-CG2 3.38Å; L230-V234 PolarHBondContact O-N 3.26Å
231F94.2Very high90.2Very high50 Ų5056.6 Ų56.622%0.21930%0.295CS..Hα-helixtrans-60.5-47.9176.4-176.6-107.5000111.7I183 F186 I187 F191 N227 I228 V229 R233 V234 V235I183-F231 HydrophobicContact CG2-CE2 4.39Å; F186-F231 HydrophobicContact CB-CD2 4.43Å; F186-F231 HydrophobicContact CD1-CB 4.21Å; F186-F231 AromaticContact CD1-CD2 3.55Å; F186-F231 HydrophobicContact CD1-CD2 3.55Å; F186-F231 HydrophobicContact CD1-CE2 4.36Å; F186-F231 HydrophobicContact CD1-CG 4.27Å; F186-F231 HydrophobicContact CE1-CB 3.62Å; F186-F231 AromaticContact CE1-CD2 3.88Å; F186-F231 HydrophobicContact CE1-CD2 3.88Å; F186-F231 HydrophobicContact CE1-CG 4.15Å; F186-F231 AromaticContact CG-CD2 3.92Å; F186-F231 HydrophobicContact CG-CD2 3.92Å; F186-F231 HydrophobicContact CZ-CB 3.82Å; F186-F231 HydrophobicContact CZ-CD2 4.47Å; I187-F231 HydrophobicContact CG1-CE2 4.28Å; F191-F231 HydrophobicContact CE2-CB 4.16Å; F191-F231 HydrophobicContact CE2-CD1 4.11Å; F191-F231 AromaticContact CE2-CD2 3.86Å; F191-F231 HydrophobicContact CE2-CD2 3.86Å; F191-F231 HydrophobicContact CE2-CE1 4.49Å; F191-F231 HydrophobicContact CE2-CE2 4.25Å; F191-F231 AromaticContact CE2-CG 3.77Å; F191-F231 HydrophobicContact CE2-CG 3.77Å; F191-F231 HydrophobicContact CZ-CB 3.83Å; F191-F231 HydrophobicContact CZ-CD1 4.26Å; F191-F231 HydrophobicContact CZ-CD2 4.41Å; F191-F231 AromaticContact CZ-CG 3.92Å; F191-F231 HydrophobicContact CZ-CG 3.92Å; N227-F231 VanDerWaalsContact O-CB 3.28Å; N227-F231 WeakPolarHBondContact O-CB 3.38Å; N227-F231 PolarHBondContact O-N 2.96Å; I228-F231 WeakPolarHBondContact O-CB 3.29Å; I228-F231 PolarHBondContact O-N 2.92Å; V229-F231 VanDerWaalsContact C-N 3.33Å; V229-F231 PolarHBondContact O-N 3.06Å; F231-R233 VanDerWaalsContact C-N 3.31Å; F231-R233 PolarHBondContact O-N 3.44Å; F231-V234 PolarHBondContact O-N 3.46Å; F231-V235 HydrophobicContact CD1-CG2 4.22Å; F231-V235 HydrophobicContact CD2-CG2 4.36Å; F231-V235 HydrophobicContact CE1-CG2 3.85Å; F231-V235 HydrophobicContact CE2-CG2 4.02Å; F231-V235 HydrophobicContact CG-CG2 4.47Å; F231-V235 HydrophobicContact CZ-CG2 3.75Å; F231-V235 WeakPolarHBondContact O-CG2 3.11Å; F231-V235 PolarHBondContact O-N 2.77Å
232I93.6Very high88.5Confident105 Ų10557.1 Ų57.154%0.53829%0.29SS..Hα-helixtrans-58.1-45.5177.4-66.8167000110.4I228 V229 V234 V235 Y236I228-I232 HydrophobicContact CG2-CD1 4.08Å; I228-I232 WeakPolarHBondContact O-CG1 3.13Å; I228-I232 PolarHBondContact O-N 3.27Å; V229-I232 PolarHBondContact O-N 2.68Å; I232-V234 PolarHBondContact O-N 3.21Å; I232-V235 PolarHBondContact O-N 3.3Å; I232-Y236 WeakPolarHBondContact O-CB 3.11Å; I232-Y236 PolarHBondContact O-N 2.87Å
233R91.5Very high86.7Confident127 Ų12759.7 Ų59.748%0.47930%0.302SS..Hα-helixtrans-60.1-43.5177.8-71.1176.8-174.7162.85.7112.2E119 V229 L230 F231 A237E119-R233 IonicContact OE1-NH1 3.95Å; E119-R233 IonicContact OE2-CZ 3.77Å; E119-R233 IonicContact OE2-NH1 3.17Å; E119-R233 PolarHBondContact OE2-NH1 3.37Å; E119-R233 IonicContact OE2-NH2 3.83Å; E119-R233 PolarHBondContact OE2-NH2 2.79Å; V229-R233 WeakPolarHBondContact O-CG 3.45Å; V229-R233 PolarHBondContact O-N 3.49Å; V229-R233 VanDerWaalsContact O-N 3.07Å; L230-R233 PolarHBondContact O-N 3.03Å; F231-R233 VanDerWaalsContact C-N 3.31Å; F231-R233 PolarHBondContact O-N 3.44Å; R233-A237 VanDerWaalsContact O-CB 3.32Å; R233-A237 WeakPolarHBondContact O-CB 3.29Å; R233-A237 PolarHBondContact O-N 3.25Å
234V91.1Very high84.8Confident7 Ų762.9 Ų62.94%0.04232%0.323CS..Hα-helixtrans-64.3-50.1178.7167.40000110.9N182 I183 L230 F231 I232 Y236 A237 D238N182-V234 VanDerWaalsContact ND2-CG1 3.31Å; N182-V234 WeakPolarHBondContact ND2-CG1 3.4Å; I183-V234 HydrophobicContact CG1-CG1 4.32Å; L230-V234 WeakPolarHBondContact O-CG2 3.38Å; L230-V234 PolarHBondContact O-N 3.26Å; F231-V234 PolarHBondContact O-N 3.46Å; I232-V234 PolarHBondContact O-N 3.21Å; V234-Y236 VanDerWaalsContact C-N 3.3Å; V234-Y236 PolarHBondContact O-N 3.12Å; V234-A237 PolarHBondContact O-N 3.31Å; V234-D238 WeakPolarHBondContact O-CB 3.17Å; V234-D238 PolarHBondContact O-N 3.44Å
235V91.3Very high82.9Confident41 Ų4165.9 Ų65.925%0.24834%0.343CS..Hα-helixtrans-59.7-42.9179.8170.80000111F231 I232 D238 F239F231-V235 HydrophobicContact CD1-CG2 4.22Å; F231-V235 HydrophobicContact CD2-CG2 4.36Å; F231-V235 HydrophobicContact CE1-CG2 3.85Å; F231-V235 HydrophobicContact CE2-CG2 4.02Å; F231-V235 HydrophobicContact CG-CG2 4.47Å; F231-V235 HydrophobicContact CZ-CG2 3.75Å; F231-V235 WeakPolarHBondContact O-CG2 3.11Å; F231-V235 PolarHBondContact O-N 2.77Å; I232-V235 PolarHBondContact O-N 3.3Å; V235-D238 PolarHBondContact O-N 3.16Å; V235-F239 HydrophobicContact CG1-CD2 4.22Å; V235-F239 PolarHBondContact O-N 3.37Å
236Y90.6Very high81Confident123 Ų12364.8 Ų64.848%0.48234%0.339SS..Iπ-helixtrans-62.6-45.3177.4-174.7-87.4000112.4I232 V234 D238 L240 T241I232-Y236 WeakPolarHBondContact O-CB 3.11Å; I232-Y236 PolarHBondContact O-N 2.87Å; V234-Y236 VanDerWaalsContact C-N 3.3Å; V234-Y236 PolarHBondContact O-N 3.12Å; Y236-D238 PolarHBondContact O-N 3.45Å; Y236-L240 HydrophobicContact CD2-CB 3.85Å; Y236-L240 HydrophobicContact CD2-CD1 3.5Å; Y236-L240 HydrophobicContact CD2-CG 4.28Å; Y236-L240 HydrophobicContact CE2-CB 4.1Å; Y236-L240 HydrophobicContact CE2-CD1 4.18Å; Y236-L240 HydrophobicContact CG-CB 4.27Å; Y236-L240 HydrophobicContact CG-CD1 4.27Å; Y236-L240 WeakPolarHBondContact O-CB 3.45Å; Y236-L240 PolarHBondContact O-N 3Å; Y236-L240 VanDerWaalsContact O-N 3.15Å; Y236-T241 PolarHBondContact O-N 3.32Å; Y236-T241 PolarHBondContact O-OG1 3.37Å
237A87.4Confident79Confident31 Ų3166.5 Ų66.526%0.25636%0.355SS..Iπ-helixtrans-69-32.5-178.700000113.3R160 K170 R233 V234R160-A237 VanDerWaalsContact NH2-CB 3.25Å; K170-A237 PolarHBondContact NZ-O 2.93Å; R233-A237 VanDerWaalsContact O-CB 3.32Å; R233-A237 WeakPolarHBondContact O-CB 3.29Å; R233-A237 PolarHBondContact O-N 3.25Å; V234-A237 PolarHBondContact O-N 3.31Å
238D85.4Confident77.2Confident8 Ų868.4 Ų68.44%0.04337%0.372CS..Iπ-helixtrans-88.6-36-175.7-73.2-14.8000113.9R160 V234 V235 Y236 N242R160-D238 IonicContact CZ-OD1 2.74Å; R160-D238 IonicContact CZ-OD2 2.98Å; R160-D238 IonicContact NE-OD1 2.74Å; R160-D238 PolarHBondContact NE-OD1 2.78Å; R160-D238 IonicContact NE-OD2 2.67Å; R160-D238 PolarHBondContact NE-OD2 2.88Å; R160-D238 IonicContact NH2-OD1 3.51Å; R160-D238 PolarHBondContact NH2-OD1 3.19Å; R160-D238 IonicContact NH2-OD2 3.11Å; V234-D238 WeakPolarHBondContact O-CB 3.17Å; V234-D238 PolarHBondContact O-N 3.44Å; V235-D238 PolarHBondContact O-N 3.16Å; Y236-D238 PolarHBondContact O-N 3.45Å; D238-N242 PolarHBondContact O-ND2 3.48Å
239F81.8Confident75.5Confident104 Ų10467.1 Ų67.146%0.45637%0.373SS..Iπ-helixtrans-114.6-42.1-174.7-58.1-72.1000113.7I183 V235I183-F239 HydrophobicContact CD1-CD2 4.36Å; I183-F239 HydrophobicContact CD1-CE2 3.15Å; I183-F239 HydrophobicContact CD1-CZ 3.31Å; I183-F239 HydrophobicContact CG1-CE2 4.35Å; V235-F239 HydrophobicContact CG1-CD2 4.22Å; V235-F239 PolarHBondContact O-N 3.37Å
240L76.2Confident74.3Confident84 Ų8470.1 Ų70.144%0.4439%0.387SS..Iπ-helixtrans-78.7-39.9-171.2-62.5176.9000112.1Y236 N242 N243 T244Y236-L240 HydrophobicContact CD2-CB 3.85Å; Y236-L240 HydrophobicContact CD2-CD1 3.5Å; Y236-L240 HydrophobicContact CD2-CG 4.28Å; Y236-L240 HydrophobicContact CE2-CB 4.1Å; Y236-L240 HydrophobicContact CE2-CD1 4.18Å; Y236-L240 HydrophobicContact CG-CB 4.27Å; Y236-L240 HydrophobicContact CG-CD1 4.27Å; Y236-L240 WeakPolarHBondContact O-CB 3.45Å; Y236-L240 PolarHBondContact O-N 3Å; Y236-L240 VanDerWaalsContact O-N 3.15Å; L240-N242 PolarHBondContact O-N 3.23Å; L240-N243 PolarHBondContact O-N 3.4Å; L240-T244 PolarHBondContact O-N 2.97Å; L240-T244 PolarHBondContact O-OG1 3.23Å
241T69.7Low73.3Confident36 Ų3674 Ų7422%0.22141%0.407CS..Hα-helixtrans-63.7-30.8177-550000112.4Y236Y236-T241 PolarHBondContact O-N 3.32Å; Y236-T241 PolarHBondContact O-OG1 3.37Å
242N59.3Low72.2Confident66 Ų6676.7 Ų76.735%0.35343%0.427SS..Hα-helixtrans-71.8-33.3179.1-69.7-15000112.5K170 D238 L240 S246K170-N242 WeakPolarHBondContact CD-OD1 3.17Å; K170-N242 WeakPolarHBondContact CE-OD1 3.24Å; K170-N242 PolarHBondContact NZ-OD1 3.38Å; D238-N242 PolarHBondContact O-ND2 3.48Å; L240-N242 PolarHBondContact O-N 3.23Å; N242-S246 WeakPolarHBondContact O-CB 3.47Å; N242-S246 PolarHBondContact O-N 2.94Å
243N57.1Low71.1Confident101 Ų10175.6 Ų75.654%0.5443%0.429SS..Hα-helixtrans-73.3-41.8-179.1-69.7-10.8000111.4L240 V245 S246 S247L240-N243 PolarHBondContact O-N 3.4Å; N243-V245 PolarHBondContact O-N 3.03Å; N243-S246 PolarHBondContact O-N 3.3Å; N243-S247 WeakPolarHBondContact O-CB 3.37Å; N243-S247 PolarHBondContact O-N 3.27Å; N243-S247 PolarHBondContact O-OG 2.94Å; N243-S247 VanDerWaalsContact O-OG 3.08Å
244T54.1Low70.1Confident94 Ų9472.5 Ų72.558%0.57743%0.431SS*.Hα-helixtrans-64-41.2-178-47.70000112.7L240 S247 A248L240-T244 PolarHBondContact O-N 2.97Å; L240-T244 PolarHBondContact O-OG1 3.23Å; T244-S247 PolarHBondContact O-N 3.11Å; T244-A248 WeakPolarHBondContact O-CB 3.39Å; T244-A248 PolarHBondContact O-N 2.94Å
245V57Low68.9Low100 Ų10076 Ų7661%0.60646%0.46SS*.Hα-helixtrans-68.9-39.4177.4179.80000111.3N243 A248 A249N243-V245 PolarHBondContact O-N 3.03Å; V245-A248 PolarHBondContact O-N 2.66Å; V245-A249 VanDerWaalsContact O-CB 3.3Å; V245-A249 WeakPolarHBondContact O-CB 3.39Å; V245-A249 PolarHBondContact O-N 3.03Å
246S54.1Low67Low67 Ų6777.1 Ų77.147%0.46948%0.48SS..Hα-helixtrans-63.7-45.3175.6-167.60000111.5N242 N243 A249 L250N242-S246 WeakPolarHBondContact O-CB 3.47Å; N242-S246 PolarHBondContact O-N 2.94Å; N243-S246 PolarHBondContact O-N 3.3Å; S246-A249 PolarHBondContact O-N 2.98Å; S246-L250 WeakPolarHBondContact O-CB 3.3Å; S246-L250 VanDerWaalsContact O-CG 3.27Å; S246-L250 WeakPolarHBondContact O-CG 3.45Å; S246-L250 PolarHBondContact O-N 3.19Å
247S50.7Low64.9Low66 Ų6675.8 Ų75.846%0.46249%0.489SS..Hα-helixtrans-63.1-42.6175.8-62.90000112.4N243 T244 L250 L251N243-S247 WeakPolarHBondContact O-CB 3.37Å; N243-S247 PolarHBondContact O-N 3.27Å; N243-S247 PolarHBondContact O-OG 2.94Å; N243-S247 VanDerWaalsContact O-OG 3.08Å; T244-S247 PolarHBondContact O-N 3.11Å; S247-L250 PolarHBondContact O-N 2.73Å; S247-L251 WeakPolarHBondContact O-CB 3.26Å; S247-L251 VanDerWaalsContact O-CG 3.28Å; S247-L251 WeakPolarHBondContact O-CG 3.42Å; S247-L251 PolarHBondContact O-N 3.13Å
248A55.7Low62.6Low51 Ų5177.1 Ų77.142%0.42151%0.505SS..Hα-helixtrans-64.4-42.4175.800000111.8T244 V245 L250 L251 V252T244-A248 WeakPolarHBondContact O-CB 3.39Å; T244-A248 PolarHBondContact O-N 2.94Å; V245-A248 PolarHBondContact O-N 2.66Å; A248-L250 PolarHBondContact O-N 3.31Å; A248-L251 PolarHBondContact O-N 3.18Å; A248-V252 WeakPolarHBondContact O-CG2 3.45Å; A248-V252 PolarHBondContact O-N 2.5Å
249A59.5Low60.2Low52 Ų5283.5 Ų83.543%0.4355%0.545SS..Hα-helixtrans-64.1-39.5176.100000112.3V245 S246 S253V245-A249 VanDerWaalsContact O-CB 3.3Å; V245-A249 WeakPolarHBondContact O-CB 3.39Å; V245-A249 PolarHBondContact O-N 3.03Å; S246-A249 PolarHBondContact O-N 2.98Å; A249-S253 WeakPolarHBondContact O-CB 3.02Å; A249-S253 PolarHBondContact O-N 2.83Å; A249-S253 PolarHBondContact O-OG 3.15Å
250L68.2Low58Low115 Ų11582.1 Ų82.160%0.60256%0.56SS**Hα-helixtrans-65.6-41.5174-72.7171.7000112S246 S247 A248 S253 A254S246-L250 WeakPolarHBondContact O-CB 3.3Å; S246-L250 VanDerWaalsContact O-CG 3.27Å; S246-L250 WeakPolarHBondContact O-CG 3.45Å; S246-L250 PolarHBondContact O-N 3.19Å; S247-L250 PolarHBondContact O-N 2.73Å; A248-L250 PolarHBondContact O-N 3.31Å; L250-S253 PolarHBondContact O-N 2.84Å; L250-A254 VanDerWaalsContact O-CB 3.28Å; L250-A254 WeakPolarHBondContact O-CB 3.39Å; L250-A254 PolarHBondContact O-N 3.41Å
251L70.5Confident56Low127 Ų12782.8 Ų82.867%0.66558%0.578SS**Hα-helixtrans-64.6-42.1176-74169.7000112.1S247 A248 S253 A254 A255S247-L251 WeakPolarHBondContact O-CB 3.26Å; S247-L251 VanDerWaalsContact O-CG 3.28Å; S247-L251 WeakPolarHBondContact O-CG 3.42Å; S247-L251 PolarHBondContact O-N 3.13Å; A248-L251 PolarHBondContact O-N 3.18Å; L251-S253 VanDerWaalsContact C-N 3.35Å; L251-A254 PolarHBondContact O-N 3.43Å; L251-A255 WeakPolarHBondContact O-CB 3.17Å; L251-A255 PolarHBondContact O-N 3.27Å
252V70.9Confident54.4Low105 Ų10587.7 Ų87.764%0.63661%0.61SS**Hα-helixtrans-65.7-39.8175.3172.20000111A248 A255 G256A248-V252 WeakPolarHBondContact O-CG2 3.45Å; A248-V252 PolarHBondContact O-N 2.5Å; V252-A255 PolarHBondContact O-N 3.14Å; V252-G256 PolarHBondContact O-N 3.27Å
253S70.7Confident53.1Low82 Ų8288.2 Ų88.257%0.57363%0.631SS**Hα-helixtrans-67.6-39.9177.2-56.80000111.7A249 L250 L251 G256 S257A249-S253 WeakPolarHBondContact O-CB 3.02Å; A249-S253 PolarHBondContact O-N 2.83Å; A249-S253 PolarHBondContact O-OG 3.15Å; L250-S253 PolarHBondContact O-N 2.84Å; L251-S253 VanDerWaalsContact C-N 3.35Å; S253-G256 PolarHBondContact O-N 3.34Å; S253-S257 PolarHBondContact O-N 3Å; S253-S257 PolarHBondContact O-OG 3.2Å
254A70.1Confident51.9Low63 Ų6393.2 Ų93.252%0.52165%0.648SS.*Hα-helixtrans-66-38.2174.400000112.2L250 L251 G256 S257L250-A254 VanDerWaalsContact O-CB 3.28Å; L250-A254 WeakPolarHBondContact O-CB 3.39Å; L250-A254 PolarHBondContact O-N 3.41Å; L251-A254 PolarHBondContact O-N 3.43Å; A254-G256 VanDerWaalsContact C-N 3.34Å; A254-S257 PolarHBondContact O-N 3.03Å; A254-S257 PolarHBondContact O-OG 2.9Å
255A67.3Low50.9Low80 Ų8094.5 Ų94.566%0.66166%0.657SS**Hα-helixtrans-68.1-33.4173.100000112.3L251 V252 S257L251-A255 WeakPolarHBondContact O-CB 3.17Å; L251-A255 PolarHBondContact O-N 3.27Å; V252-A255 PolarHBondContact O-N 3.14Å; A255-S257 VanDerWaalsContact C-N 3.33Å; A255-S257 PolarHBondContact O-N 3.08Å
256G50.3Low49.5Very low65 Ų6598.2 Ų98.267%0.6767%0.668SS**Hα-helixtrans-74.1-15.7178.200000115.1V252 S253 A254 G258V252-G256 PolarHBondContact O-N 3.27Å; S253-G256 PolarHBondContact O-N 3.34Å; A254-G256 VanDerWaalsContact C-N 3.34Å; G256-G258 PolarHBondContact O-N 2.74Å
257S46.6Very low48.3Very low95 Ų95101.5 Ų101.566%0.66468%0.68SS**THydrogen-bonded Turntrans-81.56.1174.338.60000114.7S253 A254 A255 T259S253-S257 PolarHBondContact O-N 3Å; S253-S257 PolarHBondContact O-OG 3.2Å; A254-S257 PolarHBondContact O-N 3.03Å; A254-S257 PolarHBondContact O-OG 2.9Å; A255-S257 VanDerWaalsContact C-N 3.33Å; A255-S257 PolarHBondContact O-N 3.08Å; S257-T259 PolarHBondContact O-N 2.74Å
258G40.2Very low47.2Very low58 Ų58104.4 Ų104.460%0.59870%0.7SS**SBendtrans-76.999.1169.500000112.4G256G256-G258 PolarHBondContact O-N 2.74Å
259T35.3Very low46.1Very low142 Ų142107.2 Ų107.287%0.87171%0.712SS**  trans-3.4120.1157.456.20000118S257S257-T259 PolarHBondContact O-N 2.74Å
260G34.1Very low44.6Very low75 Ų75114.3 Ų114.377%0.77374%0.735SS**  trans156.888.915800000117.5
261A34.1Very low42.7Very low99 Ų99113.2 Ų113.282%0.81874%0.737SS**  trans49.3147.9148.100000122.4
262P36.6Very low40.8Very low139 Ų139112.9 Ų112.990%0.90375%0.746SS**  trans-92.6118.8-158.835.2-29.2000113.5
263G33.3Very low38.6Very low76 Ų76118.6 Ų118.678%0.78476%0.757SS**  trans-118131.3166.300000110.6
264K31Very low36.6Very low207 Ų207121 Ų12190%0.977%0.768SS**  trans-53.7154.6-169.3-76.2170.9172.81750116
265P33.2Very low34.5Very low120 Ų120123.3 Ų123.378%0.77978%0.781SS**  trans-96.2124.9-172.335.5-27.3000112.1
266H27.8Very low32.6Very low179 Ų179123.1 Ų123.183%0.82978%0.779SS**  trans-165.1100.6157.5-145.2-96.3000111.1
267L28.9Very low31.7Very low136 Ų136131.2 Ų131.271%0.71280%0.799SS**  171.4113.1125.8-13270.2000109.9V269L267-V269 HydrophobicContact CB-CG2 4.47Å; L267-V269 HydrophobicContact CD2-CG2 3.97Å; L267-V269 HydrophobicContact CG-CG2 4.36Å; L267-V269 PolarHBondContact O-N 3.1Å
268S26.7Very low31Very low126 Ų126133.1 Ų133.188%0.88181%0.806SS**  trans-74102.6165.641.80000109.4
269V32.5Very low30.5Very low111 Ų111137 Ų13767%0.67382%0.817SS**  trans-111.9107.1169-177.90000109.7L267 S271L267-V269 HydrophobicContact CB-CG2 4.47Å; L267-V269 HydrophobicContact CD2-CG2 3.97Å; L267-V269 HydrophobicContact CG-CG2 4.36Å; L267-V269 PolarHBondContact O-N 3.1Å; V269-S271 PolarHBondContact O-N 2.9Å; V269-S271 VanDerWaalsContact O-N 3.08Å
270H27.7Very low30.2Very low201 Ų201136.7 Ų136.793%0.93181%0.814SS**  trans-62.290.8170-143.4-87.4000109.4
271S28.8Very low30Very low92 Ų92140.4 Ų140.464%0.64382%0.816SS**  trans-160.885.4169.2-174.90000112.8V269V269-S271 PolarHBondContact O-N 2.9Å; V269-S271 VanDerWaalsContact O-N 3.08Å
272S30.2Very low29.7Very low120 Ų120142.9 Ų142.984%0.83982%0.816SS**  trans-151.660.3158.827.20000109.7
273Y25.2Very low29.3Very low225 Ų225143.2 Ų143.288%0.88281%0.81SS**  trans-126.866.5162.7-106.2-86.7000108.1
274V28.5Very low29Very low132 Ų132148 Ų14880%0.881%0.812SS**  trans-136.2123167.2-178.30000108.3
275S25.6Very low28.9Very low112 Ų112143.5 Ų143.578%0.78381%0.805SS**  trans81.679.8163.8-166.40000118.4
276A28.1Very low28.5Very low76 Ų76145.4 Ų145.463%0.62881%0.807SS**  trans-152.583.9133.200000107.5
277H31.9Very low28.5Very low235 Ų235142.4 Ų142.4100%1.08881%0.806SS**  trans-75.10166.4-89.4-63.6000110.3

Retrieved 277 of 277 residues in 161.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).