A0A077YXP3_TRITR Loading...

7TM GPCR Srsx domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXP3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 342 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
1M47.8Very low72.2Confident225 Ų22590.2 Ų90.2100%1.10849%0.488SS*.  01130-86.7178.2143.100105.9T3M1-T3 PolarHBondContact O-N 3.48Å
2D53.6Low72.9Confident121 Ų12184.8 Ų84.865%0.64746%0.46SS*.  trans-63.7129-168.7-70.9-26000109.7A4 E5 N6D2-A4 PolarHBondContact O-N 3.14Å; D2-E5 PolarHBondContact O-N 3.09Å; D2-N6 PolarHBondContact O-N 3.21Å
3T69.1Low73.6Confident127 Ų12783.6 Ų83.678%0.77946%0.457SS*.Hα-helixtrans-51.6-32.3-179.744.20000112.1M1 L7M1-T3 PolarHBondContact O-N 3.48Å; T3-L7 WeakPolarHBondContact O-CB 3.22Å; T3-L7 PolarHBondContact O-N 3.01Å
4A71.3Confident73.9Confident69 Ų6977.8 Ų77.857%0.5743%0.426SS*.Hα-helixtrans-66-43.9175.500000113.6D2 N6 L7 H8D2-A4 PolarHBondContact O-N 3.14Å; A4-N6 VanDerWaalsContact C-N 3.33Å; A4-N6 PolarHBondContact O-N 3.26Å; A4-L7 PolarHBondContact O-N 3.49Å; A4-H8 WeakPolarHBondContact O-CB 3.36Å; A4-H8 PolarHBondContact O-N 2.94Å
5E73.7Confident74.3Confident118 Ų11874.2 Ų74.255%0.55140%0.404SS*.Hα-helixtrans-66.6-38.8179.4-168.6-177.6-179.200110.8D2 H8 N9D2-E5 PolarHBondContact O-N 3.09Å; E5-H8 PolarHBondContact O-N 2.62Å; E5-N9 PolarHBondContact O-N 3.48Å; E5-N9 PolarHBondContact O-ND2 2.98Å
6N80.4Confident74.6Confident99 Ų9974.8 Ų74.853%0.52941%0.407SS..Hα-helixtrans-65.3-42.4174.4-162.919.4000111.4D2 A4 N9 I10D2-N6 PolarHBondContact O-N 3.21Å; A4-N6 VanDerWaalsContact C-N 3.33Å; A4-N6 PolarHBondContact O-N 3.26Å; N6-N9 PolarHBondContact O-N 3.33Å; N6-I10 WeakPolarHBondContact O-CB 3.27Å; N6-I10 WeakPolarHBondContact O-CD1 3.37Å; N6-I10 WeakPolarHBondContact O-CG1 3.35Å; N6-I10 PolarHBondContact O-N 3.4Å
7L77.4Confident74.9Confident41 Ų4173.6 Ų73.622%0.21540%0.4CS..Hα-helixtrans-64.7-40.8178.2-159.771.9000112T3 A4 I10 S11 V90 D166 P168T3-L7 WeakPolarHBondContact O-CB 3.22Å; T3-L7 PolarHBondContact O-N 3.01Å; A4-L7 PolarHBondContact O-N 3.49Å; L7-I10 PolarHBondContact O-N 3.49Å; L7-S11 WeakPolarHBondContact O-CB 3.31Å; L7-S11 PolarHBondContact O-N 3.42Å; L7-V90 HydrophobicContact CD2-CG1 3.59Å; L7-V90 HydrophobicContact CD2-CG2 4.15Å; L7-V90 HydrophobicContact CG-CG1 4.41Å; L7-V90 HydrophobicContact CG-CG2 4.1Å; L7-D166 HydrophobicContact CD2-CB 3.78Å; L7-P168 HydrophobicContact CD1-CB 3.97Å; L7-P168 HydrophobicContact CD1-CG 4.28Å; L7-P168 HydrophobicContact CG-CB 4.31Å
8H80.1Confident75.1Confident65 Ų6570.7 Ų70.730%0.30138%0.384SS..Hα-helixtrans-59.2-54.1174.1-17987.5000111.1A4 E5 I10 S11 V12 D88A4-H8 WeakPolarHBondContact O-CB 3.36Å; A4-H8 PolarHBondContact O-N 2.94Å; E5-H8 PolarHBondContact O-N 2.62Å; H8-I10 VanDerWaalsContact C-N 3.33Å; H8-I10 PolarHBondContact O-N 3.07Å; H8-S11 WeakPolarHBondContact O-CB 3.24Å; H8-S11 PolarHBondContact O-N 2.87Å; H8-S11 VanDerWaalsContact O-N 3.09Å; H8-S11 PolarHBondContact O-OG 3.48Å; H8-V12 WeakPolarHBondContact O-CG2 3.49Å; H8-V12 PolarHBondContact O-N 3.11Å; H8-D88 IonicContact CE1-OD2 3.75Å; H8-D88 VanDerWaalsContact ND1-CB 3.33Å; H8-D88 WeakPolarHBondContact ND1-CB 3.2Å; H8-D88 IonicContact ND1-OD2 3.26Å; H8-D88 PolarHBondContact ND1-OD2 3Å
9N81.4Confident75.3Confident86 Ų8668.6 Ų68.646%0.4638%0.375SS..Hα-helixtrans-59.9-42.3179.9-73.6-20.8000112.2E5 N6 S11 V12 V13E5-N9 PolarHBondContact O-N 3.48Å; E5-N9 PolarHBondContact O-ND2 2.98Å; N6-N9 PolarHBondContact O-N 3.33Å; N9-S11 VanDerWaalsContact C-N 3.35Å; N9-S11 PolarHBondContact O-N 2.86Å; N9-V12 PolarHBondContact O-N 3.47Å; N9-V13 WeakPolarHBondContact O-CG2 3.35Å; N9-V13 PolarHBondContact O-N 3.43Å; N9-V13 VanDerWaalsContact O-N 3.09Å
10I79.6Confident75.4Confident41 Ų4168.8 Ų68.821%0.2139%0.387CS..Hα-helixtrans-62.4-42.5175.6-68.7165.9000110.7N6 L7 H8 V12 V13 I14 P168N6-I10 WeakPolarHBondContact O-CB 3.27Å; N6-I10 WeakPolarHBondContact O-CD1 3.37Å; N6-I10 WeakPolarHBondContact O-CG1 3.35Å; N6-I10 PolarHBondContact O-N 3.4Å; L7-I10 PolarHBondContact O-N 3.49Å; H8-I10 VanDerWaalsContact C-N 3.33Å; H8-I10 PolarHBondContact O-N 3.07Å; I10-V12 VanDerWaalsContact C-N 3.33Å; I10-V12 PolarHBondContact O-N 3.47Å; I10-V13 PolarHBondContact O-N 3.37Å; I10-I14 HydrophobicContact CG2-CD1 3.51Å; I10-I14 HydrophobicContact CG2-CG1 4.24Å; I10-I14 WeakPolarHBondContact O-CB 3.28Å; I10-I14 WeakPolarHBondContact O-CG1 3.34Å; I10-I14 PolarHBondContact O-N 2.85Å; I10-P168 HydrophobicContact CG2-CB 3.97Å; I10-P168 HydrophobicContact CG2-CG 4.18Å
11S80Confident75.6Confident0 Ų067 Ų670%038%0.376CS..Hα-helixtrans-61.2-40.9178.977.60000112.7L7 H8 N9 F15 D88 P168L7-S11 WeakPolarHBondContact O-CB 3.31Å; L7-S11 PolarHBondContact O-N 3.42Å; H8-S11 WeakPolarHBondContact O-CB 3.24Å; H8-S11 PolarHBondContact O-N 2.87Å; H8-S11 VanDerWaalsContact O-N 3.09Å; H8-S11 PolarHBondContact O-OG 3.48Å; N9-S11 VanDerWaalsContact C-N 3.35Å; N9-S11 PolarHBondContact O-N 2.86Å; S11-F15 WeakPolarHBondContact O-CB 3.36Å; S11-F15 PolarHBondContact O-N 3.33Å; S11-D88 WeakPolarHBondContact OG-CB 3.39Å; S11-P168 WeakPolarHBondContact CB-O 3.47Å
12V80.9Confident77.1Confident25 Ų2556.9 Ų56.915%0.15233%0.326CS..Hα-helixtrans-68.6-47.8-179.71730000110.7H8 N9 I10 I14 F15 D16H8-V12 WeakPolarHBondContact O-CG2 3.49Å; H8-V12 PolarHBondContact O-N 3.11Å; N9-V12 PolarHBondContact O-N 3.47Å; I10-V12 VanDerWaalsContact C-N 3.33Å; I10-V12 PolarHBondContact O-N 3.47Å; V12-I14 VanDerWaalsContact C-N 3.32Å; V12-I14 PolarHBondContact O-N 3.32Å; V12-F15 PolarHBondContact O-N 2.97Å; V12-D16 WeakPolarHBondContact O-CB 3.41Å; V12-D16 PolarHBondContact O-N 2.89Å
13V81.4Confident78.4Confident70 Ų7059.8 Ų59.842%0.42433%0.329SS..Hα-helixtrans-58.9-46.2177.9172.10000110.7N9 I10 F15 D16 D17 V263N9-V13 WeakPolarHBondContact O-CG2 3.35Å; N9-V13 PolarHBondContact O-N 3.43Å; N9-V13 VanDerWaalsContact O-N 3.09Å; I10-V13 PolarHBondContact O-N 3.37Å; V13-F15 PolarHBondContact O-N 2.92Å; V13-D16 PolarHBondContact O-N 2.91Å; V13-D17 WeakPolarHBondContact O-CB 3.4Å; V13-D17 PolarHBondContact O-N 3.43Å; V13-V263 HydrophobicContact CG1-CG1 4.32Å; V13-V263 HydrophobicContact CG1-CG2 4.34Å
14I77.4Confident79Confident2 Ų255.9 Ų55.91%0.0131%0.31CS..Hα-helixtrans-60.1-47.5176.9-71.9172.4000110.9I10 V12 D17 L18 P168 Y169 I262 M266I10-I14 HydrophobicContact CG2-CD1 3.51Å; I10-I14 HydrophobicContact CG2-CG1 4.24Å; I10-I14 WeakPolarHBondContact O-CB 3.28Å; I10-I14 WeakPolarHBondContact O-CG1 3.34Å; I10-I14 PolarHBondContact O-N 2.85Å; V12-I14 VanDerWaalsContact C-N 3.32Å; V12-I14 PolarHBondContact O-N 3.32Å; I14-D17 WeakPolarHBondContact O-CB 3.45Å; I14-D17 PolarHBondContact O-N 3.32Å; I14-L18 HydrophobicContact CG2-CD1 3.86Å; I14-L18 WeakPolarHBondContact O-CD1 3.37Å; I14-L18 PolarHBondContact O-N 3.38Å; I14-P168 HydrophobicContact CD1-CB 4.43Å; I14-P168 HydrophobicContact CD1-CG 4.27Å; I14-Y169 HydrophobicContact CG2-CD1 4.11Å; I14-Y169 HydrophobicContact CG2-CD2 4.45Å; I14-Y169 HydrophobicContact CG2-CG 3.9Å; I14-I262 HydrophobicContact CD1-CG2 4.13Å; I14-M266 HydrophobicContact CD1-CG 4.02Å; I14-M266 HydrophobicContact CG1-CB 4.44Å; I14-M266 HydrophobicContact CG1-CG 4.11Å; I14-M266 HydrophobicContact CG2-CB 4.49Å; I14-M266 HydrophobicContact CG2-CE 3.32Å; I14-M266 HydrophobicContact CG2-CG 4.18Å
15F79.7Confident79.6Confident24 Ų2453.1 Ų53.111%0.10529%0.286CS..Hα-helixtrans-63-46.4-179.6-177.2-85.7000111.7S11 V12 V13 D17 L18 S19 L22 R83 C89 Y169S11-F15 WeakPolarHBondContact O-CB 3.36Å; S11-F15 PolarHBondContact O-N 3.33Å; V12-F15 PolarHBondContact O-N 2.97Å; V13-F15 PolarHBondContact O-N 2.92Å; F15-D17 PolarHBondContact O-N 3.5Å; F15-L18 CarbonylContact O-C 3.6Å; F15-L18 PolarHBondContact O-N 3Å; F15-L18 VanDerWaalsContact O-N 3.09Å; F15-S19 WeakPolarHBondContact O-CA 3.46Å; F15-S19 WeakPolarHBondContact O-CB 3.46Å; F15-S19 PolarHBondContact O-N 3.45Å; F15-L22 HydrophobicContact CE2-CD2 4.16Å; F15-L22 HydrophobicContact CZ-CD2 4.44Å; F15-R83 HydrophobicContact CD1-CB 4.42Å; F15-R83 HydrophobicContact CD1-CG 3.75Å; F15-R83 HydrophobicContact CD2-CB 4.29Å; F15-R83 HydrophobicContact CD2-CG 4.45Å; F15-R83 HydrophobicContact CE1-CB 4.22Å; F15-R83 HydrophobicContact CE1-CG 3.71Å; F15-R83 HydrophobicContact CE2-CB 4.07Å; F15-R83 HydrophobicContact CE2-CG 4.41Å; F15-R83 HydrophobicContact CG-CB 4.46Å; F15-R83 HydrophobicContact CG-CG 4.14Å; F15-R83 HydrophobicContact CZ-CB 4.03Å; F15-R83 HydrophobicContact CZ-CG 4.05Å; F15-C89 VanDerWaalsContact CD2-SG 3.51Å; F15-Y169 HydrophobicContact CD2-CE2 4.06Å
16D80.5Confident80.2Confident84 Ų8450.1 Ų50.145%0.44927%0.271SS..Hα-helixtrans-61.7-37.9-179.5-71.2-10.7000110.3V12 V13 S19 R83V12-D16 WeakPolarHBondContact O-CB 3.41Å; V12-D16 PolarHBondContact O-N 2.89Å; V13-D16 PolarHBondContact O-N 2.91Å; D16-S19 PolarHBondContact O-N 3.32Å; D16-S19 PolarHBondContact O-OG 3.1Å; D16-R83 IonicContact OD1-NH2 2.97Å
17D78.8Confident80.6Confident55 Ų5548.6 Ų48.629%0.29427%0.267SS..Hα-helixtrans-64.3-39.4173-104.3-38.9000113.8V13 I14 F15 K270V13-D17 WeakPolarHBondContact O-CB 3.4Å; V13-D17 PolarHBondContact O-N 3.43Å; I14-D17 WeakPolarHBondContact O-CB 3.45Å; I14-D17 PolarHBondContact O-N 3.32Å; F15-D17 PolarHBondContact O-N 3.5Å; D17-K270 WeakPolarHBondContact O-CE 3.37Å; D17-K270 PolarHBondContact O-NZ 3.23Å; D17-K270 IonicContact OD1-NZ 3.26Å; D17-K270 PolarHBondContact OD1-NZ 3.38Å
18L78.1Confident81.1Confident20 Ų2048.5 Ų48.511%0.10527%0.266CS..Hα-helixtrans-85.6-13.1179.8-85.884.3000113.2I14 F15 A20 I21 L22 Y169 M266I14-L18 HydrophobicContact CG2-CD1 3.86Å; I14-L18 WeakPolarHBondContact O-CD1 3.37Å; I14-L18 PolarHBondContact O-N 3.38Å; F15-L18 CarbonylContact O-C 3.6Å; F15-L18 PolarHBondContact O-N 3Å; F15-L18 VanDerWaalsContact O-N 3.09Å; L18-A20 PolarHBondContact O-N 2.94Å; L18-I21 WeakPolarHBondContact O-CA 3.27Å; L18-I21 VanDerWaalsContact O-CB 3.28Å; L18-I21 WeakPolarHBondContact O-CB 3.48Å; L18-I21 PolarHBondContact O-N 3.38Å; L18-L22 PolarHBondContact O-N 3.3Å; L18-Y169 HydrophobicContact CD2-CD1 4.43Å; L18-Y169 HydrophobicContact CD2-CE1 3.74Å; L18-M266 HydrophobicContact CD1-CB 4.34Å; L18-M266 HydrophobicContact CD1-CE 3.86Å; L18-M266 HydrophobicContact CD2-CE 4.02Å
19S78.8Confident81.5Confident31 Ų3145.7 Ų45.722%0.21725%0.253CS..Hα-helixtrans-57.7-48.3-172.565.70000112.5F15 D16 I21 L22 Y23F15-S19 WeakPolarHBondContact O-CA 3.46Å; F15-S19 WeakPolarHBondContact O-CB 3.46Å; F15-S19 PolarHBondContact O-N 3.45Å; D16-S19 PolarHBondContact O-N 3.32Å; D16-S19 PolarHBondContact O-OG 3.1Å; S19-I21 PolarHBondContact O-N 2.87Å; S19-L22 WeakPolarHBondContact O-CB 3.36Å; S19-L22 PolarHBondContact O-N 3.18Å; S19-L22 VanDerWaalsContact O-N 3.14Å; S19-Y23 WeakPolarHBondContact O-CD2 3.43Å; S19-Y23 PolarHBondContact O-N 3.02Å
20A78.5Confident82Confident73 Ų7343.6 Ų43.660%0.60325%0.248SC*.Hα-helixtrans-57.2-33.4177.500000112.5L18L18-A20 PolarHBondContact O-N 2.94Å
21I79.2Confident82.6Confident31 Ų3145.2 Ų45.216%0.15926%0.259CS..Hα-helixtrans-78.2-43.2179.6-78.4163.8000111.1L18 S19 Y23 A24 V25 K270 I273L18-I21 WeakPolarHBondContact O-CA 3.27Å; L18-I21 VanDerWaalsContact O-CB 3.28Å; L18-I21 WeakPolarHBondContact O-CB 3.48Å; L18-I21 PolarHBondContact O-N 3.38Å; S19-I21 PolarHBondContact O-N 2.87Å; I21-Y23 PolarHBondContact O-N 3.1Å; I21-A24 CarbonylContact O-C 3.47Å; I21-A24 WeakPolarHBondContact O-CA 3.34Å; I21-A24 WeakPolarHBondContact O-CB 3.42Å; I21-A24 PolarHBondContact O-N 3.02Å; I21-V25 HydrophobicContact CG2-CG2 4.02Å; I21-V25 VanDerWaalsContact O-CG2 3.32Å; I21-V25 WeakPolarHBondContact O-CG2 3.43Å; I21-V25 PolarHBondContact O-N 3.5Å; I21-K270 HydrophobicContact CD1-CB 3.2Å; I21-K270 HydrophobicContact CD1-CD 3.4Å; I21-K270 HydrophobicContact CD1-CG 3.14Å; I21-I273 HydrophobicContact CB-CD1 3.74Å; I21-I273 HydrophobicContact CD1-CD1 3.89Å; I21-I273 HydrophobicContact CG1-CD1 3.47Å; I21-I273 VanDerWaalsContact CG1-CD1 3.47Å; I21-I273 HydrophobicContact CG2-CD1 3.14Å; I21-I273 HydrophobicContact CG2-CG1 3.45Å; I21-I273 VanDerWaalsContact CG2-CG1 3.45Å
22L79.3Confident83.2Confident12 Ų1245.2 Ų45.26%0.06326%0.259CS..Hα-helixtrans-56.3-43176.6-143.170.8000109.9F15 L18 S19 A24 V25 F26 C80F15-L22 HydrophobicContact CE2-CD2 4.16Å; F15-L22 HydrophobicContact CZ-CD2 4.44Å; L18-L22 PolarHBondContact O-N 3.3Å; S19-L22 WeakPolarHBondContact O-CB 3.36Å; S19-L22 PolarHBondContact O-N 3.18Å; S19-L22 VanDerWaalsContact O-N 3.14Å; L22-A24 VanDerWaalsContact C-N 3.25Å; L22-A24 PolarHBondContact O-N 3.4Å; L22-V25 PolarHBondContact O-N 3.07Å; L22-F26 HydrophobicContact CD2-CE2 3.97Å; L22-F26 HydrophobicContact CG-CD2 4.1Å; L22-F26 HydrophobicContact CG-CE2 3.75Å; L22-F26 WeakPolarHBondContact O-CD2 3.29Å; L22-F26 PolarHBondContact O-N 3.19Å; L22-C80 WeakPolarHBondContact CD2-SG 3.2Å
23Y80.2Confident83.8Confident182 Ų18244.5 Ų44.571%0.71426%0.256SS*.Hα-helixtrans-61.2-28174.5-75.9-62.7000114.4S19 I21 P27S19-Y23 WeakPolarHBondContact O-CD2 3.43Å; S19-Y23 PolarHBondContact O-N 3.02Å; I21-Y23 PolarHBondContact O-N 3.1Å; Y23-P27 WeakPolarHBondContact O-CD 3.34Å; Y23-P27 WeakPolarHBondContact O-CG 3.34Å
24A82.1Confident84.4Confident46 Ų4645 Ų4538%0.3826%0.262SS..Hα-helixtrans-84.6-36.6173.800000112.4I21 L22 P27 I28I21-A24 CarbonylContact O-C 3.47Å; I21-A24 WeakPolarHBondContact O-CA 3.34Å; I21-A24 WeakPolarHBondContact O-CB 3.42Å; I21-A24 PolarHBondContact O-N 3.02Å; L22-A24 VanDerWaalsContact C-N 3.25Å; L22-A24 PolarHBondContact O-N 3.4Å; A24-P27 VanDerWaalsContact O-CD 3.31Å; A24-P27 WeakPolarHBondContact O-CD 3.25Å; A24-P27 WeakPolarHBondContact O-CG 3.41Å; A24-I28 VanDerWaalsContact O-CD1 3.29Å; A24-I28 WeakPolarHBondContact O-CD1 3.47Å; A24-I28 VanDerWaalsContact O-CG1 3.24Å; A24-I28 WeakPolarHBondContact O-CG1 3.48Å
25V84.5Confident85Confident10 Ų1047.8 Ų47.86%0.06128%0.276CS..Hα-helixtrans-67.6-44.9-179.6168.30000111.2I21 L22 I28 D29 I273 V276I21-V25 HydrophobicContact CG2-CG2 4.02Å; I21-V25 VanDerWaalsContact O-CG2 3.32Å; I21-V25 WeakPolarHBondContact O-CG2 3.43Å; I21-V25 PolarHBondContact O-N 3.5Å; L22-V25 PolarHBondContact O-N 3.07Å; V25-I28 PolarHBondContact O-N 3.29Å; V25-I28 VanDerWaalsContact O-N 3.13Å; V25-D29 WeakPolarHBondContact CG1-OD2 3.49Å; V25-D29 PolarHBondContact O-N 3.13Å; V25-I273 HydrophobicContact CG2-CB 4.39Å; V25-I273 HydrophobicContact CG2-CD1 4.47Å; V25-I273 HydrophobicContact CG2-CG1 3.77Å; V25-I273 HydrophobicContact CG2-CG2 3.96Å; V25-V276 HydrophobicContact CG1-CG1 4.37Å; V25-V276 HydrophobicContact CG1-CG2 4.47Å
26F85.6Confident85.6Confident55 Ų5546.7 Ų46.724%0.24127%0.271CS..Hα-helixtrans-50.3-55.7179.7-93.9-69.2000114.5L22 I28 D29 A30 I73L22-F26 HydrophobicContact CD2-CE2 3.97Å; L22-F26 HydrophobicContact CG-CD2 4.1Å; L22-F26 HydrophobicContact CG-CE2 3.75Å; L22-F26 WeakPolarHBondContact O-CD2 3.29Å; L22-F26 PolarHBondContact O-N 3.19Å; F26-I28 VanDerWaalsContact C-N 3.32Å; F26-I28 PolarHBondContact O-N 2.92Å; F26-D29 PolarHBondContact O-N 3.36Å; F26-A30 WeakPolarHBondContact O-CB 3.28Å; F26-A30 PolarHBondContact O-N 3.18Å; F26-I73 HydrophobicContact CD1-CG2 4.37Å; F26-I73 HydrophobicContact CE1-CG2 4.07Å
27P88.3Confident86.3Confident68 Ų6847.5 Ų47.544%0.44227%0.271SS..Hα-helixtrans-66.3-35.3179.724.7-33.5000112Y23 A24 A30 V31Y23-P27 WeakPolarHBondContact O-CD 3.34Å; Y23-P27 WeakPolarHBondContact O-CG 3.34Å; A24-P27 VanDerWaalsContact O-CD 3.31Å; A24-P27 WeakPolarHBondContact O-CD 3.25Å; A24-P27 WeakPolarHBondContact O-CG 3.41Å; P27-A30 PolarHBondContact O-N 2.88Å; P27-V31 WeakPolarHBondContact O-CB 3.14Å; P27-V31 VanDerWaalsContact O-CG2 3.23Å; P27-V31 WeakPolarHBondContact O-CG2 3.42Å; P27-V31 PolarHBondContact O-N 3.39Å
28I88.7Confident86.9Confident39 Ų3947.8 Ų47.820%0.227%0.274CS..Hα-helixtrans-63.5-49.4177.5-66.5170000110.2A24 V25 F26 V31 T32 V276 I277 L280A24-I28 VanDerWaalsContact O-CD1 3.29Å; A24-I28 WeakPolarHBondContact O-CD1 3.47Å; A24-I28 VanDerWaalsContact O-CG1 3.24Å; A24-I28 WeakPolarHBondContact O-CG1 3.48Å; V25-I28 PolarHBondContact O-N 3.29Å; V25-I28 VanDerWaalsContact O-N 3.13Å; F26-I28 VanDerWaalsContact C-N 3.32Å; F26-I28 PolarHBondContact O-N 2.92Å; I28-V31 PolarHBondContact O-N 3.43Å; I28-T32 WeakPolarHBondContact O-CB 3.32Å; I28-T32 PolarHBondContact O-N 3.36Å; I28-T32 PolarHBondContact O-OG1 2.83Å; I28-V276 HydrophobicContact CG2-CG1 3.96Å; I28-I277 HydrophobicContact CD1-CG1 4.32Å; I28-L280 HydrophobicContact CG2-CB 4.26Å; I28-L280 HydrophobicContact CG2-CD2 4.14Å
29D89.2Confident87.4Confident5 Ų546.9 Ų46.93%0.02727%0.27CS..Hα-helixtrans-66.6-38.3178.1-82-36.5000111.8V25 F26 T32 A33 S72 I73 V276V25-D29 WeakPolarHBondContact CG1-OD2 3.49Å; V25-D29 PolarHBondContact O-N 3.13Å; F26-D29 PolarHBondContact O-N 3.36Å; D29-T32 PolarHBondContact O-N 3.46Å; D29-A33 VanDerWaalsContact O-CB 3.24Å; D29-A33 WeakPolarHBondContact O-CB 3.39Å; D29-A33 PolarHBondContact O-N 2.93Å; D29-S72 WeakPolarHBondContact OD2-CB 3.39Å; D29-S72 PolarHBondContact OD2-OG 3.39Å; D29-I73 HydrophobicContact CB-CD1 3.92Å; D29-I73 HydrophobicContact CB-CG1 3.6Å; D29-V276 WeakPolarHBondContact OD1-CG1 3.46Å
30A91.5Very high88Confident42 Ų4247.7 Ų47.735%0.34727%0.269SS..Hα-helixtrans-63.2-43.8177.500000111.5F26 P27 C34 I73F26-A30 WeakPolarHBondContact O-CB 3.28Å; F26-A30 PolarHBondContact O-N 3.18Å; P27-A30 PolarHBondContact O-N 2.88Å; A30-C34 WeakPolarHBondContact O-CB 3.23Å; A30-C34 PolarHBondContact O-N 3.37Å; A30-C34 PolarHBondContact O-SG 3.37Å; A30-I73 HydrophobicContact CB-CD1 4.47Å
31V92.8Very high88.6Confident75 Ų7546.5 Ų46.546%0.45525%0.254SS..Hα-helixtrans-65.7-42.6175174.10000110.4P27 I28 C34 M35 L280P27-V31 WeakPolarHBondContact O-CB 3.14Å; P27-V31 VanDerWaalsContact O-CG2 3.23Å; P27-V31 WeakPolarHBondContact O-CG2 3.42Å; P27-V31 PolarHBondContact O-N 3.39Å; I28-V31 PolarHBondContact O-N 3.43Å; V31-C34 PolarHBondContact O-N 3.47Å; V31-M35 HydrophobicContact CG1-CG 4.21Å; V31-M35 WeakPolarHBondContact O-CB 3.44Å; V31-M35 VanDerWaalsContact O-CG 3.28Å; V31-M35 WeakPolarHBondContact O-CG 3.21Å; V31-M35 PolarHBondContact O-N 3.19Å; V31-L280 HydrophobicContact CB-CD1 4.35Å; V31-L280 HydrophobicContact CG1-CD1 3.69Å
32T91.4Very high89.1Confident0 Ų045.1 Ų45.10%025%0.248CC..Hα-helixtrans-62.3-47178.4-55.20000111.2I28 D29 M35 T36 S69 L280I28-T32 WeakPolarHBondContact O-CB 3.32Å; I28-T32 PolarHBondContact O-N 3.36Å; I28-T32 PolarHBondContact O-OG1 2.83Å; D29-T32 PolarHBondContact O-N 3.46Å; T32-M35 PolarHBondContact O-N 2.87Å; T32-T36 HydrophobicContact CG2-CG2 4.19Å; T32-T36 WeakPolarHBondContact O-CB 3.24Å; T32-T36 VanDerWaalsContact O-CG2 3.25Å; T32-T36 WeakPolarHBondContact O-CG2 3.43Å; T32-T36 PolarHBondContact O-N 3.42Å; T32-T36 PolarHBondContact O-OG1 3.27Å; T32-S69 VanDerWaalsContact CG2-OG 3.26Å; T32-S69 WeakPolarHBondContact CG2-OG 3.25Å; T32-L280 WeakPolarHBondContact OG1-CA 3.18Å; T32-L280 VanDerWaalsContact OG1-CB 3.32Å; T32-L280 WeakPolarHBondContact OG1-CB 3.35Å; T32-L280 PolarHBondContact OG1-N 3.19Å
33A93.5Very high89.5Confident10 Ų1044.6 Ų44.68%0.08325%0.245CC..Hα-helixtrans-60-46.6176.200000111.1D29 T36 F37 F66 I73D29-A33 VanDerWaalsContact O-CB 3.24Å; D29-A33 WeakPolarHBondContact O-CB 3.39Å; D29-A33 PolarHBondContact O-N 2.93Å; A33-T36 PolarHBondContact O-OG1 3.25Å; A33-F37 WeakPolarHBondContact O-CB 3.17Å; A33-F37 PolarHBondContact O-N 2.87Å; A33-F66 HydrophobicContact CB-CD2 4.41Å; A33-I73 HydrophobicContact CB-CD1 4.34Å
34C93.8Very high89.9Confident82 Ų8239.3 Ų39.355%0.55423%0.231SC*.Hα-helixtrans-61-48.6177.1-70.90000112.2A30 V31 F37 V38A30-C34 WeakPolarHBondContact O-CB 3.23Å; A30-C34 PolarHBondContact O-N 3.37Å; A30-C34 PolarHBondContact O-SG 3.37Å; V31-C34 PolarHBondContact O-N 3.47Å; C34-F37 PolarHBondContact O-N 3.43Å; C34-V38 VanDerWaalsContact O-CG2 3.31Å; C34-V38 WeakPolarHBondContact O-CG2 3.32Å; C34-V38 PolarHBondContact O-N 3.07Å
35M91.5Very high90Very high59 Ų5941 Ų4129%0.29123%0.234SC..Hα-helixtrans-62.5-51-179-76.6-71.7-66.400111.4V31 T32 F37 V38 E39 A283V31-M35 HydrophobicContact CG1-CG 4.21Å; V31-M35 WeakPolarHBondContact O-CB 3.44Å; V31-M35 VanDerWaalsContact O-CG 3.28Å; V31-M35 WeakPolarHBondContact O-CG 3.21Å; V31-M35 PolarHBondContact O-N 3.19Å; T32-M35 PolarHBondContact O-N 2.87Å; M35-F37 VanDerWaalsContact C-N 3.32Å; M35-F37 PolarHBondContact O-N 2.9Å; M35-V38 PolarHBondContact O-N 3.07Å; M35-E39 WeakPolarHBondContact O-CG 3.46Å; M35-E39 PolarHBondContact O-N 2.95Å; M35-A283 HydrophobicContact CB-CB 4.4Å
36T92.4Very high90Very high1 Ų141.6 Ų41.61%0.00624%0.237CC..Hα-helixtrans-65.4-35.8-179.854.30000111.8T32 A33 E39 F40 I62 F66 A283T32-T36 HydrophobicContact CG2-CG2 4.19Å; T32-T36 WeakPolarHBondContact O-CB 3.24Å; T32-T36 VanDerWaalsContact O-CG2 3.25Å; T32-T36 WeakPolarHBondContact O-CG2 3.43Å; T32-T36 PolarHBondContact O-N 3.42Å; T32-T36 PolarHBondContact O-OG1 3.27Å; A33-T36 PolarHBondContact O-OG1 3.25Å; T36-E39 PolarHBondContact O-N 2.77Å; T36-F40 WeakPolarHBondContact O-CB 3.31Å; T36-F40 PolarHBondContact O-N 2.85Å; T36-I62 HydrophobicContact CG2-CG2 4.44Å; T36-I62 WeakPolarHBondContact O-CG2 3.26Å; T36-F66 WeakPolarHBondContact OG1-CA 3.4Å; T36-F66 WeakPolarHBondContact OG1-CB 3.32Å; T36-A283 HydrophobicContact CG2-CB 3.91Å
37F93.5Very high89.7Confident101 Ų10145.6 Ų45.644%0.44326%0.256SS..Hα-helixtrans-63.6-47.8173.5-177.7-104.6000112.1A33 C34 M35 E39 F40 V41 F66A33-F37 WeakPolarHBondContact O-CB 3.17Å; A33-F37 PolarHBondContact O-N 2.87Å; C34-F37 PolarHBondContact O-N 3.43Å; M35-F37 VanDerWaalsContact C-N 3.32Å; M35-F37 PolarHBondContact O-N 2.9Å; F37-E39 VanDerWaalsContact C-N 3.33Å; F37-E39 PolarHBondContact O-N 3.45Å; F37-F40 PolarHBondContact O-N 2.92Å; F37-V41 HydrophobicContact CD1-CG2 4.28Å; F37-V41 HydrophobicContact CD2-CG2 4.29Å; F37-V41 HydrophobicContact CE1-CG2 3.9Å; F37-V41 HydrophobicContact CE2-CG2 3.91Å; F37-V41 HydrophobicContact CG-CG2 4.46Å; F37-V41 HydrophobicContact CZ-CG2 3.7Å; F37-V41 WeakPolarHBondContact O-CB 3.39Å; F37-V41 VanDerWaalsContact O-CG2 3.31Å; F37-V41 WeakPolarHBondContact O-CG2 3.23Å; F37-V41 PolarHBondContact O-N 2.91Å; F37-F66 HydrophobicContact CB-CD2 3.87Å; F37-F66 HydrophobicContact CB-CE2 3.9Å; F37-F66 HydrophobicContact CD2-CD2 4.33Å; F37-F66 AromaticContact CD2-CE2 3.84Å; F37-F66 HydrophobicContact CD2-CE2 3.84Å; F37-F66 HydrophobicContact CD2-CZ 4.02Å; F37-F66 HydrophobicContact CG-CE2 4.22Å
38V91.3Very high89.2Confident61 Ų6150.5 Ų50.537%0.3727%0.266SS..Hα-helixtrans-61.2-43.5177.6170.20000110.9C34 M35 A42 V297C34-V38 VanDerWaalsContact O-CG2 3.31Å; C34-V38 WeakPolarHBondContact O-CG2 3.32Å; C34-V38 PolarHBondContact O-N 3.07Å; M35-V38 PolarHBondContact O-N 3.07Å; V38-A42 WeakPolarHBondContact O-CB 3.27Å; V38-A42 PolarHBondContact O-N 3.36Å; V38-V297 HydrophobicContact CG1-CG1 4.05Å; V38-V297 HydrophobicContact CG1-CG2 4.42Å
39E88.5Confident88.3Confident2 Ų248.8 Ų48.81%0.00926%0.258CS..Hα-helixtrans-63.6-43.7176.2-72.7175.3-161.800112.4M35 T36 F37 A42 L43 I62 F287 I293 V297M35-E39 WeakPolarHBondContact O-CG 3.46Å; M35-E39 PolarHBondContact O-N 2.95Å; T36-E39 PolarHBondContact O-N 2.77Å; F37-E39 VanDerWaalsContact C-N 3.33Å; F37-E39 PolarHBondContact O-N 3.45Å; E39-A42 PolarHBondContact O-N 3.4Å; E39-L43 WeakPolarHBondContact O-CB 2.99Å; E39-L43 WeakPolarHBondContact O-CG 3.46Å; E39-L43 PolarHBondContact O-N 2.93Å; E39-I62 HydrophobicContact CB-CD1 4.31Å; E39-I62 HydrophobicContact CB-CG2 4.02Å; E39-F287 HydrophobicContact CG-CD2 4.46Å; E39-F287 WeakPolarHBondContact OE1-CB 3.42Å; E39-I293 HydrophobicContact CB-CG2 4.44Å; E39-I293 HydrophobicContact CG-CG2 3.94Å; E39-V297 HydrophobicContact CG-CG2 4.47Å
40F92.4Very high87.6Confident48 Ų4850.6 Ų50.621%0.21127%0.27CS..Hα-helixtrans-60.2-54177.2174.5-101000111T36 F37 A42 L43 V44 I59 I62 F63T36-F40 WeakPolarHBondContact O-CB 3.31Å; T36-F40 PolarHBondContact O-N 2.85Å; F37-F40 PolarHBondContact O-N 2.92Å; F40-A42 VanDerWaalsContact C-N 3.27Å; F40-A42 PolarHBondContact O-N 3.32Å; F40-L43 PolarHBondContact O-N 3.41Å; F40-V44 HydrophobicContact CD1-CG2 4.43Å; F40-V44 HydrophobicContact CD2-CG2 4.14Å; F40-V44 HydrophobicContact CE1-CG2 4.11Å; F40-V44 HydrophobicContact CE2-CG2 3.8Å; F40-V44 HydrophobicContact CG-CG2 4.45Å; F40-V44 HydrophobicContact CZ-CG2 3.78Å; F40-V44 WeakPolarHBondContact O-CB 3.19Å; F40-V44 WeakPolarHBondContact O-CG2 3.32Å; F40-V44 PolarHBondContact O-N 2.94Å; F40-I59 HydrophobicContact CD2-CG2 3.74Å; F40-I59 HydrophobicContact CE2-CG2 3.5Å; F40-I59 VanDerWaalsContact CE2-CG2 3.5Å; F40-I62 HydrophobicContact CB-CG2 4.01Å; F40-F63 HydrophobicContact CD2-CB 3.82Å; F40-F63 HydrophobicContact CD2-CD2 4.08Å; F40-F63 HydrophobicContact CD2-CG 4.34Å; F40-F63 HydrophobicContact CE1-CD2 4.25Å; F40-F63 HydrophobicContact CE2-CB 3.77Å; F40-F63 AromaticContact CE2-CD2 3.75Å; F40-F63 HydrophobicContact CE2-CD2 3.75Å; F40-F63 AromaticContact CE2-CG 3.96Å; F40-F63 HydrophobicContact CE2-CG 3.96Å; F40-F63 HydrophobicContact CG-CD2 4.46Å; F40-F63 AromaticContact CZ-CD2 3.85Å; F40-F63 HydrophobicContact CZ-CD2 3.85Å; F40-F63 HydrophobicContact CZ-CE2 4.36Å; F40-F63 HydrophobicContact CZ-CG 4.42Å
41V91.2Very high86.8Confident48 Ų4854.3 Ų54.329%0.29128%0.284SS..Hα-helixtrans-59.7-40.4178.9173.50000110.8F37 N45 L300F37-V41 HydrophobicContact CD1-CG2 4.28Å; F37-V41 HydrophobicContact CD2-CG2 4.29Å; F37-V41 HydrophobicContact CE1-CG2 3.9Å; F37-V41 HydrophobicContact CE2-CG2 3.91Å; F37-V41 HydrophobicContact CG-CG2 4.46Å; F37-V41 HydrophobicContact CZ-CG2 3.7Å; F37-V41 WeakPolarHBondContact O-CB 3.39Å; F37-V41 VanDerWaalsContact O-CG2 3.31Å; F37-V41 WeakPolarHBondContact O-CG2 3.23Å; F37-V41 PolarHBondContact O-N 2.91Å; V41-N45 VanDerWaalsContact O-CB 3.24Å; V41-N45 WeakPolarHBondContact O-CB 3.48Å; V41-N45 PolarHBondContact O-N 2.89Å; V41-L300 HydrophobicContact CB-CD2 4.31Å; V41-L300 HydrophobicContact CG1-CD1 4.1Å; V41-L300 HydrophobicContact CG1-CD2 3.86Å
42A88.8Confident86.1Confident2 Ų255.6 Ų55.62%0.01728%0.28CS..Hα-helixtrans-63.1-43.517800000112.6V38 E39 F40 D46 A296 V297 L300V38-A42 WeakPolarHBondContact O-CB 3.27Å; V38-A42 PolarHBondContact O-N 3.36Å; E39-A42 PolarHBondContact O-N 3.4Å; F40-A42 VanDerWaalsContact C-N 3.27Å; F40-A42 PolarHBondContact O-N 3.32Å; A42-D46 PolarHBondContact O-N 3.22Å; A42-A296 HydrophobicContact CB-CB 4.15Å; A42-V297 HydrophobicContact CB-CB 4.26Å; A42-V297 HydrophobicContact CB-CG2 3.58Å; A42-L300 HydrophobicContact CB-CB 4.25Å; A42-L300 HydrophobicContact CB-CD2 3.99Å
43L87.6Confident85.5Confident1 Ų157.7 Ų57.71%0.00529%0.289CS..Hα-helixtrans-72.3-41.7-179.8-74.9172.3000112.5E39 F40 N45 D46 A49 F55 I58 I59 I62 I293 A296E39-L43 WeakPolarHBondContact O-CB 2.99Å; E39-L43 WeakPolarHBondContact O-CG 3.46Å; E39-L43 PolarHBondContact O-N 2.93Å; F40-L43 PolarHBondContact O-N 3.41Å; L43-N45 VanDerWaalsContact C-N 3.3Å; L43-N45 PolarHBondContact O-N 2.74Å; L43-D46 PolarHBondContact O-N 3.34Å; L43-D46 VanDerWaalsContact O-N 3.12Å; L43-A49 HydrophobicContact CD2-CB 4.23Å; L43-F55 HydrophobicContact CD2-CD1 4.14Å; L43-F55 HydrophobicContact CD2-CE1 4.37Å; L43-I58 HydrophobicContact CD1-CG2 4.3Å; L43-I59 HydrophobicContact CB-CD1 4.07Å; L43-I59 HydrophobicContact CB-CG1 3.72Å; L43-I59 HydrophobicContact CD1-CG1 4.08Å; L43-I62 HydrophobicContact CD1-CD1 3.4Å; L43-I293 HydrophobicContact CD1-CG1 4.26Å; L43-I293 HydrophobicContact CD2-CG1 4.2Å; L43-A296 HydrophobicContact CD2-CB 4.34Å
44V89Confident84.8Confident71 Ų7158 Ų5843%0.4329%0.291SS..Hα-helixtrans-63-39177.9171.40000111.1F40 D46 C50 I59F40-V44 HydrophobicContact CD1-CG2 4.43Å; F40-V44 HydrophobicContact CD2-CG2 4.14Å; F40-V44 HydrophobicContact CE1-CG2 4.11Å; F40-V44 HydrophobicContact CE2-CG2 3.8Å; F40-V44 HydrophobicContact CG-CG2 4.45Å; F40-V44 HydrophobicContact CZ-CG2 3.78Å; F40-V44 WeakPolarHBondContact O-CB 3.19Å; F40-V44 WeakPolarHBondContact O-CG2 3.32Å; F40-V44 PolarHBondContact O-N 2.94Å; V44-D46 VanDerWaalsContact C-N 3.26Å; V44-D46 PolarHBondContact O-N 2.94Å; V44-C50 PolarHBondContact O-SG 3.43Å; V44-I59 HydrophobicContact CG2-CG2 3.93Å
45N85.6Confident84.3Confident80 Ų8054.2 Ų54.243%0.42827%0.265SS..THydrogen-bonded Turntrans-75.5-12.3177.6-163.18.6000113.2V41 L43 H47 L300V41-N45 VanDerWaalsContact O-CB 3.24Å; V41-N45 WeakPolarHBondContact O-CB 3.48Å; V41-N45 PolarHBondContact O-N 2.89Å; L43-N45 VanDerWaalsContact C-N 3.3Å; L43-N45 PolarHBondContact O-N 2.74Å; N45-H47 PolarHBondContact O-N 3.45Å; N45-L300 WeakPolarHBondContact ND2-CD1 3.4Å
46D84.4Confident84.1Confident24 Ų2453.5 Ų53.513%0.12826%0.262CS..  trans-88.495.2172.5-165-9.6000110.4A42 L43 V44 R48 A49 C50 A296 R299A42-D46 PolarHBondContact O-N 3.22Å; L43-D46 PolarHBondContact O-N 3.34Å; L43-D46 VanDerWaalsContact O-N 3.12Å; V44-D46 VanDerWaalsContact C-N 3.26Å; V44-D46 PolarHBondContact O-N 2.94Å; D46-R48 PolarHBondContact O-N 3.42Å; D46-R48 WeakPolarHBondContact OD1-CB 3.32Å; D46-R48 PolarHBondContact OD1-N 3.38Å; D46-R48 VanDerWaalsContact OD1-N 3.17Å; D46-A49 HydrophobicContact CB-CB 4Å; D46-A49 WeakPolarHBondContact O-CB 3.43Å; D46-A49 PolarHBondContact O-N 2.9Å; D46-C50 PolarHBondContact O-N 3.37Å; D46-C50 VanDerWaalsContact O-N 3.12Å; D46-A296 HydrophobicContact CB-CB 4.37Å; D46-R299 VanDerWaalsContact CG-NH1 3.28Å; D46-R299 IonicContact OD1-NH1 3.69Å; D46-R299 PolarHBondContact OD1-NH1 3.35Å; D46-R299 IonicContact OD2-CZ 3.61Å; D46-R299 IonicContact OD2-NH1 3.45Å; D46-R299 PolarHBondContact OD2-NH1 2.91Å; D46-R299 IonicContact OD2-NH2 2.62Å
47H77.7Confident83.9Confident138 Ų13853.5 Ų53.564%0.63926%0.262SS*.Hα-helixtrans-53.3-30.5178.2-166.4-67.4000112.8N45 L51N45-H47 PolarHBondContact O-N 3.45Å; H47-L51 WeakPolarHBondContact ND1-CD1 3.4Å; H47-L51 WeakPolarHBondContact O-CD1 3.32Å; H47-L51 VanDerWaalsContact O-CG 3.26Å; H47-L51 WeakPolarHBondContact O-CG 3.35Å; H47-L51 PolarHBondContact O-N 2.9Å
48R78Confident83.7Confident171 Ų17148.8 Ų48.865%0.64524%0.241SC*.Hα-helixtrans-70.6-34.4177.3-63.9-176.6-179-166.1-2.2112.3D46D46-R48 PolarHBondContact O-N 3.42Å; D46-R48 WeakPolarHBondContact OD1-CB 3.32Å; D46-R48 PolarHBondContact OD1-N 3.38Å; D46-R48 VanDerWaalsContact OD1-N 3.17Å
49A70.6Confident83.7Confident4 Ų446.7 Ų46.73%0.03323%0.228CC..Hα-helixtrans-70.4-45.7176.200000110.2L43 D46 L51 R52 F55L43-A49 HydrophobicContact CD2-CB 4.23Å; D46-A49 HydrophobicContact CB-CB 4Å; D46-A49 WeakPolarHBondContact O-CB 3.43Å; D46-A49 PolarHBondContact O-N 2.9Å; A49-L51 PolarHBondContact O-N 3.38Å; A49-R52 PolarHBondContact O-N 2.96Å; A49-F55 HydrophobicContact CB-CB 4.34Å; A49-F55 HydrophobicContact CB-CD1 4.16Å; A49-F55 HydrophobicContact CB-CG 4.23Å; A49-F55 WeakPolarHBondContact O-CB 3.42Å
50C74.9Confident83.9Confident42 Ų4247.1 Ų47.128%0.28423%0.232SC..Hα-helixtrans-61.8-26.2179.2-68.50000113.8V44 D46 R52V44-C50 PolarHBondContact O-SG 3.43Å; D46-C50 PolarHBondContact O-N 3.37Å; D46-C50 VanDerWaalsContact O-N 3.12Å; C50-R52 VanDerWaalsContact C-N 3.29Å; C50-R52 PolarHBondContact O-N 3.5Å
51L73.9Confident83.9Confident121 Ų12145 Ų4563%0.63422%0.222SC*.THydrogen-bonded Turntrans-72.1-20.9174.6-74.7166.9000113.5H47 A49H47-L51 WeakPolarHBondContact ND1-CD1 3.4Å; H47-L51 WeakPolarHBondContact O-CD1 3.32Å; H47-L51 VanDerWaalsContact O-CG 3.26Å; H47-L51 WeakPolarHBondContact O-CG 3.35Å; H47-L51 PolarHBondContact O-N 2.9Å; A49-L51 PolarHBondContact O-N 3.38Å
52R77.7Confident83.9Confident102 Ų10242.8 Ų42.839%0.38521%0.209SC..SBendtrans-95.1118.9-176.4-70.4177.7172-171.8-7.1110.3A49 C50 S54 F55 L56 E292 A342A49-R52 PolarHBondContact O-N 2.96Å; C50-R52 VanDerWaalsContact C-N 3.29Å; C50-R52 PolarHBondContact O-N 3.5Å; R52-S54 VanDerWaalsContact C-N 3.3Å; R52-S54 PolarHBondContact O-N 2.93Å; R52-S54 VanDerWaalsContact O-N 3.15Å; R52-F55 HydrophobicContact CB-CB 4.31Å; R52-F55 HydrophobicContact CB-CD2 3.71Å; R52-F55 HydrophobicContact CB-CG 4.45Å; R52-F55 HydrophobicContact CG-CD2 4.48Å; R52-F55 WeakPolarHBondContact O-CB 3.49Å; R52-F55 PolarHBondContact O-N 3.05Å; R52-L56 PolarHBondContact O-N 3.16Å; R52-E292 IonicContact NH1-OE1 2.81Å; R52-E292 PolarHBondContact NH1-OE1 3.05Å; R52-E292 IonicContact NH1-OE2 3.57Å; R52-E292 PolarHBondContact NH1-OE2 3.41Å; R52-A342 PolarHBondContact NH2-OXT 2.98Å
53K78.4Confident84.2Confident43 Ų4346 Ų4619%0.18722%0.223CC..Hα-helixtrans-48.2-46.8-177.4-58.8176.3-168.3161.80113.8F55 L56 Y135 N137 L140K53-F55 PolarHBondContact O-N 3.18Å; K53-L56 WeakPolarHBondContact O-CB 3.18Å; K53-L56 PolarHBondContact O-N 3.25Å; K53-Y135 HydrophobicContact CD-CD1 3.82Å; K53-Y135 HydrophobicContact CD-CE1 4.17Å; K53-Y135 PolarHBondContact NZ-O 2.85Å; K53-N137 VanDerWaalsContact CE-OD1 3.24Å; K53-N137 WeakPolarHBondContact CE-OD1 3.42Å; K53-L140 HydrophobicContact CB-CD2 4.1Å; K53-L140 HydrophobicContact CG-CD2 4.44Å
54S79.1Confident84.4Confident16 Ų1645.9 Ų45.911%0.11222%0.223CC..Hα-helixtrans-69.5-21.4-178.4690000114.2R52 I58 R121R52-S54 VanDerWaalsContact C-N 3.3Å; R52-S54 PolarHBondContact O-N 2.93Å; R52-S54 VanDerWaalsContact O-N 3.15Å; S54-I58 WeakPolarHBondContact O-CG1 3.33Å; S54-I58 PolarHBondContact O-N 3.41Å; S54-R121 PolarHBondContact OG-NH1 3.45Å; S54-R121 PolarHBondContact OG-NH2 2.99Å
55F84Confident84.6Confident4 Ų442.9 Ų42.92%0.01820%0.203CC..Hα-helixtrans-77.4-32.2175-86.4-83.4000111.9L43 A49 R52 K53 L57 I58 I59 E292L43-F55 HydrophobicContact CD2-CD1 4.14Å; L43-F55 HydrophobicContact CD2-CE1 4.37Å; A49-F55 HydrophobicContact CB-CB 4.34Å; A49-F55 HydrophobicContact CB-CD1 4.16Å; A49-F55 HydrophobicContact CB-CG 4.23Å; A49-F55 WeakPolarHBondContact O-CB 3.42Å; R52-F55 HydrophobicContact CB-CB 4.31Å; R52-F55 HydrophobicContact CB-CD2 3.71Å; R52-F55 HydrophobicContact CB-CG 4.45Å; R52-F55 HydrophobicContact CG-CD2 4.48Å; R52-F55 WeakPolarHBondContact O-CB 3.49Å; R52-F55 PolarHBondContact O-N 3.05Å; K53-F55 PolarHBondContact O-N 3.18Å; F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 2.87Å; F55-I58 HydrophobicContact CD1-CD1 4.35Å; F55-I58 HydrophobicContact CE1-CD1 4.4Å; F55-I58 CarbonylContact O-C 3.5Å; F55-I58 PolarHBondContact O-N 2.97Å; F55-I58 VanDerWaalsContact O-N 3.11Å; F55-I59 VanDerWaalsContact O-CG1 3.29Å; F55-I59 WeakPolarHBondContact O-CG1 3.42Å; F55-I59 PolarHBondContact O-N 2.63Å; F55-E292 HydrophobicContact CE1-CB 3.96Å; F55-E292 WeakPolarHBondContact CE2-OE2 3.31Å; F55-E292 HydrophobicContact CZ-CB 3.76Å; F55-E292 HydrophobicContact CZ-CG 4.02Å; F55-E292 WeakPolarHBondContact CZ-OE2 3.37Å
56L87.1Confident85Confident44 Ų4441.1 Ų41.123%0.2319%0.192CC..Hα-helixtrans-59.2-41.3173-68.1171.5000111.6R52 K53 I59 A60 L140 F144R52-L56 PolarHBondContact O-N 3.16Å; K53-L56 WeakPolarHBondContact O-CB 3.18Å; K53-L56 PolarHBondContact O-N 3.25Å; L56-I59 PolarHBondContact O-N 3.46Å; L56-A60 PolarHBondContact O-N 3.19Å; L56-L140 HydrophobicContact CB-CD2 4.22Å; L56-L140 HydrophobicContact CD1-CD2 3.67Å; L56-F144 HydrophobicContact CB-CE2 4.4Å
57L88.9Confident85.4Confident0 Ų041.4 Ų41.40%019%0.193CC..Hα-helixtrans-66.4-37.1174.3-70.1171.7000112.7F55 A60 L61 L116 L117 D120 L140 F144F55-L57 VanDerWaalsContact C-N 3.28Å; F55-L57 PolarHBondContact O-N 2.87Å; L57-A60 PolarHBondContact O-N 2.8Å; L57-L61 WeakPolarHBondContact O-CB 3.1Å; L57-L61 PolarHBondContact O-N 3.48Å; L57-L116 HydrophobicContact CD1-CB 4.45Å; L57-L116 HydrophobicContact CD2-CB 3.81Å; L57-L116 HydrophobicContact CD2-CD1 4.06Å; L57-L117 HydrophobicContact CB-CD1 4.46Å; L57-L117 HydrophobicContact CB-CD2 3.43Å; L57-L117 VanDerWaalsContact CB-CD2 3.43Å; L57-L117 HydrophobicContact CB-CG 3.72Å; L57-L117 HydrophobicContact CD1-CD2 4Å; L57-L117 HydrophobicContact CD1-CG 4.3Å; L57-L117 HydrophobicContact CG-CD2 4.37Å; L57-D120 HydrophobicContact CD1-CB 3.83Å; L57-L140 HydrophobicContact CD1-CD1 4.14Å; L57-L140 HydrophobicContact CD2-CD1 4.21Å; L57-L140 HydrophobicContact CG-CD1 4.04Å; L57-F144 HydrophobicContact CD2-CE1 4.33Å; L57-F144 HydrophobicContact CD2-CE2 4.17Å; L57-F144 HydrophobicContact CD2-CZ 3.76Å; L57-F144 HydrophobicContact CG-CZ 4.45Å
58I88.8Confident86.1Confident3 Ų335.8 Ų35.82%0.01517%0.17CC..Hα-helixtrans-66.6-39.6174.5-66.6166.8000110.9L43 S54 F55 A60 L61 I62 L117L43-I58 HydrophobicContact CD1-CG2 4.3Å; S54-I58 WeakPolarHBondContact O-CG1 3.33Å; S54-I58 PolarHBondContact O-N 3.41Å; F55-I58 HydrophobicContact CD1-CD1 4.35Å; F55-I58 HydrophobicContact CE1-CD1 4.4Å; F55-I58 CarbonylContact O-C 3.5Å; F55-I58 PolarHBondContact O-N 2.97Å; F55-I58 VanDerWaalsContact O-N 3.11Å; I58-A60 VanDerWaalsContact C-N 3.33Å; I58-L61 WeakPolarHBondContact O-CB 3.19Å; I58-L61 PolarHBondContact O-N 2.93Å; I58-I62 HydrophobicContact CG2-CD1 3.74Å; I58-I62 HydrophobicContact CG2-CG1 4.39Å; I58-I62 WeakPolarHBondContact O-CG1 3.41Å; I58-I62 PolarHBondContact O-N 3.45Å; I58-L117 HydrophobicContact CG1-CD1 4.42Å; I58-L117 HydrophobicContact CG1-CD2 4.08Å
59I91.3Very high86.7Confident16 Ų1627.8 Ų27.88%0.08214%0.14CC..Hα-helixtrans-60.4-45.8175.1-71.5167.2000109.9F40 L43 V44 F55 L56 L61 I62 F63F40-I59 HydrophobicContact CD2-CG2 3.74Å; F40-I59 HydrophobicContact CE2-CG2 3.5Å; F40-I59 VanDerWaalsContact CE2-CG2 3.5Å; L43-I59 HydrophobicContact CB-CD1 4.07Å; L43-I59 HydrophobicContact CB-CG1 3.72Å; L43-I59 HydrophobicContact CD1-CG1 4.08Å; V44-I59 HydrophobicContact CG2-CG2 3.93Å; F55-I59 VanDerWaalsContact O-CG1 3.29Å; F55-I59 WeakPolarHBondContact O-CG1 3.42Å; F55-I59 PolarHBondContact O-N 2.63Å; L56-I59 PolarHBondContact O-N 3.46Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 3.03Å; I59-I62 PolarHBondContact O-N 2.82Å; I59-F63 VanDerWaalsContact O-CB 3.29Å; I59-F63 WeakPolarHBondContact O-CB 3.5Å; I59-F63 PolarHBondContact O-N 3.42Å
60A92.5Very high87.8Confident12 Ų1229.5 Ų29.510%0.09915%0.151CC..Hα-helixtrans-63.3-39.2176.300000112.6L56 L57 I58 F63 G64 F144L56-A60 PolarHBondContact O-N 3.19Å; L57-A60 PolarHBondContact O-N 2.8Å; I58-A60 VanDerWaalsContact C-N 3.33Å; A60-F63 PolarHBondContact O-N 3.42Å; A60-G64 PolarHBondContact O-N 3.4Å; A60-F144 HydrophobicContact CB-CE1 3.52Å; A60-F144 HydrophobicContact CB-CZ 3.96Å
61L91.5Very high88.5Confident2 Ų227.5 Ų27.51%0.0114%0.138CC..Hα-helixtrans-60.9-49.1174.817970.3000111.6L57 I58 I59 F63 G64 Y65 V110 S113 S114 L117 L286L57-L61 WeakPolarHBondContact O-CB 3.1Å; L57-L61 PolarHBondContact O-N 3.48Å; I58-L61 WeakPolarHBondContact O-CB 3.19Å; I58-L61 PolarHBondContact O-N 2.93Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 3.03Å; L61-F63 VanDerWaalsContact C-N 3.32Å; L61-F63 PolarHBondContact O-N 3.42Å; L61-G64 PolarHBondContact O-N 2.92Å; L61-Y65 HydrophobicContact CD1-CD2 4.43Å; L61-Y65 HydrophobicContact CD1-CE2 3.74Å; L61-Y65 HydrophobicContact CD2-CE2 4.32Å; L61-Y65 HydrophobicContact CG-CD2 4.2Å; L61-Y65 HydrophobicContact CG-CE2 3.74Å; L61-Y65 VanDerWaalsContact O-CD2 3.23Å; L61-Y65 WeakPolarHBondContact O-CD2 3.49Å; L61-Y65 PolarHBondContact O-N 3.25Å; L61-Y65 VanDerWaalsContact O-N 3.08Å; L61-V110 HydrophobicContact CD1-CB 4.46Å; L61-V110 HydrophobicContact CD1-CG1 3.99Å; L61-S113 WeakPolarHBondContact CA-OG 3.45Å; L61-S113 VanDerWaalsContact CD1-OG 3.28Å; L61-S113 WeakPolarHBondContact CD1-OG 3.11Å; L61-S114 VanDerWaalsContact CD1-OG 3.31Å; L61-S114 WeakPolarHBondContact CD1-OG 3.29Å; L61-L117 HydrophobicContact CB-CD1 4.37Å; L61-L117 HydrophobicContact CD2-CD1 3.92Å; L61-L286 HydrophobicContact CD2-CD1 4.32Å
62I92.3Very high89.1Confident2 Ų222.3 Ų22.31%0.0111%0.112CC..Hα-helixtrans-64-40.8178.7-66.8164.6000110.6T36 E39 F40 L43 I58 I59 G64 Y65 F66 I293T36-I62 HydrophobicContact CG2-CG2 4.44Å; T36-I62 WeakPolarHBondContact O-CG2 3.26Å; E39-I62 HydrophobicContact CB-CD1 4.31Å; E39-I62 HydrophobicContact CB-CG2 4.02Å; F40-I62 HydrophobicContact CB-CG2 4.01Å; L43-I62 HydrophobicContact CD1-CD1 3.4Å; I58-I62 HydrophobicContact CG2-CD1 3.74Å; I58-I62 HydrophobicContact CG2-CG1 4.39Å; I58-I62 WeakPolarHBondContact O-CG1 3.41Å; I58-I62 PolarHBondContact O-N 3.45Å; I59-I62 PolarHBondContact O-N 2.82Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.3Å; I62-Y65 PolarHBondContact O-N 3.35Å; I62-F66 PolarHBondContact O-N 3.26Å; I62-I293 HydrophobicContact CD1-CD1 4.37Å
63F93.9Very high89.7Confident69 Ų6919.8 Ų19.830%0.30311%0.105SC..Hα-helixtrans-63.5-37.5175.1-173.4-113.6000112.3F40 I59 A60 L61 F66 L67 L109F40-F63 HydrophobicContact CD2-CB 3.82Å; F40-F63 HydrophobicContact CD2-CD2 4.08Å; F40-F63 HydrophobicContact CD2-CG 4.34Å; F40-F63 HydrophobicContact CE1-CD2 4.25Å; F40-F63 HydrophobicContact CE2-CB 3.77Å; F40-F63 AromaticContact CE2-CD2 3.75Å; F40-F63 HydrophobicContact CE2-CD2 3.75Å; F40-F63 AromaticContact CE2-CG 3.96Å; F40-F63 HydrophobicContact CE2-CG 3.96Å; F40-F63 HydrophobicContact CG-CD2 4.46Å; F40-F63 AromaticContact CZ-CD2 3.85Å; F40-F63 HydrophobicContact CZ-CD2 3.85Å; F40-F63 HydrophobicContact CZ-CE2 4.36Å; F40-F63 HydrophobicContact CZ-CG 4.42Å; I59-F63 VanDerWaalsContact O-CB 3.29Å; I59-F63 WeakPolarHBondContact O-CB 3.5Å; I59-F63 PolarHBondContact O-N 3.42Å; A60-F63 PolarHBondContact O-N 3.42Å; L61-F63 VanDerWaalsContact C-N 3.32Å; L61-F63 PolarHBondContact O-N 3.42Å; F63-F66 HydrophobicContact CD2-CD1 4.14Å; F63-F66 HydrophobicContact CE2-CD1 4.04Å; F63-F66 HydrophobicContact CE2-CE1 4.45Å; F63-F66 WeakPolarHBondContact O-CB 3.27Å; F63-F66 PolarHBondContact O-N 2.87Å; F63-L67 HydrophobicContact CD1-CD1 3.89Å; F63-L67 HydrophobicContact CD1-CG 4.28Å; F63-L67 HydrophobicContact CE1-CD1 3.4Å; F63-L67 VanDerWaalsContact CE1-CD1 3.4Å; F63-L67 HydrophobicContact CE1-CD2 4.39Å; F63-L67 HydrophobicContact CE1-CG 3.9Å; F63-L67 HydrophobicContact CE2-CD2 4.41Å; F63-L67 HydrophobicContact CE2-CG 4.32Å; F63-L67 HydrophobicContact CZ-CD1 3.85Å; F63-L67 HydrophobicContact CZ-CD2 3.96Å; F63-L67 HydrophobicContact CZ-CG 3.9Å; F63-L67 WeakPolarHBondContact O-CG 3.27Å; F63-L67 PolarHBondContact O-N 3.31Å; F63-L109 HydrophobicContact CD1-CD2 3.87Å
64G93.5Very high90.3Very high0 Ų021.8 Ų21.80%012%0.118CC..Hα-helixtrans-60.2-45.9172.600000112.3A60 L61 I62 F66 L67 S68 G106 V110A60-G64 PolarHBondContact O-N 3.4Å; L61-G64 PolarHBondContact O-N 2.92Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.3Å; G64-F66 VanDerWaalsContact C-N 3.32Å; G64-F66 PolarHBondContact O-N 3.32Å; G64-L67 PolarHBondContact O-N 3.44Å; G64-S68 WeakPolarHBondContact O-CB 3.5Å; G64-S68 PolarHBondContact O-N 3.03Å; G64-G106 CarbonylContact O-C 3.57Å; G64-G106 WeakPolarHBondContact O-CA 3.43Å; G64-V110 VanDerWaalsContact C-CG2 3.46Å
65Y91.8Very high90.7Very high7 Ų721.3 Ų21.33%0.02711%0.114CC..Hα-helixtrans-62.5-39.5175-74.1-62.9000112.6L61 I62 S68 S69 V110 N282L61-Y65 HydrophobicContact CD1-CD2 4.43Å; L61-Y65 HydrophobicContact CD1-CE2 3.74Å; L61-Y65 HydrophobicContact CD2-CE2 4.32Å; L61-Y65 HydrophobicContact CG-CD2 4.2Å; L61-Y65 HydrophobicContact CG-CE2 3.74Å; L61-Y65 VanDerWaalsContact O-CD2 3.23Å; L61-Y65 WeakPolarHBondContact O-CD2 3.49Å; L61-Y65 PolarHBondContact O-N 3.25Å; L61-Y65 VanDerWaalsContact O-N 3.08Å; I62-Y65 PolarHBondContact O-N 3.35Å; Y65-S68 PolarHBondContact O-N 3.05Å; Y65-S69 WeakPolarHBondContact O-CB 3.41Å; Y65-S69 PolarHBondContact O-N 3.42Å; Y65-S69 PolarHBondContact O-OG 2.84Å; Y65-V110 HydrophobicContact CD1-CG1 4.39Å; Y65-V110 HydrophobicContact CD1-CG2 3.81Å; Y65-V110 HydrophobicContact CD2-CG2 4.22Å; Y65-V110 HydrophobicContact CE1-CB 4.5Å; Y65-V110 HydrophobicContact CE1-CG1 3.68Å; Y65-V110 HydrophobicContact CE1-CG2 3.95Å; Y65-V110 HydrophobicContact CE2-CG1 4.18Å; Y65-V110 HydrophobicContact CE2-CG2 4.35Å; Y65-V110 HydrophobicContact CG-CG2 3.93Å; Y65-N282 HydrophobicContact CE1-CB 4.49Å; Y65-N282 HydrophobicContact CE2-CB 4.19Å; Y65-N282 PolarHBondContact OH-ND2 3.45Å
66F94.1Very high90.6Very high43 Ų4321.8 Ų21.819%0.18912%0.118CC..Hα-helixtrans-59.4-53.5174.1170-104.4000111.4A33 T36 F37 I62 F63 G64 S68 S69 C70A33-F66 HydrophobicContact CB-CD2 4.41Å; T36-F66 WeakPolarHBondContact OG1-CA 3.4Å; T36-F66 WeakPolarHBondContact OG1-CB 3.32Å; F37-F66 HydrophobicContact CB-CD2 3.87Å; F37-F66 HydrophobicContact CB-CE2 3.9Å; F37-F66 HydrophobicContact CD2-CD2 4.33Å; F37-F66 AromaticContact CD2-CE2 3.84Å; F37-F66 HydrophobicContact CD2-CE2 3.84Å; F37-F66 HydrophobicContact CD2-CZ 4.02Å; F37-F66 HydrophobicContact CG-CE2 4.22Å; I62-F66 PolarHBondContact O-N 3.26Å; F63-F66 HydrophobicContact CD2-CD1 4.14Å; F63-F66 HydrophobicContact CE2-CD1 4.04Å; F63-F66 HydrophobicContact CE2-CE1 4.45Å; F63-F66 WeakPolarHBondContact O-CB 3.27Å; F63-F66 PolarHBondContact O-N 2.87Å; G64-F66 VanDerWaalsContact C-N 3.32Å; G64-F66 PolarHBondContact O-N 3.32Å; F66-S68 VanDerWaalsContact C-N 3.34Å; F66-S68 PolarHBondContact O-N 3.39Å; F66-S69 PolarHBondContact O-N 3.03Å; F66-C70 WeakPolarHBondContact CE2-SG 3.42Å; F66-C70 VanDerWaalsContact CZ-SG 3.52Å; F66-C70 WeakPolarHBondContact O-CB 3.42Å; F66-C70 PolarHBondContact O-N 2.91Å; F66-C70 PolarHBondContact O-SG 2.86Å
67L94.2Very high90.6Very high30 Ų3020.7 Ų20.716%0.15712%0.118CC..Hα-helixtrans-59.5-43.7178.1-73.2-179000112F63 G64 S69 C70 G71 V102 V105F63-L67 HydrophobicContact CD1-CD1 3.89Å; F63-L67 HydrophobicContact CD1-CG 4.28Å; F63-L67 HydrophobicContact CE1-CD1 3.4Å; F63-L67 VanDerWaalsContact CE1-CD1 3.4Å; F63-L67 HydrophobicContact CE1-CD2 4.39Å; F63-L67 HydrophobicContact CE1-CG 3.9Å; F63-L67 HydrophobicContact CE2-CD2 4.41Å; F63-L67 HydrophobicContact CE2-CG 4.32Å; F63-L67 HydrophobicContact CZ-CD1 3.85Å; F63-L67 HydrophobicContact CZ-CD2 3.96Å; F63-L67 HydrophobicContact CZ-CG 3.9Å; F63-L67 WeakPolarHBondContact O-CG 3.27Å; F63-L67 PolarHBondContact O-N 3.31Å; G64-L67 PolarHBondContact O-N 3.44Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.37Å; L67-C70 PolarHBondContact O-N 3.17Å; L67-G71 PolarHBondContact O-N 3.42Å; L67-V102 HydrophobicContact CD2-CG1 4.26Å; L67-V105 HydrophobicContact CD1-CG1 4.08Å
68S91.5Very high90.6Very high20 Ų2023.1 Ų23.114%0.1413%0.132CC..Hα-helixtrans-58.5-45.8177.5-178.90000111.5G64 Y65 F66 G71 S72 H103G64-S68 WeakPolarHBondContact O-CB 3.5Å; G64-S68 PolarHBondContact O-N 3.03Å; Y65-S68 PolarHBondContact O-N 3.05Å; F66-S68 VanDerWaalsContact C-N 3.34Å; F66-S68 PolarHBondContact O-N 3.39Å; S68-G71 PolarHBondContact O-N 3.05Å; S68-S72 WeakPolarHBondContact O-CB 3.02Å; S68-S72 PolarHBondContact O-N 3.41Å; S68-H103 PolarHBondContact O-ND1 2.9Å; S68-H103 PolarHBondContact OG-CE1 3.47Å
69S91.1Very high90.3Very high4 Ų423.3 Ų23.33%0.02813%0.134CC..Hα-helixtrans-67.7-44.8179.7-50.40000111.2T32 Y65 F66 L67 G71 S72 I73T32-S69 VanDerWaalsContact CG2-OG 3.26Å; T32-S69 WeakPolarHBondContact CG2-OG 3.25Å; Y65-S69 WeakPolarHBondContact O-CB 3.41Å; Y65-S69 PolarHBondContact O-N 3.42Å; Y65-S69 PolarHBondContact O-OG 2.84Å; F66-S69 PolarHBondContact O-N 3.03Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.37Å; S69-G71 PolarHBondContact O-N 3.19Å; S69-S72 PolarHBondContact O-N 2.77Å; S69-I73 VanDerWaalsContact O-CG1 3.28Å; S69-I73 WeakPolarHBondContact O-CG1 3.47Å; S69-I73 PolarHBondContact O-N 2.64Å
70C93Very high90Very high39 Ų3924 Ų2426%0.26414%0.14SC..Hα-helixtrans-62.3-41.6176.1-740000112.5F66 L67 I73 L74F66-C70 WeakPolarHBondContact CE2-SG 3.42Å; F66-C70 VanDerWaalsContact CZ-SG 3.52Å; F66-C70 WeakPolarHBondContact O-CB 3.42Å; F66-C70 PolarHBondContact O-N 2.91Å; F66-C70 PolarHBondContact O-SG 2.86Å; L67-C70 PolarHBondContact O-N 3.17Å; C70-I73 PolarHBondContact O-N 2.88Å; C70-L74 VanDerWaalsContact O-CB 3.29Å; C70-L74 WeakPolarHBondContact O-CB 3.26Å; C70-L74 PolarHBondContact O-N 3.22Å
71G90.2Very high89.8Confident0 Ų027 Ų270%016%0.157CC..Hα-helixtrans-63.9-39.8175.600000112.4L67 S68 S69 L74 S75L67-G71 PolarHBondContact O-N 3.42Å; S68-G71 PolarHBondContact O-N 3.05Å; S69-G71 PolarHBondContact O-N 3.19Å; G71-L74 PolarHBondContact O-N 2.77Å; G71-S75 WeakPolarHBondContact O-CB 3.24Å; G71-S75 PolarHBondContact O-N 2.85Å
72S87.2Confident89.5Confident13 Ų1329 Ų299%0.09117%0.167CC..Hα-helixtrans-63.1-46.7174.9-178.70000111.8D29 S68 S69 L74 S75 S76D29-S72 WeakPolarHBondContact OD2-CB 3.39Å; D29-S72 PolarHBondContact OD2-OG 3.39Å; S68-S72 WeakPolarHBondContact O-CB 3.02Å; S68-S72 PolarHBondContact O-N 3.41Å; S69-S72 PolarHBondContact O-N 2.77Å; S72-L74 VanDerWaalsContact C-N 3.34Å; S72-L74 PolarHBondContact O-N 3.31Å; S72-S75 PolarHBondContact O-N 2.84Å; S72-S76 VanDerWaalsContact O-CB 3.24Å; S72-S76 WeakPolarHBondContact O-CB 3.44Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 2.96Å
73I90Very high89.1Confident49 Ų4932.2 Ų32.225%0.25118%0.178SC..Hα-helixtrans-61-44.3175.4-66.6164.8000110.7F26 D29 A30 A33 S69 C70 G77F26-I73 HydrophobicContact CD1-CG2 4.37Å; F26-I73 HydrophobicContact CE1-CG2 4.07Å; D29-I73 HydrophobicContact CB-CD1 3.92Å; D29-I73 HydrophobicContact CB-CG1 3.6Å; A30-I73 HydrophobicContact CB-CD1 4.47Å; A33-I73 HydrophobicContact CB-CD1 4.34Å; S69-I73 VanDerWaalsContact O-CG1 3.28Å; S69-I73 WeakPolarHBondContact O-CG1 3.47Å; S69-I73 PolarHBondContact O-N 2.64Å; C70-I73 PolarHBondContact O-N 2.88Å; I73-G77 WeakPolarHBondContact O-CA 3.28Å; I73-G77 PolarHBondContact O-N 2.88Å
74L90.3Very high88.7Confident85 Ų8536 Ų3645%0.44520%0.201SC..Hα-helixtrans-63.1-49-179.8-177.767.3000110.8C70 G71 S72 G77 V78 L99C70-L74 VanDerWaalsContact O-CB 3.29Å; C70-L74 WeakPolarHBondContact O-CB 3.26Å; C70-L74 PolarHBondContact O-N 3.22Å; G71-L74 PolarHBondContact O-N 2.77Å; S72-L74 VanDerWaalsContact C-N 3.34Å; S72-L74 PolarHBondContact O-N 3.31Å; L74-G77 PolarHBondContact O-N 3.27Å; L74-V78 HydrophobicContact CD1-CG2 4.42Å; L74-V78 WeakPolarHBondContact O-CB 3.34Å; L74-V78 WeakPolarHBondContact O-CG2 3.47Å; L74-V78 PolarHBondContact O-N 2.88Å; L74-L99 HydrophobicContact CD2-CD1 4.15Å; L74-L99 HydrophobicContact CG-CD1 3.86Å
75S86.5Confident88.4Confident6 Ų642.3 Ų42.34%0.04223%0.234CC..Hα-helixtrans-62-49.3179-174.90000111.5G71 S72 G77 V78 S79 Q100G71-S75 WeakPolarHBondContact O-CB 3.24Å; G71-S75 PolarHBondContact O-N 2.85Å; S72-S75 PolarHBondContact O-N 2.84Å; S75-G77 VanDerWaalsContact C-N 3.31Å; S75-G77 PolarHBondContact O-N 3.46Å; S75-V78 PolarHBondContact O-N 2.95Å; S75-S79 PolarHBondContact O-N 3.48Å; S75-S79 PolarHBondContact O-OG 2.99Å; S75-Q100 PolarHBondContact OG-NE2 3.14Å
76S83.6Confident88Confident14 Ų1447.3 Ų47.310%0.09826%0.257CS..Hα-helixtrans-63.2-39.9179.4-58.40000111.6S72 S79 C80S72-S76 VanDerWaalsContact O-CB 3.24Å; S72-S76 WeakPolarHBondContact O-CB 3.44Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 2.96Å; S76-S79 PolarHBondContact O-N 3.47Å; S76-C80 PolarHBondContact O-N 3.14Å; S76-C80 PolarHBondContact O-SG 2.94Å
77G87.3Confident87.3Confident21 Ų2146.3 Ų46.322%0.21626%0.259CS..Hα-helixtrans-64.5-46.617900000112.2I73 L74 S75 C80 V81I73-G77 WeakPolarHBondContact O-CA 3.28Å; I73-G77 PolarHBondContact O-N 2.88Å; L74-G77 PolarHBondContact O-N 3.27Å; S75-G77 VanDerWaalsContact C-N 3.31Å; S75-G77 PolarHBondContact O-N 3.46Å; G77-C80 WeakPolarHBondContact O-CB 3.39Å; G77-C80 PolarHBondContact O-N 3.31Å; G77-V81 VanDerWaalsContact O-CG2 3.31Å; G77-V81 WeakPolarHBondContact O-CG2 3.47Å; G77-V81 PolarHBondContact O-N 2.97Å
78V87.2Confident86.8Confident50 Ų5046.3 Ų46.330%0.30326%0.259SS..Hα-helixtrans-63.5-42.1175.7171.10000110.7L74 S75 C80 V81 M82 L99L74-V78 HydrophobicContact CD1-CG2 4.42Å; L74-V78 WeakPolarHBondContact O-CB 3.34Å; L74-V78 WeakPolarHBondContact O-CG2 3.47Å; L74-V78 PolarHBondContact O-N 2.88Å; S75-V78 PolarHBondContact O-N 2.95Å; V78-C80 PolarHBondContact O-N 3.4Å; V78-V81 PolarHBondContact O-N 3.16Å; V78-M82 HydrophobicContact CG1-CG 4.12Å; V78-M82 WeakPolarHBondContact O-CB 3.48Å; V78-M82 WeakPolarHBondContact O-CG 3.33Å; V78-M82 PolarHBondContact O-N 2.91Å; V78-L99 HydrophobicContact CB-CD1 4.08Å; V78-L99 HydrophobicContact CB-CD2 3.91Å; V78-L99 HydrophobicContact CG1-CD1 4.4Å; V78-L99 HydrophobicContact CG1-CD2 3.87Å; V78-L99 HydrophobicContact CG2-CD1 3.76Å
79S83.4Confident86.3Confident7 Ų745.6 Ų45.65%0.04925%0.254CS..Hα-helixtrans-59.4-42.7174.5-650000112.8S75 S76 M82 R83S75-S79 PolarHBondContact O-N 3.48Å; S75-S79 PolarHBondContact O-OG 2.99Å; S76-S79 PolarHBondContact O-N 3.47Å; S79-M82 PolarHBondContact O-N 2.97Å; S79-R83 PolarHBondContact O-N 3.44Å
80C85.3Confident85.9Confident31 Ų3146.9 Ų46.921%0.20926%0.262CS..Hα-helixtrans-60.4-46.5173.4-76.20000112.5L22 S76 G77 V78 R83 L84L22-C80 WeakPolarHBondContact CD2-SG 3.2Å; S76-C80 PolarHBondContact O-N 3.14Å; S76-C80 PolarHBondContact O-SG 2.94Å; G77-C80 WeakPolarHBondContact O-CB 3.39Å; G77-C80 PolarHBondContact O-N 3.31Å; V78-C80 PolarHBondContact O-N 3.4Å; C80-R83 PolarHBondContact O-N 2.97Å; C80-L84 VanDerWaalsContact O-CG 3.32Å; C80-L84 WeakPolarHBondContact O-CG 3.16Å; C80-L84 PolarHBondContact O-N 3.29Å
81V87.9Confident85.3Confident76 Ų7646.4 Ų46.446%0.46126%0.256SS..Hα-helixtrans-64.9-42.1-178.5170.80000110.9G77 V78 L84 I85G77-V81 VanDerWaalsContact O-CG2 3.31Å; G77-V81 WeakPolarHBondContact O-CG2 3.47Å; G77-V81 PolarHBondContact O-N 2.97Å; V78-V81 PolarHBondContact O-N 3.16Å; V81-L84 PolarHBondContact O-N 3.48Å; V81-I85 HydrophobicContact CG1-CD1 3.57Å; V81-I85 HydrophobicContact CG1-CG1 4.33Å; V81-I85 WeakPolarHBondContact O-CG1 3.5Å; V81-I85 PolarHBondContact O-N 3.28Å
82M85.6Confident85Confident44 Ų4450 Ų5022%0.21728%0.275CS..Hα-helixtrans-60.2-46.9175.6-69-73.3-81.400110.8V78 S79 L84 I85 Q86 D88V78-M82 HydrophobicContact CG1-CG 4.12Å; V78-M82 WeakPolarHBondContact O-CB 3.48Å; V78-M82 WeakPolarHBondContact O-CG 3.33Å; V78-M82 PolarHBondContact O-N 2.91Å; S79-M82 PolarHBondContact O-N 2.97Å; M82-L84 VanDerWaalsContact C-N 3.29Å; M82-L84 PolarHBondContact O-N 3.3Å; M82-I85 PolarHBondContact O-N 3.06Å; M82-Q86 WeakPolarHBondContact O-CB 3.39Å; M82-Q86 PolarHBondContact O-N 3.23Å; M82-D88 CarbonylContact C-O 3.55Å
83R83.2Confident84.7Confident68 Ų6849.8 Ų49.826%0.25727%0.273SS..Hα-helixtrans-58-41176-177.762.5174.4106.87.3112.6F15 D16 S79 C80 G87 D88F15-R83 HydrophobicContact CD1-CB 4.42Å; F15-R83 HydrophobicContact CD1-CG 3.75Å; F15-R83 HydrophobicContact CD2-CB 4.29Å; F15-R83 HydrophobicContact CD2-CG 4.45Å; F15-R83 HydrophobicContact CE1-CB 4.22Å; F15-R83 HydrophobicContact CE1-CG 3.71Å; F15-R83 HydrophobicContact CE2-CB 4.07Å; F15-R83 HydrophobicContact CE2-CG 4.41Å; F15-R83 HydrophobicContact CG-CB 4.46Å; F15-R83 HydrophobicContact CG-CG 4.14Å; F15-R83 HydrophobicContact CZ-CB 4.03Å; F15-R83 HydrophobicContact CZ-CG 4.05Å; D16-R83 IonicContact OD1-NH2 2.97Å; S79-R83 PolarHBondContact O-N 3.44Å; C80-R83 PolarHBondContact O-N 2.97Å; R83-G87 PolarHBondContact NH1-O 3.39Å; R83-G87 VanDerWaalsContact O-CA 3.31Å; R83-G87 WeakPolarHBondContact O-CA 3.38Å; R83-G87 PolarHBondContact O-N 3.48Å; R83-D88 WeakPolarHBondContact CA-O 3.32Å; R83-D88 PolarHBondContact N-O 3.21Å
84L85.9Confident84.4Confident149 Ų14950.8 Ų50.878%0.7827%0.274SS*.Hα-helixtrans-72.4-34.5-178.8-72.7169.9000113.3C80 V81 M82C80-L84 VanDerWaalsContact O-CG 3.32Å; C80-L84 WeakPolarHBondContact O-CG 3.16Å; C80-L84 PolarHBondContact O-N 3.29Å; V81-L84 PolarHBondContact O-N 3.48Å; M82-L84 VanDerWaalsContact C-N 3.29Å; M82-L84 PolarHBondContact O-N 3.3Å
85I87.4Confident84.1Confident133 Ų13349.6 Ų49.668%0.68227%0.272SS*.Hα-helixtrans-93.5-49.7-174.4-63.7176.1000111.9V81 M82V81-I85 HydrophobicContact CG1-CD1 3.57Å; V81-I85 HydrophobicContact CG1-CG1 4.33Å; V81-I85 WeakPolarHBondContact O-CG1 3.5Å; V81-I85 PolarHBondContact O-N 3.28Å; M82-I85 PolarHBondContact O-N 3.06Å
86Q82.4Confident84Confident111 Ų11149.5 Ų49.552%0.51927%0.271SS..Hα-helixtrans-94-18.9-172.7-63-176.8-10.800112.3M82 D88M82-Q86 WeakPolarHBondContact O-CB 3.39Å; M82-Q86 PolarHBondContact O-N 3.23Å; Q86-D88 WeakPolarHBondContact CB-OD1 3.26Å; Q86-D88 PolarHBondContact O-N 3.35Å
87G81.1Confident84Confident22 Ų2250.1 Ų50.123%0.22727%0.274CS..SBendtrans85.5-10.5-175.400000113.5R83R83-G87 PolarHBondContact NH1-O 3.39Å; R83-G87 VanDerWaalsContact O-CA 3.31Å; R83-G87 WeakPolarHBondContact O-CA 3.38Å; R83-G87 PolarHBondContact O-N 3.48Å
88D82.6Confident84Confident31 Ų3152.5 Ų52.517%0.16629%0.286CS..SBendtrans-131179.1175.250.721.1000113.5H8 S11 M82 R83 Q86 V90H8-D88 IonicContact CE1-OD2 3.75Å; H8-D88 VanDerWaalsContact ND1-CB 3.33Å; H8-D88 WeakPolarHBondContact ND1-CB 3.2Å; H8-D88 IonicContact ND1-OD2 3.26Å; H8-D88 PolarHBondContact ND1-OD2 3Å; S11-D88 WeakPolarHBondContact OG-CB 3.39Å; M82-D88 CarbonylContact C-O 3.55Å; R83-D88 WeakPolarHBondContact CA-O 3.32Å; R83-D88 PolarHBondContact N-O 3.21Å; Q86-D88 WeakPolarHBondContact CB-OD1 3.26Å; Q86-D88 PolarHBondContact O-N 3.35Å; D88-V90 HydrophobicContact CB-CG2 4.27Å
89C80.7Confident84Confident5 Ų551.3 Ų51.33%0.03428%0.278CS..  trans-122.617.5177.3-67.80000112.3F15 M91 P168 Y169F15-C89 VanDerWaalsContact CD2-SG 3.51Å; C89-M91 PolarHBondContact O-N 3.27Å; C89-P168 CarbonylContact C-O 3.14Å; C89-Y169 HydrophobicContact CB-CD2 3.84Å; C89-Y169 HydrophobicContact CB-CE2 4.42Å
90V82.1Confident84.2Confident31 Ų3152 Ų5219%0.18828%0.28CS..  trans-67.8129.6-178.4179.60000109L7 D88 D166 I167L7-V90 HydrophobicContact CD2-CG1 3.59Å; L7-V90 HydrophobicContact CD2-CG2 4.15Å; L7-V90 HydrophobicContact CG-CG1 4.41Å; L7-V90 HydrophobicContact CG-CG2 4.1Å; D88-V90 HydrophobicContact CB-CG2 4.27Å; V90-D166 HydrophobicContact CG1-CB 4.11Å; V90-I167 WeakPolarHBondContact CA-O 3.5Å
91M82.2Confident84.3Confident29 Ų2954.1 Ų54.114%0.14329%0.289CS..EExtended strand (participates in β ladder)trans-146.9148.8178.1-175.7168.752.800110.5C89 S95 C96 L99 I167 C170C89-M91 PolarHBondContact O-N 3.27Å; M91-S95 VanDerWaalsContact SD-CB 3.57Å; M91-C96 HydrophobicContact CE-CB 3.62Å; M91-L99 HydrophobicContact CE-CD2 3.86Å; M91-I167 PolarHBondContact N-O 2.78Å; M91-I167 VanDerWaalsContact N-O 3.13Å; M91-I167 WeakPolarHBondContact O-CG1 3.38Å; M91-I167 PolarHBondContact O-N 3.12Å; M91-C170 HydrophobicContact CE-CB 3.51Å; M91-C170 VanDerWaalsContact CE-SG 3.55Å
92N83.8Confident84.6Confident74 Ų7453 Ų5340%0.39628%0.282SS..EExtended strand (participates in β ladder)trans-64.4139.5173.7-56.422.6000110R94 S95 C96 D166N92-R94 VanDerWaalsContact C-N 3.27Å; N92-R94 PolarHBondContact O-N 3.15Å; N92-R94 VanDerWaalsContact O-N 3.16Å; N92-S95 WeakPolarHBondContact O-CB 3.26Å; N92-S95 PolarHBondContact O-N 3.48Å; N92-C96 PolarHBondContact O-N 2.84Å; N92-D166 PolarHBondContact OD1-OD1 2.98Å; N92-D166 VanDerWaalsContact OD1-OD1 3.05Å
93L81Confident84.7Confident9 Ų953.1 Ų53.15%0.04728%0.282CS..Hα-helixtrans-52.4-41-178.5-17862.4000113.4C96 L97 Q165 I167L93-C96 WeakPolarHBondContact O-CB 3.22Å; L93-C96 PolarHBondContact O-N 3.38Å; L93-L97 HydrophobicContact CG-CD1 4.49Å; L93-L97 WeakPolarHBondContact O-CG 3.29Å; L93-L97 PolarHBondContact O-N 2.89Å; L93-Q165 WeakPolarHBondContact CB-O 3.49Å; L93-Q165 PolarHBondContact N-O 3.42Å; L93-I167 HydrophobicContact CD1-CD1 4.06Å; L93-I167 HydrophobicContact CD1-CG2 4.37Å
94R82Confident84.9Confident71 Ų7150 Ų5027%0.26827%0.271SS..Hα-helixtrans-64.2-41177.3-73.6-168.8-178.5174.94.2113.2N92 C96 L97 C98 Y159 S162 H164N92-R94 VanDerWaalsContact C-N 3.27Å; N92-R94 PolarHBondContact O-N 3.15Å; N92-R94 VanDerWaalsContact O-N 3.16Å; R94-C96 VanDerWaalsContact C-N 3.29Å; R94-L97 PolarHBondContact O-N 3.33Å; R94-C98 PolarHBondContact O-N 3.34Å; R94-C98 PolarHBondContact O-SG 3.48Å; R94-C98 VanDerWaalsContact O-SG 3.38Å; R94-Y159 HydrophobicContact CB-CE2 4.28Å; R94-Y159 HydrophobicContact CG-CE2 4.36Å; R94-S162 PolarHBondContact NE-O 3.4Å; R94-S162 PolarHBondContact NH2-O 3.08Å; R94-H164 PolarHBondContact NH1-CE1 3.38Å; R94-H164 PolarHBondContact NH1-NE2 2.9Å
95S84.9Confident85.2Confident60 Ų6044.6 Ų44.642%0.4224%0.244SC..Hα-helixtrans-65.7-37.1176.2-590000110.7M91 N92 C98 L99M91-S95 VanDerWaalsContact SD-CB 3.57Å; N92-S95 WeakPolarHBondContact O-CB 3.26Å; N92-S95 PolarHBondContact O-N 3.48Å; S95-C98 PolarHBondContact O-N 2.94Å; S95-L99 WeakPolarHBondContact O-CB 2.84Å; S95-L99 PolarHBondContact O-N 2.88Å
96C84.6Confident85.5Confident3 Ų338.3 Ų38.32%0.0221%0.212CC..Hα-helixtrans-61.3-46.1171.9-177.70000112.9M91 N92 L93 R94 C98 L99 Q100 I167 C170M91-C96 HydrophobicContact CE-CB 3.62Å; N92-C96 PolarHBondContact O-N 2.84Å; L93-C96 WeakPolarHBondContact O-CB 3.22Å; L93-C96 PolarHBondContact O-N 3.38Å; R94-C96 VanDerWaalsContact C-N 3.29Å; C96-C98 VanDerWaalsContact C-N 3.34Å; C96-C98 PolarHBondContact O-N 2.96Å; C96-L99 WeakPolarHBondContact O-CB 3.02Å; C96-L99 PolarHBondContact O-N 2.89Å; C96-L99 VanDerWaalsContact O-N 3.16Å; C96-Q100 WeakPolarHBondContact O-CB 3.31Å; C96-Q100 WeakPolarHBondContact O-CG 3.12Å; C96-Q100 PolarHBondContact O-N 3.47Å; C96-I167 HydrophobicContact CB-CD1 3.74Å; C96-C170 WeakPolarHBondContact CA-SG 3.4Å; C96-C170 HydrophobicContact CB-CB 3.9Å; C96-C170 WeakPolarHBondContact CB-SG 3.3Å; C96-C170 WeakPolarHBondContact SG-CA 3.04Å; C96-C170 WeakPolarHBondContact SG-CB 3.34Å; C96-C170 CovalentContact SG-SG 2.04Å; C96-C170 PolarHBondContact SG-SG 3.35Å
97L84.1Confident85.8Confident28 Ų2834.2 Ų34.215%0.14719%0.192CC..Hα-helixtrans-62.7-40.7177.5-71.7172.4000112.3L93 R94 L99 Q100 L101 S162L93-L97 HydrophobicContact CG-CD1 4.49Å; L93-L97 WeakPolarHBondContact O-CG 3.29Å; L93-L97 PolarHBondContact O-N 2.89Å; R94-L97 PolarHBondContact O-N 3.33Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.27Å; L97-Q100 CarbonylContact O-C 3.47Å; L97-Q100 PolarHBondContact O-N 2.9Å; L97-L101 PolarHBondContact O-N 2.73Å; L97-S162 WeakPolarHBondContact CD1-OG 3.01Å
98C86.2Confident86.2Confident71 Ų7133.2 Ų33.248%0.4818%0.181SC..Hα-helixtrans-61.6-40.4173.8-71.10000112R94 S95 C96 L101R94-C98 PolarHBondContact O-N 3.34Å; R94-C98 PolarHBondContact O-SG 3.48Å; R94-C98 VanDerWaalsContact O-SG 3.38Å; S95-C98 PolarHBondContact O-N 2.94Å; C96-C98 VanDerWaalsContact C-N 3.34Å; C96-C98 PolarHBondContact O-N 2.96Å; C98-L101 VanDerWaalsContact O-CB 3.24Å; C98-L101 WeakPolarHBondContact O-CB 3.27Å; C98-L101 PolarHBondContact O-N 2.97Å
99L87.4Confident86.6Confident24 Ų2432.6 Ų32.613%0.12618%0.178CC..Hα-helixtrans-67.2-39.8177.4-174.665.1000112L74 V78 M91 S95 C96 L97 L101L74-L99 HydrophobicContact CD2-CD1 4.15Å; L74-L99 HydrophobicContact CG-CD1 3.86Å; V78-L99 HydrophobicContact CB-CD1 4.08Å; V78-L99 HydrophobicContact CB-CD2 3.91Å; V78-L99 HydrophobicContact CG1-CD1 4.4Å; V78-L99 HydrophobicContact CG1-CD2 3.87Å; V78-L99 HydrophobicContact CG2-CD1 3.76Å; M91-L99 HydrophobicContact CE-CD2 3.86Å; S95-L99 WeakPolarHBondContact O-CB 2.84Å; S95-L99 PolarHBondContact O-N 2.88Å; C96-L99 WeakPolarHBondContact O-CB 3.02Å; C96-L99 PolarHBondContact O-N 2.89Å; C96-L99 VanDerWaalsContact O-N 3.16Å; L97-L99 VanDerWaalsContact C-N 3.31Å; L97-L99 PolarHBondContact O-N 3.27Å; L99-L101 VanDerWaalsContact C-N 3.3Å; L99-L101 PolarHBondContact O-N 2.94Å
100Q87Confident87.1Confident21 Ų2132.4 Ų32.410%0.09818%0.177CC..Hα-helixtrans-79.2-9178.6-74.3-76.5-17.100113.5S75 C96 L97 V102 H103 S104 M172S75-Q100 PolarHBondContact OG-NE2 3.14Å; C96-Q100 WeakPolarHBondContact O-CB 3.31Å; C96-Q100 WeakPolarHBondContact O-CG 3.12Å; C96-Q100 PolarHBondContact O-N 3.47Å; L97-Q100 CarbonylContact O-C 3.47Å; L97-Q100 PolarHBondContact O-N 2.9Å; Q100-V102 VanDerWaalsContact C-N 3.33Å; Q100-V102 PolarHBondContact O-N 2.95Å; Q100-H103 WeakPolarHBondContact O-CB 3.2Å; Q100-H103 PolarHBondContact O-N 3.25Å; Q100-H103 VanDerWaalsContact O-N 3.09Å; Q100-S104 PolarHBondContact O-N 2.79Å; Q100-M172 HydrophobicContact CB-CE 4.28Å
101L89.2Confident87.4Confident76 Ų7631 Ų3140%0.39817%0.168SC..Hα-helixtrans-55.3-46.9-176.3-178.464.5000112.1L97 C98 L99 H103 S104 V105 N155L97-L101 PolarHBondContact O-N 2.73Å; C98-L101 VanDerWaalsContact O-CB 3.24Å; C98-L101 WeakPolarHBondContact O-CB 3.27Å; C98-L101 PolarHBondContact O-N 2.97Å; L99-L101 VanDerWaalsContact C-N 3.3Å; L99-L101 PolarHBondContact O-N 2.94Å; L101-H103 VanDerWaalsContact C-N 3.29Å; L101-H103 PolarHBondContact O-N 2.78Å; L101-S104 PolarHBondContact O-N 3.33Å; L101-V105 HydrophobicContact CD1-CG2 4.16Å; L101-V105 HydrophobicContact CG-CG2 4.37Å; L101-V105 WeakPolarHBondContact O-CB 3.44Å; L101-V105 WeakPolarHBondContact O-CG2 3.36Å; L101-V105 PolarHBondContact O-N 2.94Å; L101-N155 HydrophobicContact CD1-CB 3.78Å; L101-N155 VanDerWaalsContact CD1-OD1 3.25Å; L101-N155 WeakPolarHBondContact CD1-OD1 3.38Å
102V92.2Very high87.8Confident53 Ų5330 Ų3032%0.32116%0.164SC..Hα-helixtrans-62.1-41.1-179.6-178.80000110.8L67 Q100 G106L67-V102 HydrophobicContact CD2-CG1 4.26Å; Q100-V102 VanDerWaalsContact C-N 3.33Å; Q100-V102 PolarHBondContact O-N 2.95Å; V102-G106 PolarHBondContact O-N 3.11Å
103H89.1Confident88.2Confident46 Ų4626.6 Ų26.621%0.21315%0.146CC..Hα-helixtrans-65.7-49.4177.6-175.869.1000111.1S68 Q100 L101 V105 G106 Y107S68-H103 PolarHBondContact O-ND1 2.9Å; S68-H103 PolarHBondContact OG-CE1 3.47Å; Q100-H103 WeakPolarHBondContact O-CB 3.2Å; Q100-H103 PolarHBondContact O-N 3.25Å; Q100-H103 VanDerWaalsContact O-N 3.09Å; L101-H103 VanDerWaalsContact C-N 3.29Å; L101-H103 PolarHBondContact O-N 2.78Å; H103-V105 PolarHBondContact O-N 3.4Å; H103-G106 PolarHBondContact O-N 2.82Å; H103-Y107 VanDerWaalsContact O-CB 3.31Å; H103-Y107 WeakPolarHBondContact O-CB 3.38Å; H103-Y107 PolarHBondContact O-N 3.48Å
104S87.9Confident88.5Confident2 Ų226.1 Ų26.11%0.01414%0.144CC..Hα-helixtrans-57.6-48.5177.4179.80000112.1Q100 L101 G106 Y107 I108 N155Q100-S104 PolarHBondContact O-N 2.79Å; L101-S104 PolarHBondContact O-N 3.33Å; S104-G106 VanDerWaalsContact C-N 3.34Å; S104-G106 PolarHBondContact O-N 3.27Å; S104-Y107 PolarHBondContact O-N 3.49Å; S104-I108 WeakPolarHBondContact O-CB 3.21Å; S104-I108 VanDerWaalsContact O-CG1 3.3Å; S104-I108 WeakPolarHBondContact O-CG1 3.08Å; S104-I108 PolarHBondContact O-N 3.03Å; S104-N155 PolarHBondContact OG-OD1 3.23Å
105V91.6Very high88.9Confident37 Ų3725.4 Ų25.422%0.22414%0.143CC..Hα-helixtrans-58.5-47.4177.5170.40000110.7L67 L101 H103 Y107 L109 I151L67-V105 HydrophobicContact CD1-CG1 4.08Å; L101-V105 HydrophobicContact CD1-CG2 4.16Å; L101-V105 HydrophobicContact CG-CG2 4.37Å; L101-V105 WeakPolarHBondContact O-CB 3.44Å; L101-V105 WeakPolarHBondContact O-CG2 3.36Å; L101-V105 PolarHBondContact O-N 2.94Å; H103-V105 PolarHBondContact O-N 3.4Å; V105-Y107 PolarHBondContact O-N 3.31Å; V105-L109 WeakPolarHBondContact O-CB 3.38Å; V105-L109 PolarHBondContact O-N 3.37Å; V105-I151 HydrophobicContact CB-CG2 4.27Å; V105-I151 HydrophobicContact CG1-CG2 4.14Å; V105-I151 HydrophobicContact CG2-CG2 3.74Å
106G92.2Very high89.1Confident0 Ų023.5 Ų23.50%013%0.128CC..Hα-helixtrans-60.2-45.9177.100000112.2G64 V102 H103 S104 L109 V110G64-G106 CarbonylContact O-C 3.57Å; G64-G106 WeakPolarHBondContact O-CA 3.43Å; V102-G106 PolarHBondContact O-N 3.11Å; H103-G106 PolarHBondContact O-N 2.82Å; S104-G106 VanDerWaalsContact C-N 3.34Å; S104-G106 PolarHBondContact O-N 3.27Å; G106-L109 PolarHBondContact O-N 2.77Å; G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 3.45Å
107Y88.8Confident89.3Confident26 Ų2623.4 Ų23.410%0.10213%0.127CC..Hα-helixtrans-62.5-50.6-179.3-170.8-104.3000112.6H103 S104 V105 L109 V110 I111 F246 V275H103-Y107 VanDerWaalsContact O-CB 3.31Å; H103-Y107 WeakPolarHBondContact O-CB 3.38Å; H103-Y107 PolarHBondContact O-N 3.48Å; S104-Y107 PolarHBondContact O-N 3.49Å; V105-Y107 PolarHBondContact O-N 3.31Å; Y107-L109 VanDerWaalsContact C-N 3.28Å; Y107-L109 PolarHBondContact O-N 3.31Å; Y107-V110 WeakPolarHBondContact O-CB 3.5Å; Y107-V110 PolarHBondContact O-N 3.49Å; Y107-V110 VanDerWaalsContact O-N 3.15Å; Y107-I111 HydrophobicContact CD1-CD1 3.98Å; Y107-I111 HydrophobicContact CE1-CD1 3.31Å; Y107-I111 HydrophobicContact CE1-CG1 4.21Å; Y107-I111 PolarHBondContact O-N 3.5Å; Y107-I111 VanDerWaalsContact O-N 3.15Å; Y107-F246 HydrophobicContact CE1-CD2 4.49Å; Y107-F246 AromaticContact CE1-CE2 3.88Å; Y107-F246 HydrophobicContact CE1-CE2 3.88Å; Y107-F246 HydrophobicContact CE1-CZ 4.3Å; Y107-F246 HydrophobicContact CE2-CD2 4.44Å; Y107-F246 AromaticContact CZ-CD2 3.68Å; Y107-F246 AromaticContact CZ-CE2 3.52Å; Y107-F246 WeakPolarHBondContact OH-CD2 3.3Å; Y107-F246 WeakPolarHBondContact OH-CE2 3.46Å; Y107-F246 VanDerWaalsContact OH-CG 3.27Å; Y107-F246 WeakPolarHBondContact OH-CG 3.25Å; Y107-F246 WeakPolarHBondContact OH-CZ 3.17Å; Y107-V275 HydrophobicContact CE2-CG1 4.28Å
108I90Very high89.4Confident1 Ų122 Ų221%0.00512%0.12CC..Hα-helixtrans-61.4-40.1176.7-64.6166.9000110.5S104 V110 I111 A112 Y150 I151 I154S104-I108 WeakPolarHBondContact O-CB 3.21Å; S104-I108 VanDerWaalsContact O-CG1 3.3Å; S104-I108 WeakPolarHBondContact O-CG1 3.08Å; S104-I108 PolarHBondContact O-N 3.03Å; I108-V110 VanDerWaalsContact C-N 3.31Å; I108-V110 PolarHBondContact O-N 2.9Å; I108-I111 PolarHBondContact O-N 3.21Å; I108-A112 VanDerWaalsContact O-CB 3.25Å; I108-A112 WeakPolarHBondContact O-CB 3.44Å; I108-A112 PolarHBondContact O-N 3.32Å; I108-Y150 HydrophobicContact CG2-CD1 3.67Å; I108-Y150 HydrophobicContact CG2-CE1 3.57Å; I108-I151 HydrophobicContact CB-CG1 4Å; I108-I151 HydrophobicContact CG2-CD1 4.31Å; I108-I151 HydrophobicContact CG2-CG1 3.44Å; I108-I151 VanDerWaalsContact CG2-CG1 3.44Å; I108-I154 HydrophobicContact CD1-CB 4.29Å; I108-I154 HydrophobicContact CD1-CG2 3.88Å
109L92.2Very high89.5Confident17 Ų1720.5 Ų20.59%0.08911%0.108CC..Hα-helixtrans-62.5-38.4177.5-173.262.9000111.7F63 V105 G106 Y107 S113 V147 I151F63-L109 HydrophobicContact CD1-CD2 3.87Å; V105-L109 WeakPolarHBondContact O-CB 3.38Å; V105-L109 PolarHBondContact O-N 3.37Å; G106-L109 PolarHBondContact O-N 2.77Å; Y107-L109 VanDerWaalsContact C-N 3.28Å; Y107-L109 PolarHBondContact O-N 3.31Å; L109-S113 WeakPolarHBondContact O-CB 3.23Å; L109-S113 PolarHBondContact O-N 3.27Å; L109-S113 PolarHBondContact O-OG 2.9Å; L109-V147 HydrophobicContact CD1-CG1 3.99Å; L109-I151 HydrophobicContact CB-CD1 4.29Å; L109-I151 HydrophobicContact CD1-CD1 4.32Å
110V91.2Very high89.4Confident2 Ų219.3 Ų19.31%0.01210%0.102CC..Hα-helixtrans-62.8-48.2175.3169.90000111.3L61 G64 Y65 G106 Y107 I108 S113 S114L61-V110 HydrophobicContact CD1-CB 4.46Å; L61-V110 HydrophobicContact CD1-CG1 3.99Å; G64-V110 VanDerWaalsContact C-CG2 3.46Å; Y65-V110 HydrophobicContact CD1-CG1 4.39Å; Y65-V110 HydrophobicContact CD1-CG2 3.81Å; Y65-V110 HydrophobicContact CD2-CG2 4.22Å; Y65-V110 HydrophobicContact CE1-CB 4.5Å; Y65-V110 HydrophobicContact CE1-CG1 3.68Å; Y65-V110 HydrophobicContact CE1-CG2 3.95Å; Y65-V110 HydrophobicContact CE2-CG1 4.18Å; Y65-V110 HydrophobicContact CE2-CG2 4.35Å; Y65-V110 HydrophobicContact CG-CG2 3.93Å; G106-V110 WeakPolarHBondContact O-CG2 3.49Å; G106-V110 PolarHBondContact O-N 3.45Å; Y107-V110 WeakPolarHBondContact O-CB 3.5Å; Y107-V110 PolarHBondContact O-N 3.49Å; Y107-V110 VanDerWaalsContact O-N 3.15Å; I108-V110 VanDerWaalsContact C-N 3.31Å; I108-V110 PolarHBondContact O-N 2.9Å; V110-S113 PolarHBondContact O-OG 2.92Å; V110-S113 VanDerWaalsContact O-OG 3.14Å; V110-S114 WeakPolarHBondContact O-CB 3.45Å; V110-S114 PolarHBondContact O-N 3.3Å; V110-S114 PolarHBondContact O-OG 3.23Å
111I88.6Confident89.3Confident1 Ų120 Ų201%0.00510%0.103CC..Hα-helixtrans-63.8-50.6179.5-60172.3000110.2Y107 I108 S113 S114 F115 N188 L191Y107-I111 HydrophobicContact CD1-CD1 3.98Å; Y107-I111 HydrophobicContact CE1-CD1 3.31Å; Y107-I111 HydrophobicContact CE1-CG1 4.21Å; Y107-I111 PolarHBondContact O-N 3.5Å; Y107-I111 VanDerWaalsContact O-N 3.15Å; I108-I111 PolarHBondContact O-N 3.21Å; I111-S113 PolarHBondContact O-N 3.45Å; I111-S114 WeakPolarHBondContact O-CB 3.22Å; I111-S114 PolarHBondContact O-N 2.85Å; I111-F115 PolarHBondContact O-N 2.85Å; I111-N188 HydrophobicContact CD1-CB 3.75Å; I111-L191 HydrophobicContact CG2-CB 4.17Å; I111-L191 HydrophobicContact CG2-CD2 3.54Å; I111-L191 HydrophobicContact CG2-CG 3.9Å
112A90.8Very high89.1Confident7 Ų718.1 Ų18.16%0.05810%0.096CC..Hα-helixtrans-63.2-45.1-176.400000111.9I108 S114 F115 L116 V147I108-A112 VanDerWaalsContact O-CB 3.25Å; I108-A112 WeakPolarHBondContact O-CB 3.44Å; I108-A112 PolarHBondContact O-N 3.32Å; A112-S114 VanDerWaalsContact C-N 3.35Å; A112-S114 PolarHBondContact O-N 2.95Å; A112-F115 PolarHBondContact O-N 3.05Å; A112-L116 WeakPolarHBondContact O-CB 3.37Å; A112-L116 WeakPolarHBondContact O-CG 3.42Å; A112-L116 PolarHBondContact O-N 3.36Å; A112-V147 HydrophobicContact CB-CB 4.4Å; A112-V147 HydrophobicContact CB-CG1 3.65Å; A112-V147 HydrophobicContact CB-CG2 3.82Å
113S90.2Very high88.7Confident3 Ų317.9 Ų17.92%0.0219%0.092CC..Hα-helixtrans-65.7-36.6176.460.90000112.4L61 L109 V110 I111 F115 L116 L117L61-S113 WeakPolarHBondContact CA-OG 3.45Å; L61-S113 VanDerWaalsContact CD1-OG 3.28Å; L61-S113 WeakPolarHBondContact CD1-OG 3.11Å; L109-S113 WeakPolarHBondContact O-CB 3.23Å; L109-S113 PolarHBondContact O-N 3.27Å; L109-S113 PolarHBondContact O-OG 2.9Å; V110-S113 PolarHBondContact O-OG 2.92Å; V110-S113 VanDerWaalsContact O-OG 3.14Å; I111-S113 PolarHBondContact O-N 3.45Å; S113-F115 VanDerWaalsContact C-N 3.35Å; S113-L116 PolarHBondContact O-N 2.87Å; S113-L117 WeakPolarHBondContact O-CB 3.37Å; S113-L117 VanDerWaalsContact O-CG 3.26Å; S113-L117 WeakPolarHBondContact O-CG 3.4Å; S113-L117 PolarHBondContact O-N 3.3Å
114S88.8Confident88.4Confident0 Ų017 Ų170%09%0.093CC..Hα-helixtrans-62.8-40.9174.2-64.50000112.1L61 V110 I111 A112 A118L61-S114 VanDerWaalsContact CD1-OG 3.31Å; L61-S114 WeakPolarHBondContact CD1-OG 3.29Å; V110-S114 WeakPolarHBondContact O-CB 3.45Å; V110-S114 PolarHBondContact O-N 3.3Å; V110-S114 PolarHBondContact O-OG 3.23Å; I111-S114 WeakPolarHBondContact O-CB 3.22Å; I111-S114 PolarHBondContact O-N 2.85Å; A112-S114 VanDerWaalsContact C-N 3.35Å; A112-S114 PolarHBondContact O-N 2.95Å; S114-A118 PolarHBondContact O-N 3.36Å
115F89Confident87.9Confident56 Ų5619.1 Ų19.125%0.24610%0.103CC..Hα-helixtrans-67.3-47.6174.5-179.2-96.1000112.3I111 A112 S113 L117 A118 V119 L191 L194 T195I111-F115 PolarHBondContact O-N 2.85Å; A112-F115 PolarHBondContact O-N 3.05Å; S113-F115 VanDerWaalsContact C-N 3.35Å; F115-L117 VanDerWaalsContact C-N 3.28Å; F115-L117 PolarHBondContact O-N 2.74Å; F115-A118 WeakPolarHBondContact O-CB 3.33Å; F115-A118 PolarHBondContact O-N 2.71Å; F115-V119 HydrophobicContact CD1-CG2 4.11Å; F115-V119 HydrophobicContact CE1-CG2 3.67Å; F115-V119 HydrophobicContact CE2-CG2 4.27Å; F115-V119 HydrophobicContact CZ-CG2 3.74Å; F115-V119 WeakPolarHBondContact O-CG2 3.19Å; F115-V119 PolarHBondContact O-N 2.73Å; F115-L191 HydrophobicContact CB-CD1 4.14Å; F115-L191 HydrophobicContact CB-CG 4.26Å; F115-L191 HydrophobicContact CD1-CD1 4.02Å; F115-L191 HydrophobicContact CD2-CD1 3.58Å; F115-L191 HydrophobicContact CD2-CG 4.31Å; F115-L191 HydrophobicContact CE1-CD1 4.33Å; F115-L191 HydrophobicContact CE2-CD1 3.97Å; F115-L191 HydrophobicContact CG-CD1 3.64Å; F115-L191 HydrophobicContact CG-CG 4.28Å; F115-L191 HydrophobicContact CZ-CD1 4.33Å; F115-L194 HydrophobicContact CE2-CB 4.15Å; F115-T195 VanDerWaalsContact CA-CG2 3.43Å; F115-T195 HydrophobicContact CB-CG2 3.46Å; F115-T195 VanDerWaalsContact CB-CG2 3.46Å; F115-T195 HydrophobicContact CD2-CG2 3.68Å; F115-T195 HydrophobicContact CG-CG2 4.05Å
116L90.4Very high87.3Confident19 Ų1921.1 Ų21.110%0.09912%0.116CC..Hα-helixtrans-60.1-39176.2-72-179.6000111.9L57 A112 S113 V119 D120 Q143 V147L57-L116 HydrophobicContact CD1-CB 4.45Å; L57-L116 HydrophobicContact CD2-CB 3.81Å; L57-L116 HydrophobicContact CD2-CD1 4.06Å; A112-L116 WeakPolarHBondContact O-CB 3.37Å; A112-L116 WeakPolarHBondContact O-CG 3.42Å; A112-L116 PolarHBondContact O-N 3.36Å; S113-L116 PolarHBondContact O-N 2.87Å; L116-V119 PolarHBondContact O-N 3Å; L116-D120 WeakPolarHBondContact O-CB 3.35Å; L116-D120 PolarHBondContact O-N 2.88Å; L116-Q143 HydrophobicContact CD1-CB 3.99Å; L116-Q143 HydrophobicContact CD2-CB 4.01Å; L116-Q143 HydrophobicContact CD2-CG 4.05Å; L116-V147 HydrophobicContact CD1-CG2 3.62Å; L116-V147 HydrophobicContact CG-CG2 4.46Å
117L88.2Confident86.9Confident1 Ų123.8 Ų23.81%0.00513%0.132CC..Hα-helixtrans-60.1-45.1171.8-80.1165.9000111.5L57 I58 L61 S113 F115 V119 D120 R121 L235L57-L117 HydrophobicContact CB-CD1 4.46Å; L57-L117 HydrophobicContact CB-CD2 3.43Å; L57-L117 VanDerWaalsContact CB-CD2 3.43Å; L57-L117 HydrophobicContact CB-CG 3.72Å; L57-L117 HydrophobicContact CD1-CD2 4Å; L57-L117 HydrophobicContact CD1-CG 4.3Å; L57-L117 HydrophobicContact CG-CD2 4.37Å; I58-L117 HydrophobicContact CG1-CD1 4.42Å; I58-L117 HydrophobicContact CG1-CD2 4.08Å; L61-L117 HydrophobicContact CB-CD1 4.37Å; L61-L117 HydrophobicContact CD2-CD1 3.92Å; S113-L117 WeakPolarHBondContact O-CB 3.37Å; S113-L117 VanDerWaalsContact O-CG 3.26Å; S113-L117 WeakPolarHBondContact O-CG 3.4Å; S113-L117 PolarHBondContact O-N 3.3Å; F115-L117 VanDerWaalsContact C-N 3.28Å; F115-L117 PolarHBondContact O-N 2.74Å; L117-V119 PolarHBondContact O-N 3.19Å; L117-D120 PolarHBondContact O-N 2.86Å; L117-R121 WeakPolarHBondContact O-CB 3.5Å; L117-R121 VanDerWaalsContact O-CG 3.24Å; L117-R121 WeakPolarHBondContact O-CG 3.28Å; L117-R121 PolarHBondContact O-N 3.24Å; L117-L235 HydrophobicContact CD1-CD2 4.45Å
118A86.9Confident86.3Confident0 Ų026 Ų260%015%0.15CC..Hα-helixtrans-60.8-45.8178.700000111.4S114 F115 T122 V198 Y199S114-A118 PolarHBondContact O-N 3.36Å; F115-A118 WeakPolarHBondContact O-CB 3.33Å; F115-A118 PolarHBondContact O-N 2.71Å; A118-T122 WeakPolarHBondContact O-CB 3.29Å; A118-T122 PolarHBondContact O-N 3.37Å; A118-T122 PolarHBondContact O-OG1 3.41Å; A118-V198 HydrophobicContact CB-CB 4.38Å; A118-V198 HydrophobicContact CB-CG1 3.89Å; A118-Y199 HydrophobicContact CB-CD2 3.98Å; A118-Y199 HydrophobicContact CB-CE1 4.34Å; A118-Y199 HydrophobicContact CB-CE2 3.47Å; A118-Y199 VanDerWaalsContact CB-CE2 3.47Å; A118-Y199 PolarHBondContact N-OH 2.98Å
119V87.4Confident85.8Confident38 Ų3831.6 Ų31.623%0.2318%0.183CC..Hα-helixtrans-65.4-47.1177.7175.10000111.1F115 L116 L117 R121 T122 L123F115-V119 HydrophobicContact CD1-CG2 4.11Å; F115-V119 HydrophobicContact CE1-CG2 3.67Å; F115-V119 HydrophobicContact CE2-CG2 4.27Å; F115-V119 HydrophobicContact CZ-CG2 3.74Å; F115-V119 WeakPolarHBondContact O-CG2 3.19Å; F115-V119 PolarHBondContact O-N 2.73Å; L116-V119 PolarHBondContact O-N 3Å; L117-V119 PolarHBondContact O-N 3.19Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 3.43Å; V119-T122 WeakPolarHBondContact O-CA 3.25Å; V119-T122 WeakPolarHBondContact O-CB 3.42Å; V119-T122 PolarHBondContact O-N 3.45Å; V119-L123 HydrophobicContact CG1-CD1 3.94Å; V119-L123 HydrophobicContact CG1-CG 4.33Å; V119-L123 WeakPolarHBondContact O-CG 3.42Å; V119-L123 PolarHBondContact O-N 3.24Å
120D86.2Confident85.2Confident0 Ų036 Ų360%020%0.199CC..Hα-helixtrans-56.5-46.6177.2-17978.4000111.2L57 L116 L117 T122 L123 A124 Y131L57-D120 HydrophobicContact CD1-CB 3.83Å; L116-D120 WeakPolarHBondContact O-CB 3.35Å; L116-D120 PolarHBondContact O-N 2.88Å; L117-D120 PolarHBondContact O-N 2.86Å; D120-T122 VanDerWaalsContact C-N 3.33Å; D120-T122 PolarHBondContact O-N 2.86Å; D120-L123 PolarHBondContact O-N 3.19Å; D120-A124 VanDerWaalsContact O-CB 3.28Å; D120-A124 WeakPolarHBondContact O-CB 3.46Å; D120-A124 PolarHBondContact O-N 3.01Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.46Å; D120-Y131 PolarHBondContact OD1-OH 3.17Å
121R84.7Confident84.6Confident34 Ų3437.6 Ų37.613%0.12821%0.205CC..Hα-helixtrans-65.7-35.8175.8-65.7-44.5-176-172.8-1.7112.6S54 L117 V119 I125 L202 L232 L235S54-R121 PolarHBondContact OG-NH1 3.45Å; S54-R121 PolarHBondContact OG-NH2 2.99Å; L117-R121 WeakPolarHBondContact O-CB 3.5Å; L117-R121 VanDerWaalsContact O-CG 3.24Å; L117-R121 WeakPolarHBondContact O-CG 3.28Å; L117-R121 PolarHBondContact O-N 3.24Å; V119-R121 VanDerWaalsContact C-N 3.33Å; V119-R121 PolarHBondContact O-N 3.43Å; R121-I125 WeakPolarHBondContact O-CB 3.42Å; R121-I125 WeakPolarHBondContact O-CD1 3.49Å; R121-I125 VanDerWaalsContact O-CG1 3.27Å; R121-I125 WeakPolarHBondContact O-CG1 3.3Å; R121-I125 PolarHBondContact O-N 2.9Å; R121-L202 HydrophobicContact CB-CD1 4.21Å; R121-L232 HydrophobicContact CB-CD1 4.33Å; R121-L235 HydrophobicContact CG-CD1 4.47Å
122T83.8Confident84Confident38 Ų3844.3 Ų44.323%0.23324%0.241CC..Hα-helixtrans-63.4-51.8175.6-56.10000110.8A118 V119 D120 A124 I125 V126 V198 L202A118-T122 WeakPolarHBondContact O-CB 3.29Å; A118-T122 PolarHBondContact O-N 3.37Å; A118-T122 PolarHBondContact O-OG1 3.41Å; V119-T122 WeakPolarHBondContact O-CA 3.25Å; V119-T122 WeakPolarHBondContact O-CB 3.42Å; V119-T122 PolarHBondContact O-N 3.45Å; D120-T122 VanDerWaalsContact C-N 3.33Å; D120-T122 PolarHBondContact O-N 2.86Å; T122-A124 VanDerWaalsContact C-N 3.31Å; T122-A124 PolarHBondContact O-N 3.34Å; T122-I125 PolarHBondContact O-N 2.91Å; T122-I125 VanDerWaalsContact O-N 3.1Å; T122-V126 HydrophobicContact CG2-CG2 3.98Å; T122-V126 WeakPolarHBondContact O-CB 3.15Å; T122-V126 WeakPolarHBondContact O-CG2 3.48Å; T122-V126 PolarHBondContact O-N 3.2Å; T122-V198 VanDerWaalsContact OG1-CG1 3.23Å; T122-V198 WeakPolarHBondContact OG1-CG1 3.25Å; T122-L202 HydrophobicContact CG2-CD2 4.17Å; T122-L202 WeakPolarHBondContact OG1-CD1 3.2Å; T122-L202 WeakPolarHBondContact OG1-CG 2.91Å
123L83.8Confident83.3Confident48 Ų4853.7 Ų53.725%0.25128%0.275SS..Hα-helixtrans-61-40.9179.1-68.6173000111.8V119 D120 I125 T127 W130 Y131 Y135V119-L123 HydrophobicContact CG1-CD1 3.94Å; V119-L123 HydrophobicContact CG1-CG 4.33Å; V119-L123 WeakPolarHBondContact O-CG 3.42Å; V119-L123 PolarHBondContact O-N 3.24Å; D120-L123 PolarHBondContact O-N 3.19Å; L123-I125 PolarHBondContact O-N 3.01Å; L123-T127 CarbonylContact O-C 3.58Å; L123-T127 PolarHBondContact O-N 3.35Å; L123-T127 PolarHBondContact O-OG1 3.11Å; L123-W130 HydrophobicContact CD1-CZ3 4.48Å; L123-Y131 HydrophobicContact CB-CD2 4.3Å; L123-Y135 HydrophobicContact CD1-CE2 4.34Å
124A82.9Confident82.6Confident28 Ų2857.5 Ų57.523%0.23130%0.295CS..Hα-helixtrans-64.2-27.4177.400000113.5D120 T122 Y131D120-A124 VanDerWaalsContact O-CB 3.28Å; D120-A124 WeakPolarHBondContact O-CB 3.46Å; D120-A124 PolarHBondContact O-N 3.01Å; T122-A124 VanDerWaalsContact C-N 3.31Å; T122-A124 PolarHBondContact O-N 3.34Å; A124-Y131 HydrophobicContact CB-CD1 4.06Å; A124-Y131 HydrophobicContact CB-CD2 4.27Å; A124-Y131 HydrophobicContact CB-CE1 4.05Å; A124-Y131 HydrophobicContact CB-CE2 4.27Å; A124-Y131 HydrophobicContact CB-CG 4.18Å
125I78.1Confident81.8Confident45 Ų4557.8 Ų57.823%0.23130%0.296CS..Hα-helixtrans-93.6-42.7-178-70.2169000112.1R121 T122 L123 L202 V206 L232R121-I125 WeakPolarHBondContact O-CB 3.42Å; R121-I125 WeakPolarHBondContact O-CD1 3.49Å; R121-I125 VanDerWaalsContact O-CG1 3.27Å; R121-I125 WeakPolarHBondContact O-CG1 3.3Å; R121-I125 PolarHBondContact O-N 2.9Å; T122-I125 PolarHBondContact O-N 2.91Å; T122-I125 VanDerWaalsContact O-N 3.1Å; L123-I125 PolarHBondContact O-N 3.01Å; I125-L202 HydrophobicContact CB-CD2 4.46Å; I125-L202 HydrophobicContact CD1-CD2 4.03Å; I125-V206 HydrophobicContact CD1-CG2 3.86Å; I125-V206 HydrophobicContact CG2-CG2 4.24Å; I125-L232 HydrophobicContact CD1-CD1 3.2Å
126V80Confident81.1Confident80 Ų8062.3 Ų62.349%0.48532%0.316SS..Hα-helixtrans-76.1-44.9-176.5179.50000110.5T122 P128T122-V126 HydrophobicContact CG2-CG2 3.98Å; T122-V126 WeakPolarHBondContact O-CB 3.15Å; T122-V126 WeakPolarHBondContact O-CG2 3.48Å; T122-V126 PolarHBondContact O-N 3.2Å; V126-P128 WeakPolarHBondContact O-CD 3.44Å
127T81.8Confident80.5Confident55 Ų5565.4 Ų65.434%0.33733%0.332SS..  trans-126.666-173.653.50000112L123 V129 W130 Y131L123-T127 CarbonylContact O-C 3.58Å; L123-T127 PolarHBondContact O-N 3.35Å; L123-T127 PolarHBondContact O-OG1 3.11Å; T127-V129 VanDerWaalsContact C-N 3.32Å; T127-V129 PolarHBondContact O-N 2.81Å; T127-W130 PolarHBondContact O-N 3.36Å; T127-Y131 VanDerWaalsContact O-CB 3.28Å; T127-Y131 WeakPolarHBondContact O-CB 3.37Å; T127-Y131 PolarHBondContact O-N 3.43Å
128P78Confident80Confident74 Ų7469.8 Ų69.848%0.48136%0.363SS..Hα-helixtrans-64.7-33.4-174.126-34.9000113.5V126 N132V126-P128 WeakPolarHBondContact O-CD 3.44Å; P128-N132 WeakPolarHBondContact O-CB 3.28Å; P128-N132 PolarHBondContact O-N 3.42Å
129V78.7Confident79.8Confident117 Ų11776.8 Ų76.871%0.70939%0.39SS*.Hα-helixtrans-66.2-50.5-179.4-179.50000110.5T127 N132 R133T127-V129 VanDerWaalsContact C-N 3.32Å; T127-V129 PolarHBondContact O-N 2.81Å; V129-N132 PolarHBondContact O-N 3.12Å; V129-R133 WeakPolarHBondContact O-CB 3.29Å; V129-R133 PolarHBondContact O-N 2.9Å; V129-R133 VanDerWaalsContact O-N 3.1Å
130W79.2Confident79.6Confident109 Ų10975 Ų7541%0.41338%0.379SS..Hα-helixtrans-63.6-43.8176.4-177.882.5000111.4L123 T127 N132 R133 D134 Y135L123-W130 HydrophobicContact CD1-CZ3 4.48Å; T127-W130 PolarHBondContact O-N 3.36Å; W130-N132 VanDerWaalsContact C-N 3.27Å; W130-N132 PolarHBondContact O-N 3.04Å; W130-R133 PolarHBondContact O-N 3.12Å; W130-D134 HydrophobicContact CD2-CB 4.45Å; W130-D134 HydrophobicContact CG-CB 4.32Å; W130-D134 PolarHBondContact NE1-OD2 3.41Å; W130-D134 PolarHBondContact O-N 3.26Å; W130-Y135 AromaticContact CH2-CD2 3.85Å; W130-Y135 HydrophobicContact CH2-CD2 3.85Å; W130-Y135 AromaticContact CZ3-CD2 3.71Å; W130-Y135 HydrophobicContact CZ3-CD2 3.71Å; W130-Y135 HydrophobicContact CZ3-CE2 4.43Å; W130-Y135 PolarHBondContact O-N 2.95Å
131Y79.1Confident79.6Confident37 Ų3781.8 Ų81.815%0.14541%0.405CS..Hα-helixtrans-60-35.4178.8-177.1-94.7000112.9D120 L123 A124 T127 Y135D120-Y131 WeakPolarHBondContact OD1-CE2 3.46Å; D120-Y131 PolarHBondContact OD1-OH 3.17Å; L123-Y131 HydrophobicContact CB-CD2 4.3Å; A124-Y131 HydrophobicContact CB-CD1 4.06Å; A124-Y131 HydrophobicContact CB-CD2 4.27Å; A124-Y131 HydrophobicContact CB-CE1 4.05Å; A124-Y131 HydrophobicContact CB-CE2 4.27Å; A124-Y131 HydrophobicContact CB-CG 4.18Å; T127-Y131 VanDerWaalsContact O-CB 3.28Å; T127-Y131 WeakPolarHBondContact O-CB 3.37Å; T127-Y131 PolarHBondContact O-N 3.43Å; Y131-Y135 HydrophobicContact CD2-CD1 4.13Å; Y131-Y135 HydrophobicContact CD2-CD2 4.3Å; Y131-Y135 AromaticContact CD2-CG 3.98Å; Y131-Y135 HydrophobicContact CD2-CG 3.98Å; Y131-Y135 AromaticContact CE2-CD1 3.69Å; Y131-Y135 HydrophobicContact CE2-CD1 3.69Å; Y131-Y135 HydrophobicContact CE2-CD2 4.47Å; Y131-Y135 AromaticContact CE2-CE1 3.85Å; Y131-Y135 HydrophobicContact CE2-CE1 3.85Å; Y131-Y135 HydrophobicContact CE2-CG 4.02Å; Y131-Y135 WeakPolarHBondContact O-CB 3.32Å
132N75.6Confident79.8Confident141 Ų14182.1 Ų82.175%0.75442%0.419SS*.Hα-helixtrans-81.1-33.4178.7-158.838.8000113.1P128 V129 W130P128-N132 WeakPolarHBondContact O-CB 3.28Å; P128-N132 PolarHBondContact O-N 3.42Å; V129-N132 PolarHBondContact O-N 3.12Å; W130-N132 VanDerWaalsContact C-N 3.27Å; W130-N132 PolarHBondContact O-N 3.04Å
133R76.6Confident80Confident205 Ų20581.3 Ų81.377%0.77441%0.413SS*.Hα-helixtrans-90.4-47-173.2-167.6177.2-179.2163.8-0.7113.5V129 W130V129-R133 WeakPolarHBondContact O-CB 3.29Å; V129-R133 PolarHBondContact O-N 2.9Å; V129-R133 VanDerWaalsContact O-N 3.1Å; W130-R133 PolarHBondContact O-N 3.12Å
134D75.1Confident80.2Confident83 Ų8381.2 Ų81.244%0.44441%0.411SS..THydrogen-bonded Turntrans-107.9-20.9-165.5-63.4-30.8000113.3W130 K136W130-D134 HydrophobicContact CD2-CB 4.45Å; W130-D134 HydrophobicContact CG-CB 4.32Å; W130-D134 PolarHBondContact NE1-OD2 3.41Å; W130-D134 PolarHBondContact O-N 3.26Å; D134-K136 PolarHBondContact O-N 3.5Å
135Y72Confident80.6Confident5 Ų584.4 Ų84.42%0.0243%0.427CS..  trans-71.679.2177.7-159-102.4000110.6K53 L123 W130 Y131 W139 Q143K53-Y135 HydrophobicContact CD-CD1 3.82Å; K53-Y135 HydrophobicContact CD-CE1 4.17Å; K53-Y135 PolarHBondContact NZ-O 2.85Å; L123-Y135 HydrophobicContact CD1-CE2 4.34Å; W130-Y135 AromaticContact CH2-CD2 3.85Å; W130-Y135 HydrophobicContact CH2-CD2 3.85Å; W130-Y135 AromaticContact CZ3-CD2 3.71Å; W130-Y135 HydrophobicContact CZ3-CD2 3.71Å; W130-Y135 HydrophobicContact CZ3-CE2 4.43Å; W130-Y135 PolarHBondContact O-N 2.95Å; Y131-Y135 HydrophobicContact CD2-CD1 4.13Å; Y131-Y135 HydrophobicContact CD2-CD2 4.3Å; Y131-Y135 AromaticContact CD2-CG 3.98Å; Y131-Y135 HydrophobicContact CD2-CG 3.98Å; Y131-Y135 AromaticContact CE2-CD1 3.69Å; Y131-Y135 HydrophobicContact CE2-CD1 3.69Å; Y131-Y135 HydrophobicContact CE2-CD2 4.47Å; Y131-Y135 AromaticContact CE2-CE1 3.85Å; Y131-Y135 HydrophobicContact CE2-CE1 3.85Å; Y131-Y135 HydrophobicContact CE2-CG 4.02Å; Y131-Y135 WeakPolarHBondContact O-CB 3.32Å; Y135-W139 AromaticContact CD2-CD1 3.92Å; Y135-W139 HydrophobicContact CD2-CG 4.3Å; Y135-W139 HydrophobicContact CE2-CB 4.44Å; Y135-W139 AromaticContact CE2-CD1 3.08Å; Y135-W139 AromaticContact CE2-CG 3.86Å; Y135-W139 HydrophobicContact CE2-CG 3.86Å; Y135-W139 AromaticContact CE2-NE1 3.53Å; Y135-W139 AromaticContact CZ-CD1 3.37Å; Y135-Q143 PolarHBondContact OH-NE2 2.85Å; Y135-Q143 PolarHBondContact OH-OE1 3.42Å
136K74.7Confident81.2Confident151 Ų15188 Ų8866%0.65745%0.446SS*.  trans-71.4154.4177.8-68.7177.9-178.7176.80110.6D134 S138 W139D134-K136 PolarHBondContact O-N 3.5Å; K136-S138 PolarHBondContact O-N 3.37Å; K136-W139 PolarHBondContact O-N 3.47Å
137N76.6Confident81.8Confident85 Ų8584.6 Ų84.646%0.45543%0.426SS..Hα-helixtrans-54.9-28.5175.4-68.3-3.3000112.4K53 W139 L140 Y141K53-N137 VanDerWaalsContact CE-OD1 3.24Å; K53-N137 WeakPolarHBondContact CE-OD1 3.42Å; N137-W139 VanDerWaalsContact C-N 3.26Å; N137-W139 PolarHBondContact O-N 3.27Å; N137-L140 WeakPolarHBondContact O-CB 3.36Å; N137-L140 PolarHBondContact O-N 3.48Å; N137-L140 VanDerWaalsContact O-N 3.14Å; N137-Y141 HydrophobicContact CB-CD2 4.25Å; N137-Y141 HydrophobicContact CB-CE2 3.91Å; N137-Y141 WeakPolarHBondContact O-CD2 3.45Å; N137-Y141 PolarHBondContact O-N 3.47Å
138S78Confident82.3Confident93 Ų9387.2 Ų87.265%0.6544%0.437SS*.Hα-helixtrans-54.1-37.8173.8175.20000113.4K136 Y141 G142K136-S138 PolarHBondContact O-N 3.37Å; S138-Y141 PolarHBondContact O-N 3.4Å; S138-G142 PolarHBondContact O-N 2.99Å
139W82.9Confident83Confident147 Ų14790.2 Ų90.256%0.55744%0.443SS*.Hα-helixtrans-67.7-43177.5-177.6-87.6000111.9Y135 K136 N137 Y141 G142 Q143Y135-W139 AromaticContact CD2-CD1 3.92Å; Y135-W139 HydrophobicContact CD2-CG 4.3Å; Y135-W139 HydrophobicContact CE2-CB 4.44Å; Y135-W139 AromaticContact CE2-CD1 3.08Å; Y135-W139 AromaticContact CE2-CG 3.86Å; Y135-W139 HydrophobicContact CE2-CG 3.86Å; Y135-W139 AromaticContact CE2-NE1 3.53Å; Y135-W139 AromaticContact CZ-CD1 3.37Å; K136-W139 PolarHBondContact O-N 3.47Å; N137-W139 VanDerWaalsContact C-N 3.26Å; N137-W139 PolarHBondContact O-N 3.27Å; W139-Y141 VanDerWaalsContact C-N 3.34Å; W139-Y141 PolarHBondContact O-N 3.33Å; W139-G142 PolarHBondContact O-N 2.64Å; W139-G142 VanDerWaalsContact O-N 3.16Å; W139-Q143 VanDerWaalsContact NE1-NE2 3.1Å; W139-Q143 WeakPolarHBondContact O-CG 3.31Å; W139-Q143 PolarHBondContact O-N 3.37Å
140L84.1Confident83.5Confident1 Ų187 Ų871%0.00542%0.418CS..Hα-helixtrans-61.5-43.5176.1-17274.7000111.1K53 L56 L57 N137 G142 Q143 F144K53-L140 HydrophobicContact CB-CD2 4.1Å; K53-L140 HydrophobicContact CG-CD2 4.44Å; L56-L140 HydrophobicContact CB-CD2 4.22Å; L56-L140 HydrophobicContact CD1-CD2 3.67Å; L57-L140 HydrophobicContact CD1-CD1 4.14Å; L57-L140 HydrophobicContact CD2-CD1 4.21Å; L57-L140 HydrophobicContact CG-CD1 4.04Å; N137-L140 WeakPolarHBondContact O-CB 3.36Å; N137-L140 PolarHBondContact O-N 3.48Å; N137-L140 VanDerWaalsContact O-N 3.14Å; L140-G142 VanDerWaalsContact C-N 3.32Å; L140-G142 PolarHBondContact O-N 3.37Å; L140-Q143 WeakPolarHBondContact O-CB 3.45Å; L140-Q143 PolarHBondContact O-N 3.48Å; L140-F144 HydrophobicContact CD1-CE2 4.34Å; L140-F144 HydrophobicContact CD2-CE2 4.29Å; L140-F144 HydrophobicContact CG-CD2 4.2Å; L140-F144 HydrophobicContact CG-CE2 3.95Å; L140-F144 VanDerWaalsContact O-CD2 3.28Å; L140-F144 WeakPolarHBondContact O-CD2 3.49Å; L140-F144 PolarHBondContact O-N 3.37Å
141Y86.5Confident84Confident141 Ų14182.4 Ų82.455%0.55340%0.401SS*.Hα-helixtrans-62.8-39.5174-70.3-63.3000112N137 S138 W139 Q143 F144 V145N137-Y141 HydrophobicContact CB-CD2 4.25Å; N137-Y141 HydrophobicContact CB-CE2 3.91Å; N137-Y141 WeakPolarHBondContact O-CD2 3.45Å; N137-Y141 PolarHBondContact O-N 3.47Å; S138-Y141 PolarHBondContact O-N 3.4Å; W139-Y141 VanDerWaalsContact C-N 3.34Å; W139-Y141 PolarHBondContact O-N 3.33Å; Y141-Q143 VanDerWaalsContact C-N 3.32Å; Y141-Q143 PolarHBondContact O-N 3.15Å; Y141-F144 PolarHBondContact O-N 3.42Å; Y141-V145 WeakPolarHBondContact O-CG2 3.27Å; Y141-V145 PolarHBondContact O-N 3.15Å
142G87.6Confident84.6Confident41 Ų4183 Ų8342%0.42341%0.414SS..Hα-helixtrans-58.7-41.4173.200000112.8S138 W139 L140 V145 L146S138-G142 PolarHBondContact O-N 2.99Å; W139-G142 PolarHBondContact O-N 2.64Å; W139-G142 VanDerWaalsContact O-N 3.16Å; L140-G142 VanDerWaalsContact C-N 3.32Å; L140-G142 PolarHBondContact O-N 3.37Å; G142-V145 PolarHBondContact O-N 3.32Å; G142-L146 WeakPolarHBondContact O-CB 3.47Å; G142-L146 PolarHBondContact O-N 2.97Å
143Q88Confident85.2Confident22 Ų2280.8 Ų80.810%0.10340%0.402CS..Hα-helixtrans-62.1-44.2173.8-69.6177.5-25.600111.9L116 Y135 W139 L140 Y141 L146 V147L116-Q143 HydrophobicContact CD1-CB 3.99Å; L116-Q143 HydrophobicContact CD2-CB 4.01Å; L116-Q143 HydrophobicContact CD2-CG 4.05Å; Y135-Q143 PolarHBondContact OH-NE2 2.85Å; Y135-Q143 PolarHBondContact OH-OE1 3.42Å; W139-Q143 VanDerWaalsContact NE1-NE2 3.1Å; W139-Q143 WeakPolarHBondContact O-CG 3.31Å; W139-Q143 PolarHBondContact O-N 3.37Å; L140-Q143 WeakPolarHBondContact O-CB 3.45Å; L140-Q143 PolarHBondContact O-N 3.48Å; Y141-Q143 VanDerWaalsContact C-N 3.32Å; Y141-Q143 PolarHBondContact O-N 3.15Å; Q143-L146 PolarHBondContact O-N 3.26Å; Q143-V147 WeakPolarHBondContact O-CG2 2.81Å; Q143-V147 PolarHBondContact O-N 2.95Å
144F88.9Confident85.6Confident45 Ų4571.3 Ų71.320%0.19737%0.366CS..Hα-helixtrans-62.7-44176-83-66000112.7L56 L57 A60 L140 Y141 L146 V147 L148L56-F144 HydrophobicContact CB-CE2 4.4Å; L57-F144 HydrophobicContact CD2-CE1 4.33Å; L57-F144 HydrophobicContact CD2-CE2 4.17Å; L57-F144 HydrophobicContact CD2-CZ 3.76Å; L57-F144 HydrophobicContact CG-CZ 4.45Å; A60-F144 HydrophobicContact CB-CE1 3.52Å; A60-F144 HydrophobicContact CB-CZ 3.96Å; L140-F144 HydrophobicContact CD1-CE2 4.34Å; L140-F144 HydrophobicContact CD2-CE2 4.29Å; L140-F144 HydrophobicContact CG-CD2 4.2Å; L140-F144 HydrophobicContact CG-CE2 3.95Å; L140-F144 VanDerWaalsContact O-CD2 3.28Å; L140-F144 WeakPolarHBondContact O-CD2 3.49Å; L140-F144 PolarHBondContact O-N 3.37Å; Y141-F144 PolarHBondContact O-N 3.42Å; F144-L146 VanDerWaalsContact C-N 3.28Å; F144-L146 PolarHBondContact O-N 2.93Å; F144-V147 PolarHBondContact O-N 3.4Å; F144-L148 WeakPolarHBondContact O-CG 2.7Å; F144-L148 PolarHBondContact O-N 2.74Å
145V90.5Very high86.1Confident96 Ų9668.3 Ų68.358%0.58235%0.35SS*.Hα-helixtrans-60.4-41.5176.21710000110.6Y141 G142 L148 F149Y141-V145 WeakPolarHBondContact O-CG2 3.27Å; Y141-V145 PolarHBondContact O-N 3.15Å; G142-V145 PolarHBondContact O-N 3.32Å; V145-L148 PolarHBondContact O-N 3.44Å; V145-F149 WeakPolarHBondContact O-CB 3.36Å; V145-F149 PolarHBondContact O-N 2.83Å
146L91.5Very high86.8Confident120 Ų12072 Ų7263%0.62837%0.373SS*.Hα-helixtrans-64-40.4176.4-172.4148000112G142 Q143 F144 F149 Y150G142-L146 WeakPolarHBondContact O-CB 3.47Å; G142-L146 PolarHBondContact O-N 2.97Å; Q143-L146 PolarHBondContact O-N 3.26Å; F144-L146 VanDerWaalsContact C-N 3.28Å; F144-L146 PolarHBondContact O-N 2.93Å; L146-F149 PolarHBondContact O-N 3.08Å; L146-Y150 WeakPolarHBondContact O-CB 3.23Å; L146-Y150 PolarHBondContact O-N 2.86Å
147V91.6Very high87.2Confident9 Ų965.4 Ų65.46%0.05535%0.348CS..Hα-helixtrans-64-44.8174.9171.10000111.3L109 A112 L116 Q143 F144 F149 Y150 I151L109-V147 HydrophobicContact CD1-CG1 3.99Å; A112-V147 HydrophobicContact CB-CB 4.4Å; A112-V147 HydrophobicContact CB-CG1 3.65Å; A112-V147 HydrophobicContact CB-CG2 3.82Å; L116-V147 HydrophobicContact CD1-CG2 3.62Å; L116-V147 HydrophobicContact CG-CG2 4.46Å; Q143-V147 WeakPolarHBondContact O-CG2 2.81Å; Q143-V147 PolarHBondContact O-N 2.95Å; F144-V147 PolarHBondContact O-N 3.4Å; V147-F149 VanDerWaalsContact C-N 3.31Å; V147-F149 PolarHBondContact O-N 3.48Å; V147-Y150 WeakPolarHBondContact O-CB 3.26Å; V147-Y150 PolarHBondContact O-N 3.18Å; V147-I151 HydrophobicContact CG1-CD1 3.85Å; V147-I151 HydrophobicContact CG1-CG1 4.45Å; V147-I151 VanDerWaalsContact O-CG1 3.28Å; V147-I151 WeakPolarHBondContact O-CG1 3.35Å; V147-I151 PolarHBondContact O-N 2.88Å
148L92.3Very high87.4Confident110 Ų11061.7 Ų61.758%0.57633%0.328SS*.Hα-helixtrans-62.2-40.7176.2-69.1174.9000111.6F144 V145 I151 A152F144-L148 WeakPolarHBondContact O-CG 2.7Å; F144-L148 PolarHBondContact O-N 2.74Å; V145-L148 PolarHBondContact O-N 3.44Å; L148-I151 PolarHBondContact O-N 2.95Å; L148-A152 WeakPolarHBondContact O-CB 3.33Å; L148-A152 PolarHBondContact O-N 2.88Å
149F92.3Very high87.6Confident136 Ų13661.9 Ų61.960%0.59632%0.315SS*.Hα-helixtrans-63.2-43.5174.8-177.6-98.9000111.7V145 L146 V147 A152 L153V145-F149 WeakPolarHBondContact O-CB 3.36Å; V145-F149 PolarHBondContact O-N 2.83Å; L146-F149 PolarHBondContact O-N 3.08Å; V147-F149 VanDerWaalsContact C-N 3.31Å; V147-F149 PolarHBondContact O-N 3.48Å; F149-A152 PolarHBondContact O-N 3.26Å; F149-L153 HydrophobicContact CE1-CD1 3.75Å; F149-L153 HydrophobicContact CZ-CD1 3.98Å; F149-L153 WeakPolarHBondContact O-CB 3.2Å; F149-L153 PolarHBondContact O-N 3.34Å
150Y90.1Very high87.6Confident50 Ų5061 Ų6120%0.19632%0.321CS..Hα-helixtrans-60.5-47175.3175.6-114.3000111.9I108 L146 V147 A152 L153 I154 V187I108-Y150 HydrophobicContact CG2-CD1 3.67Å; I108-Y150 HydrophobicContact CG2-CE1 3.57Å; L146-Y150 WeakPolarHBondContact O-CB 3.23Å; L146-Y150 PolarHBondContact O-N 2.86Å; V147-Y150 WeakPolarHBondContact O-CB 3.26Å; V147-Y150 PolarHBondContact O-N 3.18Å; Y150-A152 VanDerWaalsContact C-N 3.33Å; Y150-A152 PolarHBondContact O-N 2.92Å; Y150-L153 PolarHBondContact O-N 3.2Å; Y150-I154 HydrophobicContact CD2-CG1 4.07Å; Y150-I154 HydrophobicContact CE1-CG1 4.4Å; Y150-I154 HydrophobicContact CE2-CD1 3.9Å; Y150-I154 HydrophobicContact CE2-CG1 3.62Å; Y150-I154 WeakPolarHBondContact O-CG1 3.37Å; Y150-I154 PolarHBondContact O-N 3.32Å; Y150-V187 HydrophobicContact CE2-CG1 4.39Å; Y150-V187 WeakPolarHBondContact OH-CG1 3.48Å
151I90.3Very high87.4Confident12 Ų1263 Ų636%0.06234%0.335CS..Hα-helixtrans-57.7-47.1175.6-70166.1000110.6V105 I108 L109 V147 L148 N155V105-I151 HydrophobicContact CB-CG2 4.27Å; V105-I151 HydrophobicContact CG1-CG2 4.14Å; V105-I151 HydrophobicContact CG2-CG2 3.74Å; I108-I151 HydrophobicContact CB-CG1 4Å; I108-I151 HydrophobicContact CG2-CD1 4.31Å; I108-I151 HydrophobicContact CG2-CG1 3.44Å; I108-I151 VanDerWaalsContact CG2-CG1 3.44Å; L109-I151 HydrophobicContact CB-CD1 4.29Å; L109-I151 HydrophobicContact CD1-CD1 4.32Å; V147-I151 HydrophobicContact CG1-CD1 3.85Å; V147-I151 HydrophobicContact CG1-CG1 4.45Å; V147-I151 VanDerWaalsContact O-CG1 3.28Å; V147-I151 WeakPolarHBondContact O-CG1 3.35Å; V147-I151 PolarHBondContact O-N 2.88Å; L148-I151 PolarHBondContact O-N 2.95Å; I151-N155 WeakPolarHBondContact O-CB 3.48Å; I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-ND2 2.94Å
152A90.4Very high86.8Confident49 Ų4956.3 Ų56.341%0.40531%0.309SS..Hα-helixtrans-62.6-45.3179.300000111.5L148 F149 Y150 I154 N155 V156L148-A152 WeakPolarHBondContact O-CB 3.33Å; L148-A152 PolarHBondContact O-N 2.88Å; F149-A152 PolarHBondContact O-N 3.26Å; Y150-A152 VanDerWaalsContact C-N 3.33Å; Y150-A152 PolarHBondContact O-N 2.92Å; A152-I154 PolarHBondContact O-N 3.41Å; A152-N155 PolarHBondContact O-N 2.97Å; A152-V156 VanDerWaalsContact O-CB 3.23Å; A152-V156 WeakPolarHBondContact O-CB 3.17Å; A152-V156 WeakPolarHBondContact O-CG2 3.05Å; A152-V156 PolarHBondContact O-N 2.63Å
153L88.8Confident86Confident95 Ų9559.9 Ų59.950%0.49732%0.318SS..Hα-helixtrans-63.2-43.9-178.4-167.6149000111.9F149 Y150 G157F149-L153 HydrophobicContact CE1-CD1 3.75Å; F149-L153 HydrophobicContact CZ-CD1 3.98Å; F149-L153 WeakPolarHBondContact O-CB 3.2Å; F149-L153 PolarHBondContact O-N 3.34Å; Y150-L153 PolarHBondContact O-N 3.2Å; L153-G157 PolarHBondContact O-N 3.41Å
154I85.5Confident85.3Confident6 Ų665.3 Ų65.33%0.03134%0.343CS..Hα-helixtrans-64.3-50177.1-68.1-66.3000111I108 Y150 A152 G157 M158 E184I108-I154 HydrophobicContact CD1-CB 4.29Å; I108-I154 HydrophobicContact CD1-CG2 3.88Å; Y150-I154 HydrophobicContact CD2-CG1 4.07Å; Y150-I154 HydrophobicContact CE1-CG1 4.4Å; Y150-I154 HydrophobicContact CE2-CD1 3.9Å; Y150-I154 HydrophobicContact CE2-CG1 3.62Å; Y150-I154 WeakPolarHBondContact O-CG1 3.37Å; Y150-I154 PolarHBondContact O-N 3.32Å; A152-I154 PolarHBondContact O-N 3.41Å; I154-G157 PolarHBondContact O-N 3.34Å; I154-M158 HydrophobicContact CG2-CE 3.98Å; I154-M158 WeakPolarHBondContact O-CG 3.41Å; I154-M158 PolarHBondContact O-N 2.92Å; I154-E184 HydrophobicContact CG2-CB 4.43Å; I154-E184 HydrophobicContact CG2-CG 4.04Å
155N85.3Confident84.7Confident20 Ų2068.6 Ų68.611%0.10736%0.359CS..Hα-helixtrans-69-41-176.5-77.5-78.5000113L101 S104 I151 A152 M158 Y159L101-N155 HydrophobicContact CD1-CB 3.78Å; L101-N155 VanDerWaalsContact CD1-OD1 3.25Å; L101-N155 WeakPolarHBondContact CD1-OD1 3.38Å; S104-N155 PolarHBondContact OG-OD1 3.23Å; I151-N155 WeakPolarHBondContact O-CB 3.48Å; I151-N155 PolarHBondContact O-N 3.4Å; I151-N155 PolarHBondContact O-ND2 2.94Å; A152-N155 PolarHBondContact O-N 2.97Å; N155-M158 PolarHBondContact O-N 3.12Å; N155-Y159 WeakPolarHBondContact O-CB 3.49Å; N155-Y159 PolarHBondContact O-N 2.96Å
156V87.2Confident84.1Confident83 Ų8368 Ų6850%0.50335%0.353SS..Hα-helixtrans-66.4-41.3174.6173.10000110.4A152 Y159 L160A152-V156 VanDerWaalsContact O-CB 3.23Å; A152-V156 WeakPolarHBondContact O-CB 3.17Å; A152-V156 WeakPolarHBondContact O-CG2 3.05Å; A152-V156 PolarHBondContact O-N 2.63Å; V156-Y159 PolarHBondContact O-N 3.35Å; V156-L160 HydrophobicContact CG1-CD1 3.75Å; V156-L160 HydrophobicContact CG1-CG 4.16Å; V156-L160 WeakPolarHBondContact O-CB 3.48Å; V156-L160 WeakPolarHBondContact O-CG 3.33Å; V156-L160 PolarHBondContact O-N 2.91Å
157G83.3Confident83.4Confident13 Ų1362.8 Ų62.813%0.13433%0.325CS..Hα-helixtrans-58.9-47.5175.600000112.4L153 I154 Y159 L160 S161L153-G157 PolarHBondContact O-N 3.41Å; I154-G157 PolarHBondContact O-N 3.34Å; G157-Y159 PolarHBondContact O-N 3.4Å; G157-L160 PolarHBondContact O-N 3.47Å; G157-S161 WeakPolarHBondContact O-CB 3.32Å; G157-S161 PolarHBondContact O-N 3.29Å
158M80.1Confident82.5Confident7 Ų763.4 Ų63.43%0.03433%0.33CS..Hα-helixtrans-59.8-44.3174.3-74.5-166.1-68.400112.2I154 N155 S162 F180 L181I154-M158 HydrophobicContact CG2-CE 3.98Å; I154-M158 WeakPolarHBondContact O-CG 3.41Å; I154-M158 PolarHBondContact O-N 2.92Å; N155-M158 PolarHBondContact O-N 3.12Å; M158-S162 WeakPolarHBondContact O-CB 3.43Å; M158-S162 PolarHBondContact O-N 3.33Å; M158-S162 PolarHBondContact O-OG 3.49Å; M158-F180 HydrophobicContact CG-CB 4.42Å; M158-L181 HydrophobicContact SD-CD1 4.41Å
159Y82.1Confident81.6Confident97 Ų9758.9 Ų58.938%0.3831%0.305SS..Hα-helixtrans-64.3-44.3-179.4-173.3-92.5000112.4R94 N155 V156 G157 S162R94-Y159 HydrophobicContact CB-CE2 4.28Å; R94-Y159 HydrophobicContact CG-CE2 4.36Å; N155-Y159 WeakPolarHBondContact O-CB 3.49Å; N155-Y159 PolarHBondContact O-N 2.96Å; V156-Y159 PolarHBondContact O-N 3.35Å; G157-Y159 PolarHBondContact O-N 3.4Å; Y159-S162 PolarHBondContact O-N 3.12Å
160L83.6Confident80.8Confident129 Ų12952.6 Ų52.668%0.67528%0.278SS*.Hα-helixtrans-70.4-35.4-179.6-68.9176.6000112.8V156 G157 S162V156-L160 HydrophobicContact CG1-CD1 3.75Å; V156-L160 HydrophobicContact CG1-CG 4.16Å; V156-L160 WeakPolarHBondContact O-CB 3.48Å; V156-L160 WeakPolarHBondContact O-CG 3.33Å; V156-L160 PolarHBondContact O-N 2.91Å; G157-L160 PolarHBondContact O-N 3.47Å; L160-S162 PolarHBondContact O-N 2.95Å
161S79.5Confident79.9Confident42 Ų4251.5 Ų51.529%0.29428%0.277SS..Hα-helixtrans-73.6-13.6177.7-173.70000113.5G157 F180G157-S161 WeakPolarHBondContact O-CB 3.32Å; G157-S161 PolarHBondContact O-N 3.29Å; S161-F180 VanDerWaalsContact CB-CD2 3.46Å; S161-F180 WeakPolarHBondContact OG-CD2 3.23Å
162S74.4Confident78.4Confident1 Ų153.4 Ų53.41%0.00729%0.286CS..  trans-86.9121.7-170.6-67.90000112.6R94 L97 M158 Y159 L160 N178R94-S162 PolarHBondContact NE-O 3.4Å; R94-S162 PolarHBondContact NH2-O 3.08Å; L97-S162 WeakPolarHBondContact CD1-OG 3.01Å; M158-S162 WeakPolarHBondContact O-CB 3.43Å; M158-S162 PolarHBondContact O-N 3.33Å; M158-S162 PolarHBondContact O-OG 3.49Å; Y159-S162 PolarHBondContact O-N 3.12Å; L160-S162 PolarHBondContact O-N 2.95Å; S162-N178 PolarHBondContact OG-ND2 2.87Å
163N71.5Confident76.9Confident115 Ų11554.1 Ų54.162%0.61528%0.282SS*.  trans-72.7158.6173.2-73.7-26.4000111.9Q165N163-Q165 VanDerWaalsContact C-N 3.26Å; N163-Q165 PolarHBondContact O-N 3.3Å
164H72.5Confident75.2Confident136 Ų13651.8 Ų51.863%0.6327%0.273SS*.SBendtrans-77.178.4171-67.8-74.3000109.6R94R94-H164 PolarHBondContact NH1-CE1 3.38Å; R94-H164 PolarHBondContact NH1-NE2 2.9Å
165Q75.6Confident73.6Confident115 Ų11552.3 Ų52.354%0.53728%0.278SS..  trans-120.5139.9174.8-168.9170.88.200109.8L93 N163L93-Q165 WeakPolarHBondContact CB-O 3.49Å; L93-Q165 PolarHBondContact N-O 3.42Å; N163-Q165 VanDerWaalsContact C-N 3.26Å; N163-Q165 PolarHBondContact O-N 3.3Å
166D77.5Confident72.1Confident83 Ų8357.7 Ų57.744%0.44430%0.297SS..EExtended strand (participates in β ladder)trans-82.5130.9177-60.3-26.3000109.3L7 V90 N92L7-D166 HydrophobicContact CD2-CB 3.78Å; V90-D166 HydrophobicContact CG1-CB 4.11Å; N92-D166 PolarHBondContact OD1-OD1 2.98Å; N92-D166 VanDerWaalsContact OD1-OD1 3.05Å
167I77.3Confident70.6Confident10 Ų1061.3 Ų61.35%0.05131%0.308CS..EExtended strand (participates in β ladder)trans-113.6143178.653.7167.7000109.6V90 M91 L93 C96 Y169 S174V90-I167 WeakPolarHBondContact CA-O 3.5Å; M91-I167 PolarHBondContact N-O 2.78Å; M91-I167 VanDerWaalsContact N-O 3.13Å; M91-I167 WeakPolarHBondContact O-CG1 3.38Å; M91-I167 PolarHBondContact O-N 3.12Å; L93-I167 HydrophobicContact CD1-CD1 4.06Å; L93-I167 HydrophobicContact CD1-CG2 4.37Å; C96-I167 HydrophobicContact CB-CD1 3.74Å; I167-Y169 VanDerWaalsContact C-N 3.29Å; I167-Y169 PolarHBondContact O-N 2.86Å; I167-S174 WeakPolarHBondContact CD1-OG 3.39Å
168P73Confident69.7Low23 Ų2361.6 Ų61.615%0.14931%0.307CS..SBendtrans-71.6-25.9-174.428.2-33.9000112.6L7 I10 S11 I14 C89L7-P168 HydrophobicContact CD1-CB 3.97Å; L7-P168 HydrophobicContact CD1-CG 4.28Å; L7-P168 HydrophobicContact CG-CB 4.31Å; I10-P168 HydrophobicContact CG2-CB 3.97Å; I10-P168 HydrophobicContact CG2-CG 4.18Å; S11-P168 WeakPolarHBondContact CB-O 3.47Å; I14-P168 HydrophobicContact CD1-CB 4.43Å; I14-P168 HydrophobicContact CD1-CG 4.27Å; C89-P168 CarbonylContact C-O 3.14Å
169Y74.2Confident69.2Low15 Ų1569 Ų696%0.05934%0.341CS..SBendtrans-152.2136.6179.4-169.4-110.8000109.4I14 F15 L18 C89 I167 T171 M266I14-Y169 HydrophobicContact CG2-CD1 4.11Å; I14-Y169 HydrophobicContact CG2-CD2 4.45Å; I14-Y169 HydrophobicContact CG2-CG 3.9Å; F15-Y169 HydrophobicContact CD2-CE2 4.06Å; L18-Y169 HydrophobicContact CD2-CD1 4.43Å; L18-Y169 HydrophobicContact CD2-CE1 3.74Å; C89-Y169 HydrophobicContact CB-CD2 3.84Å; C89-Y169 HydrophobicContact CB-CE2 4.42Å; I167-Y169 VanDerWaalsContact C-N 3.29Å; I167-Y169 PolarHBondContact O-N 2.86Å; Y169-T171 HydrophobicContact CD1-CG2 3.3Å; Y169-T171 HydrophobicContact CE1-CG2 3.69Å; Y169-T171 HydrophobicContact CG-CG2 4.42Å; Y169-T171 PolarHBondContact O-N 3.35Å; Y169-M266 HydrophobicContact CD1-CE 3.61Å; Y169-M266 HydrophobicContact CE1-CE 4.29Å; Y169-M266 HydrophobicContact CG-CE 4.4Å
170C74.1Confident68.6Low4 Ų468.6 Ų68.63%0.02734%0.341CS..  trans-74.592.4-176.6179.30000111.3M91 C96M91-C170 HydrophobicContact CE-CB 3.51Å; M91-C170 VanDerWaalsContact CE-SG 3.55Å; C96-C170 WeakPolarHBondContact CA-SG 3.4Å; C96-C170 HydrophobicContact CB-CB 3.9Å; C96-C170 WeakPolarHBondContact CB-SG 3.3Å; C96-C170 WeakPolarHBondContact SG-CA 3.04Å; C96-C170 WeakPolarHBondContact SG-CB 3.34Å; C96-C170 CovalentContact SG-SG 2.04Å; C96-C170 PolarHBondContact SG-SG 3.35Å
171T70.9Confident67.9Low27 Ų2764.1 Ų64.117%0.16632%0.318CS..  trans-133.2151.3170740000109.9Y169 I173 S174 M266Y169-T171 HydrophobicContact CD1-CG2 3.3Å; Y169-T171 HydrophobicContact CE1-CG2 3.69Å; Y169-T171 HydrophobicContact CG-CG2 4.42Å; Y169-T171 PolarHBondContact O-N 3.35Å; T171-I173 PolarHBondContact O-N 3.46Å; T171-I173 PolarHBondContact OG1-N 2.97Å; T171-S174 PolarHBondContact O-N 3.44Å; T171-S174 PolarHBondContact O-OG 3.15Å; T171-S174 PolarHBondContact OG1-N 2.96Å; T171-M266 HydrophobicContact CG2-CE 3.92Å
172M59.7Low67.6Low52 Ų5267.5 Ų67.526%0.25633%0.331SS..G310 helixtrans-59.8-30.9172.3-73.2-151.4166.400112.2Q100 S174 L181Q100-M172 HydrophobicContact CB-CE 4.28Å; M172-S174 VanDerWaalsContact C-N 3.28Å; M172-S174 PolarHBondContact O-N 2.81Å; M172-L181 HydrophobicContact CB-CD1 4.11Å; M172-L181 WeakPolarHBondContact O-CD2 3.39Å; M172-L181 HydrophobicContact SD-CD1 4.11Å
173I59.1Low67.7Low64 Ų6473 Ų7333%0.32836%0.355SS..G310 helixtrans-69.7-23.8-176.5-56.3173.3000112.5T171 S175 I257 A269T171-I173 PolarHBondContact O-N 3.46Å; T171-I173 PolarHBondContact OG1-N 2.97Å; I173-S175 PolarHBondContact O-N 2.96Å; I173-I257 HydrophobicContact CG2-CG1 4.1Å; I173-A269 HydrophobicContact CD1-CB 4.24Å
174S52.7Low68Low45 Ų4568 Ų6832%0.31533%0.327SS..G310 helixtrans-60.9-20.7-173.667.70000114.4I167 T171 M172 R176I167-S174 WeakPolarHBondContact CD1-OG 3.39Å; T171-S174 PolarHBondContact O-N 3.44Å; T171-S174 PolarHBondContact O-OG 3.15Å; T171-S174 PolarHBondContact OG1-N 2.96Å; M172-S174 VanDerWaalsContact C-N 3.28Å; M172-S174 PolarHBondContact O-N 2.81Å; S174-R176 PolarHBondContact O-N 3.11Å
175S52.1Low68.3Low17 Ų1764.5 Ų64.512%0.11931%0.313CS..  trans-9775.9176.7-165.70000111.7I173 E177 N178I173-S175 PolarHBondContact O-N 2.96Å; S175-E177 PolarHBondContact O-N 2.86Å; S175-E177 VanDerWaalsContact O-N 3.17Å; S175-N178 PolarHBondContact O-N 3.15Å; S175-N178 WeakPolarHBondContact OG-CB 3.5Å; S175-N178 PolarHBondContact OG-N 2.99Å; S175-N178 PolarHBondContact OG-ND2 2.87Å; S175-N178 PolarHBondContact OG-OD1 3.44Å
176R53.3Low68.6Low134 Ų13464.2 Ų64.251%0.50632%0.315SS..THydrogen-bonded Turntrans-54.9-27.9171.4-107.7-171-171.1170.79112.6S174 M182 I257 S259S174-R176 PolarHBondContact O-N 3.11Å; R176-M182 WeakPolarHBondContact O-CE 3.45Å; R176-I257 PolarHBondContact NE-O 2.98Å; R176-I257 PolarHBondContact NH2-O 3.29Å; R176-S259 PolarHBondContact NH2-O 3.29Å
177E56.5Low68.9Low158 Ų15862.2 Ų62.274%0.73831%0.305SS*.THydrogen-bonded Turntrans-90.6-12.9-173.2-62.8-17216700114.1S175 Q179S175-E177 PolarHBondContact O-N 2.86Å; S175-E177 VanDerWaalsContact O-N 3.17Å; E177-Q179 PolarHBondContact O-N 3.13Å
178N63.5Low69.2Low20 Ų2061.9 Ų61.911%0.10730%0.304CS..  trans-7696.4-179.1-86.7-9.3000110.7S162 S175 F180 L181 M182S162-N178 PolarHBondContact OG-ND2 2.87Å; S175-N178 PolarHBondContact O-N 3.15Å; S175-N178 WeakPolarHBondContact OG-CB 3.5Å; S175-N178 PolarHBondContact OG-N 2.99Å; S175-N178 PolarHBondContact OG-ND2 2.87Å; S175-N178 PolarHBondContact OG-OD1 3.44Å; N178-F180 PolarHBondContact O-N 3.43Å; N178-F180 VanDerWaalsContact O-N 3.07Å; N178-L181 HydrophobicContact CB-CB 4.16Å; N178-L181 WeakPolarHBondContact O-CB 3.34Å; N178-L181 PolarHBondContact O-N 2.91Å; N178-M182 PolarHBondContact O-N 3.29Å
179Q70.1Confident69.7Low162 Ų16262.1 Ų62.176%0.75730%0.304SS*.Hα-helixtrans-50.1-34173.3-67.2-175.1-22.300112.6E177 L181 M182 F183E177-Q179 PolarHBondContact O-N 3.13Å; Q179-L181 PolarHBondContact O-N 3.49Å; Q179-M182 PolarHBondContact O-N 3.31Å; Q179-F183 WeakPolarHBondContact O-CB 3.34Å; Q179-F183 PolarHBondContact O-N 2.93Å
180F69.5Low70.3Confident88 Ų8865 Ų6539%0.38632%0.323SS..Hα-helixtrans-64.3-36.5176.6-81.8-84.8000113.7M158 S161 N178 F183 E184M158-F180 HydrophobicContact CG-CB 4.42Å; S161-F180 VanDerWaalsContact CB-CD2 3.46Å; S161-F180 WeakPolarHBondContact OG-CD2 3.23Å; N178-F180 PolarHBondContact O-N 3.43Å; N178-F180 VanDerWaalsContact O-N 3.07Å; F180-F183 PolarHBondContact O-N 3.42Å; F180-E184 WeakPolarHBondContact O-CB 3.2Å; F180-E184 PolarHBondContact O-N 2.86Å
181L69.9Low70.9Confident36 Ų3666.4 Ų66.419%0.18833%0.33CS..Hα-helixtrans-69.3-41.8177.9-174.879.1000110.9M158 M172 N178 Q179 F183 E184 N185M158-L181 HydrophobicContact SD-CD1 4.41Å; M172-L181 HydrophobicContact CB-CD1 4.11Å; M172-L181 WeakPolarHBondContact O-CD2 3.39Å; M172-L181 HydrophobicContact SD-CD1 4.11Å; N178-L181 HydrophobicContact CB-CB 4.16Å; N178-L181 WeakPolarHBondContact O-CB 3.34Å; N178-L181 PolarHBondContact O-N 2.91Å; Q179-L181 PolarHBondContact O-N 3.49Å; L181-F183 VanDerWaalsContact C-N 3.3Å; L181-F183 PolarHBondContact O-N 3.35Å; L181-E184 PolarHBondContact O-N 3.41Å; L181-N185 WeakPolarHBondContact O-CB 3.44Å; L181-N185 PolarHBondContact O-N 3.07Å
182M72.7Confident71.6Confident113 Ų11365.1 Ų65.156%0.55732%0.322SS*.Hα-helixtrans-61.4-42.4173.7-69.4-169.5175.700111.2R176 N178 Q179 N185 L186R176-M182 WeakPolarHBondContact O-CE 3.45Å; N178-M182 PolarHBondContact O-N 3.29Å; Q179-M182 PolarHBondContact O-N 3.31Å; M182-N185 PolarHBondContact O-N 2.97Å; M182-L186 WeakPolarHBondContact O-CB 3.33Å; M182-L186 PolarHBondContact O-N 3.07Å
183F75.6Confident72.9Confident117 Ų11764.5 Ų64.551%0.51333%0.325SS..Hα-helixtrans-62.7-46.2176.1-177.7-98.7000112Q179 F180 L181 N185 L186 V187Q179-F183 WeakPolarHBondContact O-CB 3.34Å; Q179-F183 PolarHBondContact O-N 2.93Å; F180-F183 PolarHBondContact O-N 3.42Å; L181-F183 VanDerWaalsContact C-N 3.3Å; L181-F183 PolarHBondContact O-N 3.35Å; F183-N185 PolarHBondContact O-N 3.06Å; F183-L186 PolarHBondContact O-N 2.91Å; F183-V187 HydrophobicContact CD1-CG2 4.1Å; F183-V187 HydrophobicContact CD2-CG2 4.46Å; F183-V187 HydrophobicContact CE1-CG2 3.69Å; F183-V187 HydrophobicContact CE2-CG2 4.08Å; F183-V187 HydrophobicContact CG-CG2 4.47Å; F183-V187 HydrophobicContact CZ-CG2 3.67Å; F183-V187 VanDerWaalsContact O-CG2 3.32Å; F183-V187 WeakPolarHBondContact O-CG2 3.24Å; F183-V187 PolarHBondContact O-N 2.87Å
184E78.8Confident74.3Confident9 Ų965.6 Ų65.64%0.04233%0.331CS..Hα-helixtrans-57.8-49.2175.6178.3-176.1-179.600111.2I154 F180 L181 L186 V187 N188I154-E184 HydrophobicContact CG2-CB 4.43Å; I154-E184 HydrophobicContact CG2-CG 4.04Å; F180-E184 WeakPolarHBondContact O-CB 3.2Å; F180-E184 PolarHBondContact O-N 2.86Å; L181-E184 PolarHBondContact O-N 3.41Å; E184-L186 VanDerWaalsContact C-N 3.31Å; E184-L186 PolarHBondContact O-N 3.28Å; E184-V187 PolarHBondContact O-N 2.88Å; E184-N188 WeakPolarHBondContact CG-ND2 3.42Å; E184-N188 VanDerWaalsContact O-CB 3.3Å; E184-N188 WeakPolarHBondContact O-CB 3.4Å; E184-N188 VanDerWaalsContact O-CG 3.28Å; E184-N188 PolarHBondContact O-N 3.26Å; E184-N188 PolarHBondContact O-ND2 3.05Å
185N78.6Confident75.9Confident63 Ų6363.4 Ų63.434%0.33732%0.316SS..Hα-helixtrans-60.9-42.6179.3-170.227000111L181 M182 F183 N188 N189L181-N185 WeakPolarHBondContact O-CB 3.44Å; L181-N185 PolarHBondContact O-N 3.07Å; M182-N185 PolarHBondContact O-N 2.97Å; F183-N185 PolarHBondContact O-N 3.06Å; N185-N188 PolarHBondContact O-N 3.23Å; N185-N189 WeakPolarHBondContact O-CB 3.22Å; N185-N189 VanDerWaalsContact O-CG 3.28Å; N185-N189 PolarHBondContact O-N 3.24Å; N185-N189 PolarHBondContact O-ND2 3.47Å; N185-N189 PolarHBondContact OD1-ND2 2.9Å
186L81.7Confident77.6Confident108 Ų10863.8 Ų63.857%0.56532%0.318SS*.Hα-helixtrans-60.1-50.1175.9-17671.6000111.5M182 F183 E184 N188 N189 V190M182-L186 WeakPolarHBondContact O-CB 3.33Å; M182-L186 PolarHBondContact O-N 3.07Å; F183-L186 PolarHBondContact O-N 2.91Å; E184-L186 VanDerWaalsContact C-N 3.31Å; E184-L186 PolarHBondContact O-N 3.28Å; L186-N188 PolarHBondContact O-N 3.42Å; L186-N189 PolarHBondContact O-N 3.39Å; L186-V190 VanDerWaalsContact O-CG2 3.32Å; L186-V190 WeakPolarHBondContact O-CG2 3.2Å; L186-V190 PolarHBondContact O-N 2.92Å
187V84.6Confident79.3Confident41 Ų4160 Ų6025%0.24832%0.315CS..Hα-helixtrans-62.2-44.5-179.9174.80000110.8Y150 F183 E184 V190 L191Y150-V187 HydrophobicContact CE2-CG1 4.39Å; Y150-V187 WeakPolarHBondContact OH-CG1 3.48Å; F183-V187 HydrophobicContact CD1-CG2 4.1Å; F183-V187 HydrophobicContact CD2-CG2 4.46Å; F183-V187 HydrophobicContact CE1-CG2 3.69Å; F183-V187 HydrophobicContact CE2-CG2 4.08Å; F183-V187 HydrophobicContact CG-CG2 4.47Å; F183-V187 HydrophobicContact CZ-CG2 3.67Å; F183-V187 VanDerWaalsContact O-CG2 3.32Å; F183-V187 WeakPolarHBondContact O-CG2 3.24Å; F183-V187 PolarHBondContact O-N 2.87Å; E184-V187 PolarHBondContact O-N 2.88Å; V187-V190 PolarHBondContact O-N 3.46Å; V187-L191 VanDerWaalsContact O-CB 3.26Å; V187-L191 WeakPolarHBondContact O-CB 3.5Å; V187-L191 PolarHBondContact O-N 2.89Å
188N82.5Confident80.8Confident4 Ų454.3 Ų54.32%0.02129%0.291CS..Hα-helixtrans-63.4-42.7178.4-74.9-17.3000111.7I111 E184 N185 L186 L191 L192 F246I111-N188 HydrophobicContact CD1-CB 3.75Å; E184-N188 WeakPolarHBondContact CG-ND2 3.42Å; E184-N188 VanDerWaalsContact O-CB 3.3Å; E184-N188 WeakPolarHBondContact O-CB 3.4Å; E184-N188 VanDerWaalsContact O-CG 3.28Å; E184-N188 PolarHBondContact O-N 3.26Å; E184-N188 PolarHBondContact O-ND2 3.05Å; N185-N188 PolarHBondContact O-N 3.23Å; L186-N188 PolarHBondContact O-N 3.42Å; N188-L191 PolarHBondContact O-N 3.19Å; N188-L192 VanDerWaalsContact O-CB 3.29Å; N188-L192 WeakPolarHBondContact O-CB 3.47Å; N188-L192 PolarHBondContact O-N 3.39Å; N188-F246 HydrophobicContact CB-CE1 4.5Å; N188-F246 HydrophobicContact CB-CZ 4.28Å
189N84.6Confident81.8Confident27 Ų2753.7 Ų53.714%0.14429%0.287CS..Hα-helixtrans-61.8-46.6174.6-77.4-54.1000111.8N185 L186 L192 A193 F246 T250N185-N189 WeakPolarHBondContact O-CB 3.22Å; N185-N189 VanDerWaalsContact O-CG 3.28Å; N185-N189 PolarHBondContact O-N 3.24Å; N185-N189 PolarHBondContact O-ND2 3.47Å; N185-N189 PolarHBondContact OD1-ND2 2.9Å; L186-N189 PolarHBondContact O-N 3.39Å; N189-L192 PolarHBondContact O-N 3.5Å; N189-A193 WeakPolarHBondContact O-CB 3.42Å; N189-A193 PolarHBondContact O-N 3.21Å; N189-F246 WeakPolarHBondContact OD1-CE1 3.31Å; N189-T250 PolarHBondContact OD1-OG1 2.95Å
190V86.3Confident82.6Confident77 Ų7750.4 Ų50.447%0.46727%0.274SS..Hα-helixtrans-62.6-45.1177.7170.70000110.8L186 V187 L192 A193 L194L186-V190 VanDerWaalsContact O-CG2 3.32Å; L186-V190 WeakPolarHBondContact O-CG2 3.2Å; L186-V190 PolarHBondContact O-N 2.92Å; V187-V190 PolarHBondContact O-N 3.46Å; V190-L192 VanDerWaalsContact C-N 3.32Å; V190-L192 PolarHBondContact O-N 3.29Å; V190-A193 WeakPolarHBondContact O-CB 3.3Å; V190-A193 PolarHBondContact O-N 3.48Å; V190-L194 HydrophobicContact CG1-CD1 4.03Å; V190-L194 HydrophobicContact CG1-CG 4.47Å; V190-L194 WeakPolarHBondContact O-CB 3.31Å; V190-L194 WeakPolarHBondContact O-CG 3.33Å; V190-L194 PolarHBondContact O-N 2.91Å
191L86.1Confident83.5Confident33 Ų3349.1 Ų49.117%0.17328%0.28CS..Hα-helixtrans-62-43.4179.8-168.763.1000110.5I111 F115 V187 N188 L194 T195I111-L191 HydrophobicContact CG2-CB 4.17Å; I111-L191 HydrophobicContact CG2-CD2 3.54Å; I111-L191 HydrophobicContact CG2-CG 3.9Å; F115-L191 HydrophobicContact CB-CD1 4.14Å; F115-L191 HydrophobicContact CB-CG 4.26Å; F115-L191 HydrophobicContact CD1-CD1 4.02Å; F115-L191 HydrophobicContact CD2-CD1 3.58Å; F115-L191 HydrophobicContact CD2-CG 4.31Å; F115-L191 HydrophobicContact CE1-CD1 4.33Å; F115-L191 HydrophobicContact CE2-CD1 3.97Å; F115-L191 HydrophobicContact CG-CD1 3.64Å; F115-L191 HydrophobicContact CG-CG 4.28Å; F115-L191 HydrophobicContact CZ-CD1 4.33Å; V187-L191 VanDerWaalsContact O-CB 3.26Å; V187-L191 WeakPolarHBondContact O-CB 3.5Å; V187-L191 PolarHBondContact O-N 2.89Å; N188-L191 PolarHBondContact O-N 3.19Å; L191-L194 PolarHBondContact O-N 3.33Å; L191-T195 VanDerWaalsContact O-CG2 3.32Å; L191-T195 WeakPolarHBondContact O-CG2 3.38Å; L191-T195 PolarHBondContact O-N 2.95Å
192L85Confident84.2Confident0 Ų047.7 Ų47.70%027%0.272CS..Hα-helixtrans-66.9-41.9177-162.866.1000112.1N188 N189 V190 L194 T195 V196 A243 F246N188-L192 VanDerWaalsContact O-CB 3.29Å; N188-L192 WeakPolarHBondContact O-CB 3.47Å; N188-L192 PolarHBondContact O-N 3.39Å; N189-L192 PolarHBondContact O-N 3.5Å; V190-L192 VanDerWaalsContact C-N 3.32Å; V190-L192 PolarHBondContact O-N 3.29Å; L192-L194 VanDerWaalsContact C-N 3.3Å; L192-L194 PolarHBondContact O-N 3.17Å; L192-T195 WeakPolarHBondContact CA-OG1 3.35Å; L192-T195 PolarHBondContact O-N 2.98Å; L192-T195 VanDerWaalsContact O-N 3.17Å; L192-T195 PolarHBondContact O-OG1 2.94Å; L192-V196 WeakPolarHBondContact O-CG2 3.42Å; L192-V196 PolarHBondContact O-N 2.97Å; L192-A243 HydrophobicContact CD1-CB 4.16Å; L192-A243 HydrophobicContact CD2-CB 4.03Å; L192-A243 HydrophobicContact CG-CB 3.86Å; L192-F246 HydrophobicContact CD2-CB 3.55Å; L192-F246 HydrophobicContact CD2-CD1 3.26Å; L192-F246 HydrophobicContact CD2-CE1 4.18Å; L192-F246 HydrophobicContact CD2-CG 3.73Å
193A87.5Confident84.6Confident39 Ų3944.3 Ų44.332%0.32226%0.256SS..Hα-helixtrans-54.6-47.8171.800000111.3N189 V190 V196 A197 Y247N189-A193 WeakPolarHBondContact O-CB 3.42Å; N189-A193 PolarHBondContact O-N 3.21Å; V190-A193 WeakPolarHBondContact O-CB 3.3Å; V190-A193 PolarHBondContact O-N 3.48Å; A193-V196 PolarHBondContact O-N 3.33Å; A193-A197 WeakPolarHBondContact O-CB 3.48Å; A193-A197 PolarHBondContact O-N 3.46Å; A193-Y247 WeakPolarHBondContact CA-OH 3.16Å; A193-Y247 WeakPolarHBondContact CB-OH 2.97Å; A193-Y247 PolarHBondContact N-OH 3.42Å
194L88.8Confident85.1Confident86 Ų8642.9 Ų42.945%0.4526%0.256SS..Hα-helixtrans-63.2-42.1177.2-71.7171.9000111.6F115 V190 L191 L192 V196 A197 V198F115-L194 HydrophobicContact CE2-CB 4.15Å; V190-L194 HydrophobicContact CG1-CD1 4.03Å; V190-L194 HydrophobicContact CG1-CG 4.47Å; V190-L194 WeakPolarHBondContact O-CB 3.31Å; V190-L194 WeakPolarHBondContact O-CG 3.33Å; V190-L194 PolarHBondContact O-N 2.91Å; L191-L194 PolarHBondContact O-N 3.33Å; L192-L194 VanDerWaalsContact C-N 3.3Å; L192-L194 PolarHBondContact O-N 3.17Å; L194-V196 VanDerWaalsContact C-N 3.34Å; L194-V196 PolarHBondContact O-N 2.84Å; L194-A197 PolarHBondContact O-N 3.43Å; L194-V198 WeakPolarHBondContact O-CB 3.4Å; L194-V198 VanDerWaalsContact O-CG2 3.25Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.44Å
195T87.4Confident85.4Confident0 Ų048.4 Ų48.40%028%0.277CS..Hα-helixtrans-56.9-48.5175.763.70000111.7F115 L191 L192 V198 Y199F115-T195 VanDerWaalsContact CA-CG2 3.43Å; F115-T195 HydrophobicContact CB-CG2 3.46Å; F115-T195 VanDerWaalsContact CB-CG2 3.46Å; F115-T195 HydrophobicContact CD2-CG2 3.68Å; F115-T195 HydrophobicContact CG-CG2 4.05Å; L191-T195 VanDerWaalsContact O-CG2 3.32Å; L191-T195 WeakPolarHBondContact O-CG2 3.38Å; L191-T195 PolarHBondContact O-N 2.95Å; L192-T195 WeakPolarHBondContact CA-OG1 3.35Å; L192-T195 PolarHBondContact O-N 2.98Å; L192-T195 VanDerWaalsContact O-N 3.17Å; L192-T195 PolarHBondContact O-OG1 2.94Å; T195-V198 PolarHBondContact O-N 2.73Å; T195-Y199 WeakPolarHBondContact O-CD2 3.43Å; T195-Y199 PolarHBondContact O-N 3.27Å
196V87.7Confident85.5Confident25 Ų2546.4 Ų46.415%0.15227%0.267CS..Hα-helixtrans-64.3-45.7-178.51740000110.2L192 A193 L194 V198 Y199 I200 V239 A243L192-V196 WeakPolarHBondContact O-CG2 3.42Å; L192-V196 PolarHBondContact O-N 2.97Å; A193-V196 PolarHBondContact O-N 3.33Å; L194-V196 VanDerWaalsContact C-N 3.34Å; L194-V196 PolarHBondContact O-N 2.84Å; V196-V198 VanDerWaalsContact C-N 3.34Å; V196-V198 PolarHBondContact O-N 3.48Å; V196-Y199 PolarHBondContact O-N 3.35Å; V196-I200 HydrophobicContact CG1-CD1 3.76Å; V196-I200 HydrophobicContact CG1-CG1 4.35Å; V196-I200 WeakPolarHBondContact O-CG1 3.13Å; V196-I200 PolarHBondContact O-N 2.87Å; V196-V239 HydrophobicContact CG2-CG1 4.41Å; V196-A243 HydrophobicContact CG2-CB 3.31Å
197A88.8Confident85.5Confident53 Ų5348.2 Ų48.244%0.43827%0.27SS..Hα-helixtrans-58.3-45.3177.100000111.9A193 L194 I200 A201A193-A197 WeakPolarHBondContact O-CB 3.48Å; A193-A197 PolarHBondContact O-N 3.46Å; L194-A197 PolarHBondContact O-N 3.43Å; A197-I200 PolarHBondContact O-N 2.98Å; A197-A201 WeakPolarHBondContact O-CB 3.45Å; A197-A201 PolarHBondContact O-N 3.18Å
198V87.7Confident85.5Confident40 Ų4054.3 Ų54.324%0.24229%0.289CS..Hα-helixtrans-62.5-43.8176.6171.30000111.2A118 T122 L194 T195 V196 A201 L202A118-V198 HydrophobicContact CB-CB 4.38Å; A118-V198 HydrophobicContact CB-CG1 3.89Å; T122-V198 VanDerWaalsContact OG1-CG1 3.23Å; T122-V198 WeakPolarHBondContact OG1-CG1 3.25Å; L194-V198 WeakPolarHBondContact O-CB 3.4Å; L194-V198 VanDerWaalsContact O-CG2 3.25Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.44Å; T195-V198 PolarHBondContact O-N 2.73Å; V196-V198 VanDerWaalsContact C-N 3.34Å; V196-V198 PolarHBondContact O-N 3.48Å; V198-A201 PolarHBondContact O-N 2.68Å; V198-L202 HydrophobicContact CG1-CD1 4.16Å; V198-L202 WeakPolarHBondContact O-CB 3.35Å; V198-L202 WeakPolarHBondContact O-CG 3.34Å; V198-L202 PolarHBondContact O-N 2.82Å
199Y84.2Confident85.3Confident6 Ų658.4 Ų58.42%0.02431%0.307CS..Hα-helixtrans-64.6-41.4176.7-84.5-64.5000112.9A118 T195 V196 L202 I203 L235 A236 V239A118-Y199 HydrophobicContact CB-CD2 3.98Å; A118-Y199 HydrophobicContact CB-CE1 4.34Å; A118-Y199 HydrophobicContact CB-CE2 3.47Å; A118-Y199 VanDerWaalsContact CB-CE2 3.47Å; A118-Y199 PolarHBondContact N-OH 2.98Å; T195-Y199 WeakPolarHBondContact O-CD2 3.43Å; T195-Y199 PolarHBondContact O-N 3.27Å; V196-Y199 PolarHBondContact O-N 3.35Å; Y199-L202 HydrophobicContact CD1-CD1 4.49Å; Y199-L202 PolarHBondContact O-N 3.47Å; Y199-I203 VanDerWaalsContact O-CG1 3.27Å; Y199-I203 WeakPolarHBondContact O-CG1 3.33Å; Y199-I203 PolarHBondContact O-N 2.95Å; Y199-L235 HydrophobicContact CE1-CB 4.19Å; Y199-A236 HydrophobicContact CD1-CB 3.65Å; Y199-A236 HydrophobicContact CE1-CB 4.33Å; Y199-A236 HydrophobicContact CG-CB 4.01Å; Y199-V239 HydrophobicContact CD2-CB 3.88Å; Y199-V239 HydrophobicContact CD2-CG1 3.76Å; Y199-V239 HydrophobicContact CD2-CG2 4.12Å; Y199-V239 HydrophobicContact CE2-CB 3.72Å; Y199-V239 HydrophobicContact CE2-CG1 3.8Å; Y199-V239 HydrophobicContact CE2-CG2 3.42Å; Y199-V239 VanDerWaalsContact CE2-CG2 3.42Å
200I86.7Confident84.8Confident94 Ų9459.9 Ų59.948%0.48231%0.314SS..Hα-helixtrans-62.2-49.4176.2-68.8169.8000109.6V196 A197 L202 I203 V204V196-I200 HydrophobicContact CG1-CD1 3.76Å; V196-I200 HydrophobicContact CG1-CG1 4.35Å; V196-I200 WeakPolarHBondContact O-CG1 3.13Å; V196-I200 PolarHBondContact O-N 2.87Å; A197-I200 PolarHBondContact O-N 2.98Å; I200-L202 VanDerWaalsContact C-N 3.3Å; I200-L202 PolarHBondContact O-N 3.28Å; I200-I203 PolarHBondContact O-N 3.44Å; I200-V204 HydrophobicContact CG2-CG2 4.38Å; I200-V204 WeakPolarHBondContact O-CG2 3.16Å; I200-V204 PolarHBondContact O-N 3.28Å
201A88.2Confident84.5Confident61 Ų6164.6 Ų64.650%0.50433%0.325SS..Hα-helixtrans-57.1-44.3177.100000111.4A197 V198 V204 W205A197-A201 WeakPolarHBondContact O-CB 3.45Å; A197-A201 PolarHBondContact O-N 3.18Å; V198-A201 PolarHBondContact O-N 2.68Å; A201-V204 PolarHBondContact O-N 3.43Å; A201-W205 WeakPolarHBondContact O-CB 3.28Å; A201-W205 PolarHBondContact O-N 3.19Å
202L84.1Confident84.1Confident6 Ų670.1 Ų70.13%0.03135%0.348CS..Hα-helixtrans-61.2-46175.4-84.5173.4000112.9R121 T122 I125 V198 Y199 I200 W205 V206 L232R121-L202 HydrophobicContact CB-CD1 4.21Å; T122-L202 HydrophobicContact CG2-CD2 4.17Å; T122-L202 WeakPolarHBondContact OG1-CD1 3.2Å; T122-L202 WeakPolarHBondContact OG1-CG 2.91Å; I125-L202 HydrophobicContact CB-CD2 4.46Å; I125-L202 HydrophobicContact CD1-CD2 4.03Å; V198-L202 HydrophobicContact CG1-CD1 4.16Å; V198-L202 WeakPolarHBondContact O-CB 3.35Å; V198-L202 WeakPolarHBondContact O-CG 3.34Å; V198-L202 PolarHBondContact O-N 2.82Å; Y199-L202 HydrophobicContact CD1-CD1 4.49Å; Y199-L202 PolarHBondContact O-N 3.47Å; I200-L202 VanDerWaalsContact C-N 3.3Å; I200-L202 PolarHBondContact O-N 3.28Å; L202-W205 PolarHBondContact O-N 3.44Å; L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 2.97Å; L202-L232 HydrophobicContact CB-CD1 4.5Å; L202-L232 HydrophobicContact CB-CD2 4.43Å; L202-L232 HydrophobicContact CD1-CD1 4.39Å
203I82.7Confident83.4Confident42 Ų4272 Ų7222%0.21536%0.358CS..Hα-helixtrans-62.5-47.4179.6-72.2163.7000110.2Y199 I200 V206 K207 L232 A236Y199-I203 VanDerWaalsContact O-CG1 3.27Å; Y199-I203 WeakPolarHBondContact O-CG1 3.33Å; Y199-I203 PolarHBondContact O-N 2.95Å; I200-I203 PolarHBondContact O-N 3.44Å; I203-V206 PolarHBondContact O-N 3.46Å; I203-K207 HydrophobicContact CG2-CD 4.3Å; I203-K207 WeakPolarHBondContact O-CB 3.26Å; I203-K207 WeakPolarHBondContact O-CG 3.37Å; I203-K207 PolarHBondContact O-N 3.48Å; I203-L232 HydrophobicContact CG1-CD2 3.87Å; I203-A236 HydrophobicContact CD1-CB 3.51Å; I203-A236 HydrophobicContact CG1-CB 4.26Å
204V85.3Confident82.5Confident87 Ų8780.6 Ų80.653%0.52738%0.382SS..Hα-helixtrans-60.4-47.8178.5172.80000109.9I200 A201 V206 K207 W208I200-V204 HydrophobicContact CG2-CG2 4.38Å; I200-V204 WeakPolarHBondContact O-CG2 3.16Å; I200-V204 PolarHBondContact O-N 3.28Å; A201-V204 PolarHBondContact O-N 3.43Å; V204-V206 PolarHBondContact O-N 3.22Å; V204-K207 PolarHBondContact O-N 2.9Å; V204-W208 WeakPolarHBondContact O-CB 3.47Å; V204-W208 PolarHBondContact O-N 3.42Å
205W84.6Confident81.4Confident124 Ų12484.3 Ų84.347%0.4740%0.397SS..Hα-helixtrans-59.9-47.4178.3-173.7-87.9000112.7A201 L202 W208 K209A201-W205 WeakPolarHBondContact O-CB 3.28Å; A201-W205 PolarHBondContact O-N 3.19Å; L202-W205 PolarHBondContact O-N 3.44Å; W205-W208 PolarHBondContact O-N 2.89Å; W205-K209 WeakPolarHBondContact O-CB 3.3Å; W205-K209 PolarHBondContact O-N 3.45Å
206V80.8Confident80.1Confident22 Ų2290.9 Ų90.913%0.13343%0.432CS..Hα-helixtrans-63.9-42.9178.81700000110.9I125 L202 I203 V204 K209 L210 L232I125-V206 HydrophobicContact CD1-CG2 3.86Å; I125-V206 HydrophobicContact CG2-CG2 4.24Å; L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.34Å; L202-V206 PolarHBondContact O-N 2.97Å; I203-V206 PolarHBondContact O-N 3.46Å; V204-V206 PolarHBondContact O-N 3.22Å; V206-K209 PolarHBondContact O-N 2.78Å; V206-L210 HydrophobicContact CG1-CD1 3.89Å; V206-L210 HydrophobicContact CG1-CG 4.38Å; V206-L210 WeakPolarHBondContact O-CB 3.34Å; V206-L210 VanDerWaalsContact O-CG 3.24Å; V206-L210 WeakPolarHBondContact O-CG 3.21Å; V206-L210 PolarHBondContact O-N 2.88Å; V206-L232 HydrophobicContact CG2-CD1 4.49Å
207K81.7Confident78.6Confident145 Ų14592.3 Ų92.363%0.6344%0.44SS*.Hα-helixtrans-62.8-45.3176-80.1-173174.6-176.50111.6I203 V204 L210 Y211I203-K207 HydrophobicContact CG2-CD 4.3Å; I203-K207 WeakPolarHBondContact O-CB 3.26Å; I203-K207 WeakPolarHBondContact O-CG 3.37Å; I203-K207 PolarHBondContact O-N 3.48Å; V204-K207 PolarHBondContact O-N 2.9Å; K207-L210 PolarHBondContact O-N 2.88Å; K207-Y211 WeakPolarHBondContact O-CB 3.25Å; K207-Y211 PolarHBondContact O-N 3.25Å
208W84.1Confident77.2Confident169 Ų16994.9 Ų94.964%0.6445%0.45SS*.Hα-helixtrans-61.7-45.7178.4-175.116.2000111.5V204 W205 L210 Y211 K212V204-W208 WeakPolarHBondContact O-CB 3.47Å; V204-W208 PolarHBondContact O-N 3.42Å; W205-W208 PolarHBondContact O-N 2.89Å; W208-L210 PolarHBondContact O-N 3.39Å; W208-Y211 PolarHBondContact O-N 2.9Å; W208-K212 PolarHBondContact O-N 2.66Å
209K78.3Confident75.9Confident90 Ų90100.3 Ų100.339%0.39148%0.478SS..Hα-helixtrans-63.3-40.7176.6-169167.8-175.3169.60112.4W205 V206 Y211 K212 D213W205-K209 WeakPolarHBondContact O-CB 3.3Å; W205-K209 PolarHBondContact O-N 3.45Å; V206-K209 PolarHBondContact O-N 2.78Å; K209-Y211 VanDerWaalsContact C-N 3.32Å; K209-Y211 PolarHBondContact O-N 3.21Å; K209-K212 PolarHBondContact O-N 3.09Å; K209-D213 VanDerWaalsContact O-CB 3.31Å; K209-D213 WeakPolarHBondContact O-CB 3.42Å; K209-D213 PolarHBondContact O-N 3.39Å
210L74.3Confident74.6Confident59 Ų59107.5 Ų107.531%0.30951%0.511SS..Hα-helixtrans-64.3-35.9174.8-76.7170.6000112.7V206 K207 W208 R214 R225V206-L210 HydrophobicContact CG1-CD1 3.89Å; V206-L210 HydrophobicContact CG1-CG 4.38Å; V206-L210 WeakPolarHBondContact O-CB 3.34Å; V206-L210 VanDerWaalsContact O-CG 3.24Å; V206-L210 WeakPolarHBondContact O-CG 3.21Å; V206-L210 PolarHBondContact O-N 2.88Å; K207-L210 PolarHBondContact O-N 2.88Å; W208-L210 PolarHBondContact O-N 3.39Å; L210-R214 PolarHBondContact O-N 2.91Å; L210-R225 HydrophobicContact CD2-CB 4.42Å
211Y79.7Confident73.5Confident176 Ų176108.3 Ų108.369%0.6951%0.514SS*.Hα-helixtrans-68-48.9176.6-176.6-95.9000111.1K207 W208 K209 D213 R214K207-Y211 WeakPolarHBondContact O-CB 3.25Å; K207-Y211 PolarHBondContact O-N 3.25Å; W208-Y211 PolarHBondContact O-N 2.9Å; K209-Y211 VanDerWaalsContact C-N 3.32Å; K209-Y211 PolarHBondContact O-N 3.21Å; Y211-D213 VanDerWaalsContact C-N 3.32Å; Y211-D213 PolarHBondContact O-N 3.15Å; Y211-R214 WeakPolarHBondContact O-CB 3.46Å; Y211-R214 PolarHBondContact O-N 3.48Å
212K79Confident72.3Confident149 Ų149107.3 Ų107.365%0.64850%0.502SS*.Hα-helixtrans-61.6-38.6178.8-171.5174.6-177.9175.90112.9W208 K209 R214W208-K212 PolarHBondContact O-N 2.66Å; K209-K212 PolarHBondContact O-N 3.09Å; K212-R214 VanDerWaalsContact C-N 3.32Å; K212-R214 PolarHBondContact O-N 3.09Å
213D70.4Confident71.3Confident40 Ų40111.9 Ų111.921%0.21452%0.523CS..G310 helixtrans-82.5-7.7-177.4-74-9.7000113.4K209 Y211 E215 N216 V217 R225K209-D213 VanDerWaalsContact O-CB 3.31Å; K209-D213 WeakPolarHBondContact O-CB 3.42Å; K209-D213 PolarHBondContact O-N 3.39Å; Y211-D213 VanDerWaalsContact C-N 3.32Å; Y211-D213 PolarHBondContact O-N 3.15Å; D213-E215 PolarHBondContact O-N 2.71Å; D213-E215 VanDerWaalsContact O-N 3.09Å; D213-N216 PolarHBondContact O-N 3.27Å; D213-N216 VanDerWaalsContact O-N 3.14Å; D213-V217 HydrophobicContact CB-CG2 3.87Å; D213-V217 WeakPolarHBondContact O-CG2 3.3Å; D213-R225 IonicContact OD2-CZ 3.59Å; D213-R225 IonicContact OD2-NH1 2.74Å; D213-R225 PolarHBondContact OD2-NH1 3.14Å; D213-R225 IonicContact OD2-NH2 3.9Å
214R67.7Low70.5Confident218 Ų218114.9 Ų114.982%0.82354%0.536SS*.G310 helixtrans-59.7-24.3179.8-163.1179.7-177.8-173.5-0.3112.3L210 Y211 K212L210-R214 PolarHBondContact O-N 2.91Å; Y211-R214 WeakPolarHBondContact O-CB 3.46Å; Y211-R214 PolarHBondContact O-N 3.48Å; K212-R214 VanDerWaalsContact C-N 3.32Å; K212-R214 PolarHBondContact O-N 3.09Å
215E65.6Low69.5Low164 Ų164114.7 Ų114.777%0.76653%0.526SS*.G310 helixtrans-76.8-22-179-67.5177.3174.900113.7D213D213-E215 PolarHBondContact O-N 2.71Å; D213-E215 VanDerWaalsContact O-N 3.09Å
216N59.7Low68.8Low139 Ų139116.5 Ų116.574%0.74353%0.533SS*.THydrogen-bonded Turntrans-130.15.6-163.1-74.4-35.1000116.9D213D213-N216 PolarHBondContact O-N 3.27Å; D213-N216 VanDerWaalsContact O-N 3.14Å
217V57Low68.1Low54 Ų54120.3 Ų120.333%0.32755%0.55SS.*  trans-117.8129.1-159.7-177.70000116.6D213 M221D213-V217 HydrophobicContact CB-CG2 3.87Å; D213-V217 WeakPolarHBondContact O-CG2 3.3Å; V217-M221 HydrophobicContact CG1-CB 3.58Å; V217-M221 HydrophobicContact CG1-CG 4.47Å
218V60.4Low67.5Low107 Ų107121 Ų12165%0.64855%0.553SS**  trans-55.6131.6169.4-179.30000111.9Q220 M221 T222V218-Q220 PolarHBondContact O-N 3.24Å; V218-M221 PolarHBondContact O-N 3.48Å; V218-M221 VanDerWaalsContact O-N 3.11Å; V218-T222 PolarHBondContact O-N 3.41Å; V218-T222 PolarHBondContact O-OG1 2.92Å
219L59.7Low66.8Low155 Ų155114.7 Ų114.781%0.81254%0.535SS*.Hα-helixtrans-47.3-36.2-173.3-80.5113000115.6T222 H223L219-T222 WeakPolarHBondContact O-CB 3.44Å; L219-T222 PolarHBondContact O-N 3.39Å; L219-H223 PolarHBondContact O-N 2.93Å
220Q56.7Low66.6Low156 Ų156117.2 Ų117.273%0.72955%0.546SS*.Hα-helixtrans-65.4-44.7-178.9-87.3-176.5-2500113.3V218 T222 H223 Q224V218-Q220 PolarHBondContact O-N 3.24Å; Q220-T222 PolarHBondContact O-N 3.37Å; Q220-H223 PolarHBondContact O-N 2.96Å; Q220-Q224 PolarHBondContact O-N 2.98Å; Q220-Q224 VanDerWaalsContact O-N 3.13Å
221M63.2Low66.7Low112 Ų112116.2 Ų116.255%0.55254%0.541SS*.Hα-helixtrans-60.9-39.5175.5-74.6-88.8-165.600110.4V217 V218 R225V217-M221 HydrophobicContact CG1-CB 3.58Å; V217-M221 HydrophobicContact CG1-CG 4.47Å; V218-M221 PolarHBondContact O-N 3.48Å; V218-M221 VanDerWaalsContact O-N 3.11Å; M221-R225 WeakPolarHBondContact O-CB 3.45Å; M221-R225 VanDerWaalsContact O-CG 3.27Å; M221-R225 WeakPolarHBondContact O-CG 3.32Å; M221-R225 PolarHBondContact O-N 3.21Å
222T62.6Low66.4Low39 Ų39108.3 Ų108.324%0.23951%0.51CS..Hα-helixtrans-63.2-41.6176.7-47.50000111.5V218 L219 Q220 R225 R226V218-T222 PolarHBondContact O-N 3.41Å; V218-T222 PolarHBondContact O-OG1 2.92Å; L219-T222 WeakPolarHBondContact O-CB 3.44Å; L219-T222 PolarHBondContact O-N 3.39Å; Q220-T222 PolarHBondContact O-N 3.37Å; T222-R225 PolarHBondContact O-N 2.74Å; T222-R226 WeakPolarHBondContact O-CB 3.45Å; T222-R226 VanDerWaalsContact O-CG 3.29Å; T222-R226 WeakPolarHBondContact O-CG 3.29Å; T222-R226 PolarHBondContact O-N 3.4Å
223H63.5Low66.4Low103 Ų103104.5 Ų104.548%0.47750%0.496SS..Hα-helixtrans-65.8-48.9179.5-177.4-98.8000112.7L219 Q220 R225 R226 M227L219-H223 PolarHBondContact O-N 2.93Å; Q220-H223 PolarHBondContact O-N 2.96Å; H223-R225 VanDerWaalsContact C-N 3.31Å; H223-R225 PolarHBondContact O-N 3.28Å; H223-R226 WeakPolarHBondContact O-CB 3.08Å; H223-R226 PolarHBondContact O-N 3.3Å; H223-M227 WeakPolarHBondContact CE1-CE 3.43Å; H223-M227 PolarHBondContact O-N 2.96Å
224Q66.4Low66.8Low104 Ų104102.7 Ų102.749%0.48649%0.487SS..Hα-helixtrans-61.1-40.8176.9-72.7-173.6-10.300111.8Q220 M227 K228Q220-Q224 PolarHBondContact O-N 2.98Å; Q220-Q224 VanDerWaalsContact O-N 3.13Å; Q224-M227 PolarHBondContact O-N 3.1Å; Q224-K228 PolarHBondContact O-N 3.26Å; Q224-K228 VanDerWaalsContact O-N 3.07Å
225R64.9Low67.3Low84 Ų8492.5 Ų92.532%0.31745%0.449SS..Hα-helixtrans-65.6-37.9175.6-74.1178.1180-164.44.6112.6L210 D213 M221 T222 H223 M227 K228 S229L210-R225 HydrophobicContact CD2-CB 4.42Å; D213-R225 IonicContact OD2-CZ 3.59Å; D213-R225 IonicContact OD2-NH1 2.74Å; D213-R225 PolarHBondContact OD2-NH1 3.14Å; D213-R225 IonicContact OD2-NH2 3.9Å; M221-R225 WeakPolarHBondContact O-CB 3.45Å; M221-R225 VanDerWaalsContact O-CG 3.27Å; M221-R225 WeakPolarHBondContact O-CG 3.32Å; M221-R225 PolarHBondContact O-N 3.21Å; T222-R225 PolarHBondContact O-N 2.74Å; H223-R225 VanDerWaalsContact C-N 3.31Å; H223-R225 PolarHBondContact O-N 3.28Å; R225-M227 VanDerWaalsContact C-N 3.33Å; R225-M227 PolarHBondContact O-N 3.38Å; R225-K228 PolarHBondContact O-N 3.09Å; R225-S229 VanDerWaalsContact O-CB 3.25Å; R225-S229 WeakPolarHBondContact O-CB 3.11Å; R225-S229 PolarHBondContact O-N 3.39Å
226R68.4Low68Low162 Ų16285 Ų8561%0.61142%0.415SS*.Hα-helixtrans-61.1-40.7173.5-79.9177.1-178.3-1742.4111.8T222 H223 S229 K230T222-R226 WeakPolarHBondContact O-CB 3.45Å; T222-R226 VanDerWaalsContact O-CG 3.29Å; T222-R226 WeakPolarHBondContact O-CG 3.29Å; T222-R226 PolarHBondContact O-N 3.4Å; H223-R226 WeakPolarHBondContact O-CB 3.08Å; H223-R226 PolarHBondContact O-N 3.3Å; R226-S229 PolarHBondContact O-N 3Å; R226-K230 WeakPolarHBondContact O-CG 3.11Å; R226-K230 PolarHBondContact O-N 2.93Å
227M67.3Low68.9Low102 Ų10280.5 Ų80.550%0.50239%0.393SS..Hα-helixtrans-64.4-47.7175.9-73.1-171.5164.600111.9H223 Q224 R225 S229 K230 L231H223-M227 WeakPolarHBondContact CE1-CE 3.43Å; H223-M227 PolarHBondContact O-N 2.96Å; Q224-M227 PolarHBondContact O-N 3.1Å; R225-M227 VanDerWaalsContact C-N 3.33Å; R225-M227 PolarHBondContact O-N 3.38Å; M227-S229 VanDerWaalsContact C-N 3.32Å; M227-S229 PolarHBondContact O-N 3.45Å; M227-K230 PolarHBondContact O-N 3.47Å; M227-L231 PolarHBondContact O-N 3Å
228K68.6Low70Confident159 Ų15978 Ų7869%0.69138%0.378SS*.Hα-helixtrans-59.8-41.6175.4-70-176.6178.5-178.70112Q224 R225 L231 L232Q224-K228 PolarHBondContact O-N 3.26Å; Q224-K228 VanDerWaalsContact O-N 3.07Å; R225-K228 PolarHBondContact O-N 3.09Å; K228-L231 PolarHBondContact O-N 2.66Å; K228-L232 WeakPolarHBondContact O-CB 3.32Å; K228-L232 PolarHBondContact O-N 3.27Å
229S69.4Low71Confident37 Ų3773.1 Ų73.126%0.25935%0.348SS..Hα-helixtrans-64.2-40.9177174.90000112.4R225 R226 M227 L231 L232 L233R225-S229 VanDerWaalsContact O-CB 3.25Å; R225-S229 WeakPolarHBondContact O-CB 3.11Å; R225-S229 PolarHBondContact O-N 3.39Å; R226-S229 PolarHBondContact O-N 3Å; M227-S229 VanDerWaalsContact C-N 3.32Å; M227-S229 PolarHBondContact O-N 3.45Å; S229-L231 PolarHBondContact O-N 3.5Å; S229-L232 PolarHBondContact O-N 3.34Å; S229-L233 VanDerWaalsContact O-CB 3.31Å; S229-L233 WeakPolarHBondContact O-CB 3.04Å; S229-L233 PolarHBondContact O-N 3.41Å
230K75.2Confident72.1Confident143 Ų14371.8 Ų71.862%0.62234%0.336SS*.Hα-helixtrans-60.3-47.1176.1-79-178.7179.7-176.80111.5R226 M227 L233 T234R226-K230 WeakPolarHBondContact O-CG 3.11Å; R226-K230 PolarHBondContact O-N 2.93Å; M227-K230 PolarHBondContact O-N 3.47Å; K230-L233 PolarHBondContact O-N 3.49Å; K230-T234 WeakPolarHBondContact O-CG2 3.29Å; K230-T234 PolarHBondContact O-N 3.25Å
231L74.6Confident73.3Confident37 Ų3766.2 Ų66.219%0.19431%0.311CS..Hα-helixtrans-64.2-42.5177.8-172.973.4000112.1M227 K228 S229 L233 T234 L235 T290M227-L231 PolarHBondContact O-N 3Å; K228-L231 PolarHBondContact O-N 2.66Å; S229-L231 PolarHBondContact O-N 3.5Å; L231-L233 VanDerWaalsContact C-N 3.31Å; L231-L233 PolarHBondContact O-N 2.92Å; L231-T234 PolarHBondContact O-N 3.43Å; L231-T234 PolarHBondContact O-OG1 3.01Å; L231-L235 HydrophobicContact CG-CD1 4.44Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.09Å; L231-T290 HydrophobicContact CD1-CG2 4.12Å
232L74.4Confident74.1Confident11 Ų1161 Ų616%0.05829%0.285CS..Hα-helixtrans-62.8-42.1176.7-171.1147.9000111.3R121 I125 L202 I203 V206 K228 S229 T234 L235 A236R121-L232 HydrophobicContact CB-CD1 4.33Å; I125-L232 HydrophobicContact CD1-CD1 3.2Å; L202-L232 HydrophobicContact CB-CD1 4.5Å; L202-L232 HydrophobicContact CB-CD2 4.43Å; L202-L232 HydrophobicContact CD1-CD1 4.39Å; I203-L232 HydrophobicContact CG1-CD2 3.87Å; V206-L232 HydrophobicContact CG2-CD1 4.49Å; K228-L232 WeakPolarHBondContact O-CB 3.32Å; K228-L232 PolarHBondContact O-N 3.27Å; S229-L232 PolarHBondContact O-N 3.34Å; L232-T234 VanDerWaalsContact C-N 3.29Å; L232-T234 PolarHBondContact O-N 2.86Å; L232-L235 PolarHBondContact O-N 3.3Å; L232-A236 WeakPolarHBondContact O-CB 3.47Å; L232-A236 PolarHBondContact O-N 3.4Å
233L78Confident75Confident68 Ų6859.3 Ų59.336%0.35628%0.275SS..Hα-helixtrans-63-37.1175.6-175.163.2000111.5S229 K230 L231 T237 R289S229-L233 VanDerWaalsContact O-CB 3.31Å; S229-L233 WeakPolarHBondContact O-CB 3.04Å; S229-L233 PolarHBondContact O-N 3.41Å; K230-L233 PolarHBondContact O-N 3.49Å; L231-L233 VanDerWaalsContact C-N 3.31Å; L231-L233 PolarHBondContact O-N 2.92Å; L233-T237 WeakPolarHBondContact O-CB 3.18Å; L233-T237 PolarHBondContact O-N 2.9Å; L233-T237 PolarHBondContact O-OG1 3.28Å; L233-R289 VanDerWaalsContact CD2-NH2 3.28Å
234T80.2Confident75.9Confident3 Ų356.3 Ų56.32%0.01827%0.268CS..Hα-helixtrans-64.1-48.2176.872.30000111.5K230 L231 L232 A236 T237 C238 F285 R289K230-T234 WeakPolarHBondContact O-CG2 3.29Å; K230-T234 PolarHBondContact O-N 3.25Å; L231-T234 PolarHBondContact O-N 3.43Å; L231-T234 PolarHBondContact O-OG1 3.01Å; L232-T234 VanDerWaalsContact C-N 3.29Å; L232-T234 PolarHBondContact O-N 2.86Å; T234-A236 VanDerWaalsContact C-N 3.34Å; T234-T237 PolarHBondContact O-N 2.99Å; T234-C238 WeakPolarHBondContact O-CB 3.34Å; T234-C238 PolarHBondContact O-N 3.5Å; T234-F285 WeakPolarHBondContact O-CE1 3.05Å; T234-R289 HydrophobicContact CG2-CB 3.81Å; T234-R289 HydrophobicContact CG2-CG 3.38Å; T234-R289 VanDerWaalsContact CG2-NE 3.26Å
235L78.1Confident76.7Confident3 Ų352.2 Ų52.22%0.01625%0.25CC..Hα-helixtrans-62.7-44.2179.5-70.8170.6000110.7L117 R121 Y199 L231 L232 T237 C238 V239 L286L117-L235 HydrophobicContact CD1-CD2 4.45Å; R121-L235 HydrophobicContact CG-CD1 4.47Å; Y199-L235 HydrophobicContact CE1-CB 4.19Å; L231-L235 HydrophobicContact CG-CD1 4.44Å; L231-L235 WeakPolarHBondContact O-CG 3.41Å; L231-L235 PolarHBondContact O-N 3.09Å; L232-L235 PolarHBondContact O-N 3.3Å; L235-T237 VanDerWaalsContact C-N 3.34Å; L235-T237 PolarHBondContact O-N 3.37Å; L235-C238 WeakPolarHBondContact O-CB 3.45Å; L235-C238 PolarHBondContact O-N 3.04Å; L235-V239 WeakPolarHBondContact O-CG2 3.03Å; L235-V239 PolarHBondContact O-N 3.32Å; L235-L286 HydrophobicContact CD2-CD2 4.29Å
236A79.3Confident77.3Confident8 Ų849.1 Ų49.17%0.06624%0.239CC..Hα-helixtrans-62.8-39.7177.400000112.6Y199 I203 L232 T234 V239 F240Y199-A236 HydrophobicContact CD1-CB 3.65Å; Y199-A236 HydrophobicContact CE1-CB 4.33Å; Y199-A236 HydrophobicContact CG-CB 4.01Å; I203-A236 HydrophobicContact CD1-CB 3.51Å; I203-A236 HydrophobicContact CG1-CB 4.26Å; L232-A236 WeakPolarHBondContact O-CB 3.47Å; L232-A236 PolarHBondContact O-N 3.4Å; T234-A236 VanDerWaalsContact C-N 3.34Å; A236-V239 PolarHBondContact O-N 2.82Å; A236-F240 VanDerWaalsContact O-CB 3.27Å; A236-F240 WeakPolarHBondContact O-CB 3.4Å; A236-F240 PolarHBondContact O-N 3.37Å
237T79.2Confident77.8Confident44 Ų4445.4 Ų45.427%0.2723%0.225SC..Hα-helixtrans-66.9-40.4175.2-54.10000111.6L233 T234 L235 F240 I241 F285L233-T237 WeakPolarHBondContact O-CB 3.18Å; L233-T237 PolarHBondContact O-N 2.9Å; L233-T237 PolarHBondContact O-OG1 3.28Å; T234-T237 PolarHBondContact O-N 2.99Å; L235-T237 VanDerWaalsContact C-N 3.34Å; L235-T237 PolarHBondContact O-N 3.37Å; T237-F240 PolarHBondContact O-N 3.42Å; T237-I241 HydrophobicContact CG2-CD1 4.01Å; T237-I241 HydrophobicContact CG2-CG1 4.49Å; T237-I241 VanDerWaalsContact O-CG1 3.27Å; T237-I241 WeakPolarHBondContact O-CG1 3.25Å; T237-I241 PolarHBondContact O-N 2.88Å; T237-F285 HydrophobicContact CG2-CE1 4Å; T237-F285 HydrophobicContact CG2-CE2 4.19Å; T237-F285 HydrophobicContact CG2-CZ 3.62Å
238C81.2Confident78.5Confident1 Ų144.3 Ų44.31%0.00722%0.221CC..Hα-helixtrans-59.6-47.7174.5177.60000111.5T234 L235 F240 I241 H242 N282T234-C238 WeakPolarHBondContact O-CB 3.34Å; T234-C238 PolarHBondContact O-N 3.5Å; L235-C238 WeakPolarHBondContact O-CB 3.45Å; L235-C238 PolarHBondContact O-N 3.04Å; C238-F240 VanDerWaalsContact C-N 3.34Å; C238-F240 PolarHBondContact O-N 2.89Å; C238-I241 PolarHBondContact O-N 3.46Å; C238-H242 WeakPolarHBondContact O-CB 3.35Å; C238-H242 PolarHBondContact O-N 3Å; C238-N282 WeakPolarHBondContact CA-OD1 3.39Å; C238-N282 PolarHBondContact O-ND2 3.46Å; C238-N282 PolarHBondContact O-OD1 2.93Å; C238-N282 VanDerWaalsContact SG-CB 3.56Å; C238-N282 PolarHBondContact SG-OD1 3.41Å
239V79.8Confident78.7Confident4 Ų437.3 Ų37.32%0.02419%0.194CC..Hα-helixtrans-66.8-35.2176175.80000111.8V196 Y199 L235 A236 H242 A243V196-V239 HydrophobicContact CG2-CG1 4.41Å; Y199-V239 HydrophobicContact CD2-CB 3.88Å; Y199-V239 HydrophobicContact CD2-CG1 3.76Å; Y199-V239 HydrophobicContact CD2-CG2 4.12Å; Y199-V239 HydrophobicContact CE2-CB 3.72Å; Y199-V239 HydrophobicContact CE2-CG1 3.8Å; Y199-V239 HydrophobicContact CE2-CG2 3.42Å; Y199-V239 VanDerWaalsContact CE2-CG2 3.42Å; L235-V239 WeakPolarHBondContact O-CG2 3.03Å; L235-V239 PolarHBondContact O-N 3.32Å; A236-V239 PolarHBondContact O-N 2.82Å; V239-H242 PolarHBondContact O-N 3.47Å; V239-A243 WeakPolarHBondContact O-CB 3.45Å; V239-A243 PolarHBondContact O-N 3.41Å
240F82.7Confident78.9Confident127 Ų12736.9 Ų36.956%0.55719%0.19SC*.Hα-helixtrans-65.3-42.5174.6-171.9-93.4000112A236 T237 C238 A243 A244A236-F240 VanDerWaalsContact O-CB 3.27Å; A236-F240 WeakPolarHBondContact O-CB 3.4Å; A236-F240 PolarHBondContact O-N 3.37Å; T237-F240 PolarHBondContact O-N 3.42Å; C238-F240 VanDerWaalsContact C-N 3.34Å; C238-F240 PolarHBondContact O-N 2.89Å; F240-A243 PolarHBondContact O-N 3.24Å; F240-A244 VanDerWaalsContact O-CB 3.26Å; F240-A244 WeakPolarHBondContact O-CB 3.44Å; F240-A244 PolarHBondContact O-N 3.45Å
241I82.7Confident79Confident40 Ų4034.3 Ų34.321%0.20518%0.182CC..Hα-helixtrans-61.5-46.7174.4-69.2164000110T237 C238 A244 T245 L281T237-I241 HydrophobicContact CG2-CD1 4.01Å; T237-I241 HydrophobicContact CG2-CG1 4.49Å; T237-I241 VanDerWaalsContact O-CG1 3.27Å; T237-I241 WeakPolarHBondContact O-CG1 3.25Å; T237-I241 PolarHBondContact O-N 2.88Å; C238-I241 PolarHBondContact O-N 3.46Å; I241-A244 PolarHBondContact O-N 3.46Å; I241-T245 WeakPolarHBondContact O-CB 3.31Å; I241-T245 WeakPolarHBondContact O-CG2 3.49Å; I241-T245 PolarHBondContact O-N 3.28Å; I241-T245 PolarHBondContact O-OG1 2.98Å; I241-L281 HydrophobicContact CG2-CB 4.17Å; I241-L281 HydrophobicContact CG2-CD1 4.06Å
242H79.7Confident79Confident3 Ų335 Ų351%0.01418%0.184CC..Hα-helixtrans-62.8-43.4177.5-170.658.1000112.3C238 V239 T245 F246 S278C238-H242 WeakPolarHBondContact O-CB 3.35Å; C238-H242 PolarHBondContact O-N 3Å; V239-H242 PolarHBondContact O-N 3.47Å; H242-T245 WeakPolarHBondContact CA-OG1 3.5Å; H242-T245 PolarHBondContact O-OG1 3.49Å; H242-F246 WeakPolarHBondContact O-CB 3.4Å; H242-F246 PolarHBondContact O-N 3.45Å; H242-S278 PolarHBondContact ND1-OG 3.03Å
243A81.4Confident78.7Confident3 Ų335 Ų353%0.02519%0.187CC..Hα-helixtrans-64.9-47.3177.800000112.1L192 V196 V239 F240 T245 F246 Y247L192-A243 HydrophobicContact CD1-CB 4.16Å; L192-A243 HydrophobicContact CD2-CB 4.03Å; L192-A243 HydrophobicContact CG-CB 3.86Å; V196-A243 HydrophobicContact CG2-CB 3.31Å; V239-A243 WeakPolarHBondContact O-CB 3.45Å; V239-A243 PolarHBondContact O-N 3.41Å; F240-A243 PolarHBondContact O-N 3.24Å; A243-T245 VanDerWaalsContact C-N 3.34Å; A243-T245 PolarHBondContact O-N 2.91Å; A243-F246 PolarHBondContact O-N 3.11Å; A243-Y247 HydrophobicContact CB-CD2 4.38Å; A243-Y247 HydrophobicContact CB-CE2 4.41Å; A243-Y247 WeakPolarHBondContact O-CB 3.47Å; A243-Y247 WeakPolarHBondContact O-CD2 3.28Å; A243-Y247 PolarHBondContact O-N 3.34Å
244A83.3Confident78.3Confident40 Ų4034.8 Ų34.833%0.33119%0.191SC..Hα-helixtrans-59.9-45.9178.400000111.4F240 I241 Y247 L248F240-A244 VanDerWaalsContact O-CB 3.26Å; F240-A244 WeakPolarHBondContact O-CB 3.44Å; F240-A244 PolarHBondContact O-N 3.45Å; I241-A244 PolarHBondContact O-N 3.46Å; A244-Y247 PolarHBondContact O-N 3.31Å; A244-L248 WeakPolarHBondContact O-CB 3.17Å; A244-L248 WeakPolarHBondContact O-CG 3.24Å; A244-L248 PolarHBondContact O-N 3.28Å
245T82.1Confident78Confident17 Ų1738.6 Ų38.610%0.10421%0.21CC..Hα-helixtrans-65.4-40.6177.847.30000112.3I241 H242 A243 G249 L274 S278I241-T245 WeakPolarHBondContact O-CB 3.31Å; I241-T245 WeakPolarHBondContact O-CG2 3.49Å; I241-T245 PolarHBondContact O-N 3.28Å; I241-T245 PolarHBondContact O-OG1 2.98Å; H242-T245 WeakPolarHBondContact CA-OG1 3.5Å; H242-T245 PolarHBondContact O-OG1 3.49Å; A243-T245 VanDerWaalsContact C-N 3.34Å; A243-T245 PolarHBondContact O-N 2.91Å; T245-G249 PolarHBondContact O-N 2.89Å; T245-L274 WeakPolarHBondContact CB-O 3.45Å; T245-L274 WeakPolarHBondContact CG2-O 3.29Å; T245-S278 WeakPolarHBondContact OG1-CB 3.17Å
246F77.6Confident77.6Confident19 Ų1938.5 Ų38.58%0.08321%0.211CC..Hα-helixtrans-66.1-46.4174.8-174.5-115.2000112.6Y107 N188 N189 L192 H242 A243 L248 G249 T250Y107-F246 HydrophobicContact CE1-CD2 4.49Å; Y107-F246 AromaticContact CE1-CE2 3.88Å; Y107-F246 HydrophobicContact CE1-CE2 3.88Å; Y107-F246 HydrophobicContact CE1-CZ 4.3Å; Y107-F246 HydrophobicContact CE2-CD2 4.44Å; Y107-F246 AromaticContact CZ-CD2 3.68Å; Y107-F246 AromaticContact CZ-CE2 3.52Å; Y107-F246 WeakPolarHBondContact OH-CD2 3.3Å; Y107-F246 WeakPolarHBondContact OH-CE2 3.46Å; Y107-F246 VanDerWaalsContact OH-CG 3.27Å; Y107-F246 WeakPolarHBondContact OH-CG 3.25Å; Y107-F246 WeakPolarHBondContact OH-CZ 3.17Å; N188-F246 HydrophobicContact CB-CE1 4.5Å; N188-F246 HydrophobicContact CB-CZ 4.28Å; N189-F246 WeakPolarHBondContact OD1-CE1 3.31Å; L192-F246 HydrophobicContact CD2-CB 3.55Å; L192-F246 HydrophobicContact CD2-CD1 3.26Å; L192-F246 HydrophobicContact CD2-CE1 4.18Å; L192-F246 HydrophobicContact CD2-CG 3.73Å; H242-F246 WeakPolarHBondContact O-CB 3.4Å; H242-F246 PolarHBondContact O-N 3.45Å; A243-F246 PolarHBondContact O-N 3.11Å; F246-L248 VanDerWaalsContact C-N 3.29Å; F246-L248 PolarHBondContact O-N 3.32Å; F246-G249 CarbonylContact O-C 3.42Å; F246-G249 WeakPolarHBondContact O-CA 3.09Å; F246-G249 PolarHBondContact O-N 3.2Å; F246-T250 PolarHBondContact O-N 2.92Å; F246-T250 PolarHBondContact O-OG1 2.76Å; F246-T250 VanDerWaalsContact O-OG1 3.11Å
247Y79.6Confident77Confident85 Ų8541.6 Ų41.633%0.33323%0.225SC..Hα-helixtrans-59.8-41.3177.2-84.1-64.5000111.9A193 A243 A244 G249 T250 I251A193-Y247 WeakPolarHBondContact CA-OH 3.16Å; A193-Y247 WeakPolarHBondContact CB-OH 2.97Å; A193-Y247 PolarHBondContact N-OH 3.42Å; A243-Y247 HydrophobicContact CB-CD2 4.38Å; A243-Y247 HydrophobicContact CB-CE2 4.41Å; A243-Y247 WeakPolarHBondContact O-CB 3.47Å; A243-Y247 WeakPolarHBondContact O-CD2 3.28Å; A243-Y247 PolarHBondContact O-N 3.34Å; A244-Y247 PolarHBondContact O-N 3.31Å; Y247-G249 VanDerWaalsContact C-N 3.34Å; Y247-T250 PolarHBondContact O-N 3.42Å; Y247-I251 WeakPolarHBondContact O-CB 3.4Å; Y247-I251 VanDerWaalsContact O-CG1 3.23Å; Y247-I251 WeakPolarHBondContact O-CG1 3.32Å; Y247-I251 PolarHBondContact O-N 3.28Å
248L80.6Confident76.6Confident78 Ų7843.3 Ų43.341%0.40824%0.244SC..Hα-helixtrans-59.6-47.5172.3-71.4171.5000110.5A244 F246 T250 I251 F252 L274A244-L248 WeakPolarHBondContact O-CB 3.17Å; A244-L248 WeakPolarHBondContact O-CG 3.24Å; A244-L248 PolarHBondContact O-N 3.28Å; F246-L248 VanDerWaalsContact C-N 3.29Å; F246-L248 PolarHBondContact O-N 3.32Å; L248-T250 PolarHBondContact O-N 2.6Å; L248-I251 PolarHBondContact O-N 2.89Å; L248-F252 HydrophobicContact CB-CE2 4.42Å; L248-F252 WeakPolarHBondContact O-CD2 3.12Å; L248-F252 PolarHBondContact O-N 3.37Å; L248-L274 HydrophobicContact CB-CD1 4.33Å; L248-L274 HydrophobicContact CD1-CD1 4.43Å
249G73.6Confident76Confident13 Ų1344 Ų4413%0.13425%0.249CC..Hα-helixtrans-56.4-45.7174.800000113.6T245 F246 Y247 F252 G253T245-G249 PolarHBondContact O-N 2.89Å; F246-G249 CarbonylContact O-C 3.42Å; F246-G249 WeakPolarHBondContact O-CA 3.09Å; F246-G249 PolarHBondContact O-N 3.2Å; Y247-G249 VanDerWaalsContact C-N 3.34Å; G249-F252 PolarHBondContact O-N 2.97Å; G249-G253 PolarHBondContact O-N 2.9Å
250T74Confident75.4Confident28 Ų2851.1 Ų51.117%0.17229%0.286CS..Hα-helixtrans-66.5-40.2178.1-56.10000111.8N189 F246 Y247 L248 G253 S254N189-T250 PolarHBondContact OD1-OG1 2.95Å; F246-T250 PolarHBondContact O-N 2.92Å; F246-T250 PolarHBondContact O-OG1 2.76Å; F246-T250 VanDerWaalsContact O-OG1 3.11Å; Y247-T250 PolarHBondContact O-N 3.42Å; L248-T250 PolarHBondContact O-N 2.6Å; T250-G253 PolarHBondContact O-N 3.14Å; T250-S254 WeakPolarHBondContact O-CB 3.44Å; T250-S254 PolarHBondContact O-N 3.02Å; T250-S254 PolarHBondContact O-OG 3.13Å
251I76.4Confident74.7Confident89 Ų8950 Ų5046%0.45629%0.286SS..Hα-helixtrans-61.9-52.1175.7-70.9165.6000109.4Y247 L248 G253 S254 I255Y247-I251 WeakPolarHBondContact O-CB 3.4Å; Y247-I251 VanDerWaalsContact O-CG1 3.23Å; Y247-I251 WeakPolarHBondContact O-CG1 3.32Å; Y247-I251 PolarHBondContact O-N 3.28Å; L248-I251 PolarHBondContact O-N 2.89Å; I251-G253 VanDerWaalsContact C-N 3.29Å; I251-G253 PolarHBondContact O-N 3.5Å; I251-S254 PolarHBondContact O-N 3.31Å; I251-S254 VanDerWaalsContact O-N 3.12Å; I251-S254 PolarHBondContact O-OG 3.45Å; I251-I255 HydrophobicContact CG2-CD1 3.85Å; I251-I255 VanDerWaalsContact O-CG1 3.32Å; I251-I255 WeakPolarHBondContact O-CG1 3.35Å; I251-I255 PolarHBondContact O-N 2.87Å
252F75.1Confident74Confident50 Ų5052.8 Ų52.822%0.21930%0.301CS..Hα-helixtrans-59.9-39.9176.8-72.6-62.9000112.1L248 G249 I255 A256 Y271 L274L248-F252 HydrophobicContact CB-CE2 4.42Å; L248-F252 WeakPolarHBondContact O-CD2 3.12Å; L248-F252 PolarHBondContact O-N 3.37Å; G249-F252 PolarHBondContact O-N 2.97Å; F252-I255 PolarHBondContact O-N 3.47Å; F252-A256 WeakPolarHBondContact O-CB 3.23Å; F252-A256 PolarHBondContact O-N 3.44Å; F252-Y271 AromaticContact CD1-CD2 3.93Å; F252-Y271 HydrophobicContact CD1-CD2 3.93Å; F252-Y271 HydrophobicContact CD1-CG 4.09Å; F252-Y271 HydrophobicContact CD2-CG 4.37Å; F252-Y271 AromaticContact CE1-CD2 3.97Å; F252-Y271 HydrophobicContact CE1-CD2 3.97Å; F252-Y271 HydrophobicContact CE1-CG 4.02Å; F252-Y271 HydrophobicContact CE2-CG 4.32Å; F252-Y271 HydrophobicContact CG-CD2 4.47Å; F252-Y271 HydrophobicContact CG-CG 4.29Å; F252-Y271 HydrophobicContact CZ-CD1 4.47Å; F252-Y271 HydrophobicContact CZ-CG 4.15Å; F252-L274 HydrophobicContact CD2-CD1 4.41Å; F252-L274 HydrophobicContact CE2-CD1 3.91Å
253G68.1Low73.4Confident13 Ų1355.7 Ų55.713%0.13432%0.319CS..Hα-helixtrans-62.9-40.3174.300000113G249 T250 I251 A256 I257G249-G253 PolarHBondContact O-N 2.9Å; T250-G253 PolarHBondContact O-N 3.14Å; I251-G253 VanDerWaalsContact C-N 3.29Å; I251-G253 PolarHBondContact O-N 3.5Å; G253-A256 WeakPolarHBondContact O-CB 3.45Å; G253-A256 PolarHBondContact O-N 3.46Å; G253-I257 WeakPolarHBondContact O-CB 3.47Å; G253-I257 WeakPolarHBondContact O-CD1 3.28Å; G253-I257 WeakPolarHBondContact O-CG1 3.44Å; G253-I257 PolarHBondContact O-N 3.15Å
254S70.6Confident72.8Confident63 Ų6360.4 Ų60.444%0.44134%0.34SS..Hα-helixtrans-68.4-38.9177.469.90000112.4T250 I251 I257 A258T250-S254 WeakPolarHBondContact O-CB 3.44Å; T250-S254 PolarHBondContact O-N 3.02Å; T250-S254 PolarHBondContact O-OG 3.13Å; I251-S254 PolarHBondContact O-N 3.31Å; I251-S254 VanDerWaalsContact O-N 3.12Å; I251-S254 PolarHBondContact O-OG 3.45Å; S254-I257 PolarHBondContact O-N 2.83Å; S254-A258 WeakPolarHBondContact O-CB 3.46Å; S254-A258 PolarHBondContact O-N 3.46Å
255I73.3Confident72Confident82 Ų8259.3 Ų59.342%0.42133%0.331SS..Hα-helixtrans-66.5-42.1174.8-60.9166.5000109.5I251 F252 I257 A258 S259 L268I251-I255 HydrophobicContact CG2-CD1 3.85Å; I251-I255 VanDerWaalsContact O-CG1 3.32Å; I251-I255 WeakPolarHBondContact O-CG1 3.35Å; I251-I255 PolarHBondContact O-N 2.87Å; F252-I255 PolarHBondContact O-N 3.47Å; I255-I257 VanDerWaalsContact C-N 3.33Å; I255-I257 PolarHBondContact O-N 3.25Å; I255-A258 PolarHBondContact O-N 2.64Å; I255-A258 VanDerWaalsContact O-N 3.08Å; I255-S259 PolarHBondContact O-N 3.29Å; I255-S259 VanDerWaalsContact O-N 3.12Å; I255-L268 HydrophobicContact CB-CD1 4.46Å; I255-L268 HydrophobicContact CG2-CD1 3.73Å
256A68.8Low71.3Confident2 Ų259.2 Ų59.22%0.01733%0.33CS..Hα-helixtrans-60.6-41.2173.600000112.1F252 G253 A258 S259 A265 L268F252-A256 WeakPolarHBondContact O-CB 3.23Å; F252-A256 PolarHBondContact O-N 3.44Å; G253-A256 WeakPolarHBondContact O-CB 3.45Å; G253-A256 PolarHBondContact O-N 3.46Å; A256-A258 VanDerWaalsContact C-N 3.26Å; A256-A258 PolarHBondContact O-N 2.82Å; A256-S259 PolarHBondContact O-N 3.28Å; A256-S259 PolarHBondContact O-OG 2.95Å; A256-A265 HydrophobicContact CB-CB 4.21Å; A256-A265 VanDerWaalsContact CB-O 3.25Å; A256-A265 WeakPolarHBondContact CB-O 3.36Å; A256-A265 WeakPolarHBondContact O-CB 3.47Å; A256-L268 HydrophobicContact CB-CB 3.9Å; A256-L268 HydrophobicContact CB-CD1 4.48Å
257I67.3Low70.7Confident72 Ų7260.3 Ų60.337%0.36934%0.34SS..Hα-helixtrans-67.1-28.7175.3-68.7163.1000111.1I173 R176 G253 S254 I255I173-I257 HydrophobicContact CG2-CG1 4.1Å; R176-I257 PolarHBondContact NE-O 2.98Å; R176-I257 PolarHBondContact NH2-O 3.29Å; G253-I257 WeakPolarHBondContact O-CB 3.47Å; G253-I257 WeakPolarHBondContact O-CD1 3.28Å; G253-I257 WeakPolarHBondContact O-CG1 3.44Å; G253-I257 PolarHBondContact O-N 3.15Å; S254-I257 PolarHBondContact O-N 2.83Å; I255-I257 VanDerWaalsContact C-N 3.33Å; I255-I257 PolarHBondContact O-N 3.25Å
258A70.5Confident70.1Confident80 Ų8057.9 Ų57.966%0.66133%0.332SS*.Hα-helixtrans-79.9-18177.600000114S254 I255 A256S254-A258 WeakPolarHBondContact O-CB 3.46Å; S254-A258 PolarHBondContact O-N 3.46Å; I255-A258 PolarHBondContact O-N 2.64Å; I255-A258 VanDerWaalsContact O-N 3.08Å; A256-A258 VanDerWaalsContact C-N 3.26Å; A256-A258 PolarHBondContact O-N 2.82Å
259S69.4Low69.4Low16 Ų1655.4 Ų55.411%0.11232%0.323CS..  trans-73.9137.8176.960.70000112.4R176 I255 A256 A265R176-S259 PolarHBondContact NH2-O 3.29Å; I255-S259 PolarHBondContact O-N 3.29Å; I255-S259 VanDerWaalsContact O-N 3.12Å; A256-S259 PolarHBondContact O-N 3.28Å; A256-S259 PolarHBondContact O-OG 2.95Å; S259-A265 VanDerWaalsContact OG-CA 3.29Å; S259-A265 WeakPolarHBondContact OG-CA 3.24Å; S259-A265 VanDerWaalsContact OG-CB 3.3Å; S259-A265 WeakPolarHBondContact OG-CB 3.45Å; S259-A265 PolarHBondContact OG-N 3.2Å
260D66.2Low69.1Low153 Ų15357 Ų5782%0.81833%0.326SS*.SBendtrans-75.5-27.2177.8-75.9-31.8000112.5
261N69.3Low68.7Low104 Ų10461.6 Ų61.656%0.55634%0.341SS*.  trans-89.9120.1-179.6-70.3-37.1000111.5V263 E264 A265N261-V263 VanDerWaalsContact C-N 3.27Å; N261-V263 PolarHBondContact O-N 3.27Å; N261-E264 HydrophobicContact CB-CB 3.89Å; N261-E264 PolarHBondContact O-N 2.94Å; N261-E264 VanDerWaalsContact O-N 3.11Å; N261-A265 PolarHBondContact O-N 2.93Å
262I67.7Low68.2Low99 Ų9958.7 Ų58.751%0.50833%0.333SS..Hα-helixtrans-58.1-38.4178.6-60.2172.6000112I14 E264 A265 M266I14-I262 HydrophobicContact CD1-CG2 4.13Å; I262-E264 VanDerWaalsContact C-N 3.35Å; I262-A265 WeakPolarHBondContact O-CB 3.08Å; I262-A265 PolarHBondContact O-N 3.31Å; I262-M266 WeakPolarHBondContact O-CB 3.31Å; I262-M266 WeakPolarHBondContact O-CG 3.44Å; I262-M266 PolarHBondContact O-N 3.11Å
263V66.9Low67.9Low64 Ų6458 Ų5839%0.38833%0.332SS..Hα-helixtrans-66.4-39.2179.3-177.90000111V13 N261 M266 S267V13-V263 HydrophobicContact CG1-CG1 4.32Å; V13-V263 HydrophobicContact CG1-CG2 4.34Å; N261-V263 VanDerWaalsContact C-N 3.27Å; N261-V263 PolarHBondContact O-N 3.27Å; V263-M266 PolarHBondContact O-N 3.43Å; V263-S267 WeakPolarHBondContact O-CB 3.32Å; V263-S267 PolarHBondContact O-N 3.4Å
264E67.6Low68.1Low101 Ų10160.2 Ų60.247%0.47234%0.34SS..Hα-helixtrans-71.2-39.3176.8-165.5175-178.300111.5N261 I262 M266 S267 L268N261-E264 HydrophobicContact CB-CB 3.89Å; N261-E264 PolarHBondContact O-N 2.94Å; N261-E264 VanDerWaalsContact O-N 3.11Å; I262-E264 VanDerWaalsContact C-N 3.35Å; E264-M266 VanDerWaalsContact C-N 3.3Å; E264-M266 PolarHBondContact O-N 2.86Å; E264-S267 PolarHBondContact O-N 3.39Å; E264-S267 PolarHBondContact O-OG 2.82Å; E264-L268 PolarHBondContact O-N 2.93Å
265A66.8Low68.3Low17 Ų1758.8 Ų58.814%0.1433%0.329CS..Hα-helixtrans-56.8-45.7171.500000111.3A256 S259 N261 I262 L268 A269A256-A265 HydrophobicContact CB-CB 4.21Å; A256-A265 VanDerWaalsContact CB-O 3.25Å; A256-A265 WeakPolarHBondContact CB-O 3.36Å; A256-A265 WeakPolarHBondContact O-CB 3.47Å; S259-A265 VanDerWaalsContact OG-CA 3.29Å; S259-A265 WeakPolarHBondContact OG-CA 3.24Å; S259-A265 VanDerWaalsContact OG-CB 3.3Å; S259-A265 WeakPolarHBondContact OG-CB 3.45Å; S259-A265 PolarHBondContact OG-N 3.2Å; N261-A265 PolarHBondContact O-N 2.93Å; I262-A265 WeakPolarHBondContact O-CB 3.08Å; I262-A265 PolarHBondContact O-N 3.31Å; A265-L268 PolarHBondContact O-N 3.45Å; A265-A269 PolarHBondContact O-N 3.16Å
266M67.4Low68.5Low16 Ų1656.2 Ų56.28%0.07932%0.317CS..Hα-helixtrans-71.1-33178.5-72.3-61-74.400112.5I14 L18 Y169 T171 I262 V263 E264 L268 A269 K270I14-M266 HydrophobicContact CD1-CG 4.02Å; I14-M266 HydrophobicContact CG1-CB 4.44Å; I14-M266 HydrophobicContact CG1-CG 4.11Å; I14-M266 HydrophobicContact CG2-CB 4.49Å; I14-M266 HydrophobicContact CG2-CE 3.32Å; I14-M266 HydrophobicContact CG2-CG 4.18Å; L18-M266 HydrophobicContact CD1-CB 4.34Å; L18-M266 HydrophobicContact CD1-CE 3.86Å; L18-M266 HydrophobicContact CD2-CE 4.02Å; Y169-M266 HydrophobicContact CD1-CE 3.61Å; Y169-M266 HydrophobicContact CE1-CE 4.29Å; Y169-M266 HydrophobicContact CG-CE 4.4Å; T171-M266 HydrophobicContact CG2-CE 3.92Å; I262-M266 WeakPolarHBondContact O-CB 3.31Å; I262-M266 WeakPolarHBondContact O-CG 3.44Å; I262-M266 PolarHBondContact O-N 3.11Å; V263-M266 PolarHBondContact O-N 3.43Å; E264-M266 VanDerWaalsContact C-N 3.3Å; E264-M266 PolarHBondContact O-N 2.86Å; M266-L268 VanDerWaalsContact C-N 3.31Å; M266-L268 PolarHBondContact O-N 3.27Å; M266-A269 WeakPolarHBondContact O-CB 3.41Å; M266-A269 PolarHBondContact O-N 3.39Å; M266-A269 HydrophobicContact SD-CB 4.47Å; M266-K270 PolarHBondContact O-N 2.81Å
267S66.4Low69.1Low42 Ų4258.8 Ų58.829%0.29433%0.329SS..Hα-helixtrans-66.7-32.817489.20000112.2V263 E264 K270V263-S267 WeakPolarHBondContact O-CB 3.32Å; V263-S267 PolarHBondContact O-N 3.4Å; E264-S267 PolarHBondContact O-N 3.39Å; E264-S267 PolarHBondContact O-OG 2.82Å; S267-K270 WeakPolarHBondContact O-CB 3.42Å; S267-K270 WeakPolarHBondContact O-CD 3.24Å; S267-K270 WeakPolarHBondContact O-CG 3.37Å
268L66.3Low69.9Low33 Ų3355.6 Ų55.617%0.17331%0.313CS..Hα-helixtrans-75-34.9171.1-74.7164.9000112.2I255 A256 E264 A265 M266 K270 Y271I255-L268 HydrophobicContact CB-CD1 4.46Å; I255-L268 HydrophobicContact CG2-CD1 3.73Å; A256-L268 HydrophobicContact CB-CB 3.9Å; A256-L268 HydrophobicContact CB-CD1 4.48Å; E264-L268 PolarHBondContact O-N 2.93Å; A265-L268 PolarHBondContact O-N 3.45Å; M266-L268 VanDerWaalsContact C-N 3.31Å; M266-L268 PolarHBondContact O-N 3.27Å; L268-K270 PolarHBondContact O-N 3.42Å; L268-K270 VanDerWaalsContact O-N 3.1Å; L268-Y271 WeakPolarHBondContact O-CD2 3.39Å; L268-Y271 PolarHBondContact O-N 2.98Å
269A65.8Low70.4Confident26 Ų2652 Ų5222%0.21528%0.284CS..Hα-helixtrans-59.9-20.3174.200000112.6I173 A265 M266 Y271 G272I173-A269 HydrophobicContact CD1-CB 4.24Å; A265-A269 PolarHBondContact O-N 3.16Å; M266-A269 WeakPolarHBondContact O-CB 3.41Å; M266-A269 PolarHBondContact O-N 3.39Å; M266-A269 HydrophobicContact SD-CB 4.47Å; A269-Y271 PolarHBondContact O-N 2.83Å; A269-G272 WeakPolarHBondContact O-CA 3.07Å; A269-G272 PolarHBondContact O-N 3.16Å
270K67.1Low71.2Confident47 Ų4752.8 Ų52.820%0.20429%0.287CS..G310 helixtrans-50.8-36.3168.4-64.5-173.4-179.4-169.10112.6D17 I21 M266 S267 L268 G272 I273D17-K270 WeakPolarHBondContact O-CE 3.37Å; D17-K270 PolarHBondContact O-NZ 3.23Å; D17-K270 IonicContact OD1-NZ 3.26Å; D17-K270 PolarHBondContact OD1-NZ 3.38Å; I21-K270 HydrophobicContact CD1-CB 3.2Å; I21-K270 HydrophobicContact CD1-CD 3.4Å; I21-K270 HydrophobicContact CD1-CG 3.14Å; M266-K270 PolarHBondContact O-N 2.81Å; S267-K270 WeakPolarHBondContact O-CB 3.42Å; S267-K270 WeakPolarHBondContact O-CD 3.24Å; S267-K270 WeakPolarHBondContact O-CG 3.37Å; L268-K270 PolarHBondContact O-N 3.42Å; L268-K270 VanDerWaalsContact O-N 3.1Å; K270-G272 PolarHBondContact O-N 3.25Å; K270-I273 WeakPolarHBondContact O-CD1 3.07Å; K270-I273 WeakPolarHBondContact O-CG1 3.07Å; K270-I273 PolarHBondContact O-N 2.93Å
271Y66.7Low72.2Confident125 Ų12549.2 Ų49.249%0.4927%0.268SS..G310 helixtrans-73.3-9.1178.2-64.2-72000113.6F252 L268 A269 I273 L274F252-Y271 AromaticContact CD1-CD2 3.93Å; F252-Y271 HydrophobicContact CD1-CD2 3.93Å; F252-Y271 HydrophobicContact CD1-CG 4.09Å; F252-Y271 HydrophobicContact CD2-CG 4.37Å; F252-Y271 AromaticContact CE1-CD2 3.97Å; F252-Y271 HydrophobicContact CE1-CD2 3.97Å; F252-Y271 HydrophobicContact CE1-CG 4.02Å; F252-Y271 HydrophobicContact CE2-CG 4.32Å; F252-Y271 HydrophobicContact CG-CD2 4.47Å; F252-Y271 HydrophobicContact CG-CG 4.29Å; F252-Y271 HydrophobicContact CZ-CD1 4.47Å; F252-Y271 HydrophobicContact CZ-CG 4.15Å; L268-Y271 WeakPolarHBondContact O-CD2 3.39Å; L268-Y271 PolarHBondContact O-N 2.98Å; A269-Y271 PolarHBondContact O-N 2.83Å; Y271-I273 PolarHBondContact O-N 3.01Å; Y271-I273 VanDerWaalsContact O-N 3.15Å; Y271-L274 WeakPolarHBondContact O-CB 3.28Å; Y271-L274 WeakPolarHBondContact O-CG 3.45Å; Y271-L274 PolarHBondContact O-N 3.4Å; Y271-L274 VanDerWaalsContact O-N 3.09Å
272G65.6Low73Confident28 Ų2844.3 Ų44.329%0.28924%0.241SC..G310 helixtrans-58.9-20.2170.500000113.9A269 K270 L274 V275A269-G272 WeakPolarHBondContact O-CA 3.07Å; A269-G272 PolarHBondContact O-N 3.16Å; K270-G272 PolarHBondContact O-N 3.25Å; G272-L274 PolarHBondContact O-N 3.45Å; G272-L274 VanDerWaalsContact O-N 3.09Å; G272-V275 WeakPolarHBondContact O-CB 3.39Å; G272-V275 WeakPolarHBondContact O-CG2 3.24Å; G272-V275 PolarHBondContact O-N 3.33Å
273I67.8Low73.7Confident36 Ų3639.6 Ų39.619%0.18522%0.217CC..Hα-helixtrans-54.1-28.8171.7-59.3159.8000112.2I21 V25 K270 Y271 V275 V276 I277I21-I273 HydrophobicContact CB-CD1 3.74Å; I21-I273 HydrophobicContact CD1-CD1 3.89Å; I21-I273 HydrophobicContact CG1-CD1 3.47Å; I21-I273 VanDerWaalsContact CG1-CD1 3.47Å; I21-I273 HydrophobicContact CG2-CD1 3.14Å; I21-I273 HydrophobicContact CG2-CG1 3.45Å; I21-I273 VanDerWaalsContact CG2-CG1 3.45Å; V25-I273 HydrophobicContact CG2-CB 4.39Å; V25-I273 HydrophobicContact CG2-CD1 4.47Å; V25-I273 HydrophobicContact CG2-CG1 3.77Å; V25-I273 HydrophobicContact CG2-CG2 3.96Å; K270-I273 WeakPolarHBondContact O-CD1 3.07Å; K270-I273 WeakPolarHBondContact O-CG1 3.07Å; K270-I273 PolarHBondContact O-N 2.93Å; Y271-I273 PolarHBondContact O-N 3.01Å; Y271-I273 VanDerWaalsContact O-N 3.15Å; I273-V275 PolarHBondContact O-N 3.46Å; I273-V275 VanDerWaalsContact O-N 3.15Å; I273-V276 WeakPolarHBondContact O-CA 3.41Å; I273-V276 VanDerWaalsContact O-CB 3.3Å; I273-V276 WeakPolarHBondContact O-CB 3.27Å; I273-V276 PolarHBondContact O-N 2.99Å; I273-I277 HydrophobicContact CG2-CD1 4.38Å; I273-I277 HydrophobicContact CG2-CG1 4.45Å; I273-I277 PolarHBondContact O-N 3.16Å; I273-I277 VanDerWaalsContact O-N 3.14Å
274L71.8Confident74.7Confident58 Ų5840.1 Ų40.130%0.30422%0.217SC..Hα-helixtrans-56.5-31.5177-69.1172.3000111.9T245 L248 F252 Y271 G272 I277T245-L274 WeakPolarHBondContact CB-O 3.45Å; T245-L274 WeakPolarHBondContact CG2-O 3.29Å; L248-L274 HydrophobicContact CB-CD1 4.33Å; L248-L274 HydrophobicContact CD1-CD1 4.43Å; F252-L274 HydrophobicContact CD2-CD1 4.41Å; F252-L274 HydrophobicContact CE2-CD1 3.91Å; Y271-L274 WeakPolarHBondContact O-CB 3.28Å; Y271-L274 WeakPolarHBondContact O-CG 3.45Å; Y271-L274 PolarHBondContact O-N 3.4Å; Y271-L274 VanDerWaalsContact O-N 3.09Å; G272-L274 PolarHBondContact O-N 3.45Å; G272-L274 VanDerWaalsContact O-N 3.09Å; L274-I277 HydrophobicContact CD2-CD1 4.48Å
275V75.8Confident75.5Confident34 Ų3437.4 Ų37.421%0.20620%0.204CC..Hα-helixtrans-68.2-37.7175.2-174.90000110.9Y107 G272 I273 S278Y107-V275 HydrophobicContact CE2-CG1 4.28Å; G272-V275 WeakPolarHBondContact O-CB 3.39Å; G272-V275 WeakPolarHBondContact O-CG2 3.24Å; G272-V275 PolarHBondContact O-N 3.33Å; I273-V275 PolarHBondContact O-N 3.46Å; I273-V275 VanDerWaalsContact O-N 3.15Å; V275-S278 WeakPolarHBondContact O-CB 3.21Å; V275-S278 PolarHBondContact O-N 3.31Å; V275-S278 PolarHBondContact O-OG 3.39Å
276V76.7Confident76.3Confident28 Ų2836.7 Ų36.717%0.1720%0.197CC..Hα-helixtrans-64.5-42.8177.7179.20000111.4V25 I28 D29 I273 S278 G279V25-V276 HydrophobicContact CG1-CG1 4.37Å; V25-V276 HydrophobicContact CG1-CG2 4.47Å; I28-V276 HydrophobicContact CG2-CG1 3.96Å; D29-V276 WeakPolarHBondContact OD1-CG1 3.46Å; I273-V276 WeakPolarHBondContact O-CA 3.41Å; I273-V276 VanDerWaalsContact O-CB 3.3Å; I273-V276 WeakPolarHBondContact O-CB 3.27Å; I273-V276 PolarHBondContact O-N 2.99Å; V276-S278 PolarHBondContact O-N 2.04Å; V276-S278 VanDerWaalsContact O-N 3.11Å; V276-G279 PolarHBondContact O-N 2.9Å; V276-G279 VanDerWaalsContact O-N 3.12Å
277I82.3Confident77Confident56 Ų5638.9 Ų38.929%0.28721%0.207SC..Hα-helixtrans-59-27.9177.7-64.3171.9000111.4I28 I273 L274 G279 L280 L281I28-I277 HydrophobicContact CD1-CG1 4.32Å; I273-I277 HydrophobicContact CG2-CD1 4.38Å; I273-I277 HydrophobicContact CG2-CG1 4.45Å; I273-I277 PolarHBondContact O-N 3.16Å; I273-I277 VanDerWaalsContact O-N 3.14Å; L274-I277 HydrophobicContact CD2-CD1 4.48Å; I277-G279 VanDerWaalsContact C-N 3.29Å; I277-G279 PolarHBondContact O-N 2.88Å; I277-L280 PolarHBondContact O-N 3.38Å; I277-L281 HydrophobicContact CG2-CD1 3.71Å; I277-L281 HydrophobicContact CG2-CG 3.86Å; I277-L281 WeakPolarHBondContact O-CG 3.39Å; I277-L281 PolarHBondContact O-N 2.94Å
278S83.8Confident77.8Confident4 Ų440.5 Ų40.53%0.02822%0.217CC..Hα-helixtrans-58.2-39.7178.185.50000112.8H242 T245 V275 V276 L281 N282H242-S278 PolarHBondContact ND1-OG 3.03Å; T245-S278 WeakPolarHBondContact OG1-CB 3.17Å; V275-S278 WeakPolarHBondContact O-CB 3.21Å; V275-S278 PolarHBondContact O-N 3.31Å; V275-S278 PolarHBondContact O-OG 3.39Å; V276-S278 PolarHBondContact O-N 2.04Å; V276-S278 VanDerWaalsContact O-N 3.11Å; S278-L281 PolarHBondContact O-N 2.85Å; S278-N282 WeakPolarHBondContact O-CB 3.06Å; S278-N282 PolarHBondContact O-N 3.4Å; S278-N282 PolarHBondContact O-ND2 2.77Å
279G81.6Confident78.6Confident5 Ų544.3 Ų44.35%0.05223%0.229CC..Hα-helixtrans-63.1-47.1178.900000111.7V276 I277 N282 A283V276-G279 PolarHBondContact O-N 2.9Å; V276-G279 VanDerWaalsContact O-N 3.12Å; I277-G279 VanDerWaalsContact C-N 3.29Å; I277-G279 PolarHBondContact O-N 2.88Å; G279-N282 PolarHBondContact O-N 2.84Å; G279-A283 WeakPolarHBondContact O-CB 3.47Å; G279-A283 PolarHBondContact O-N 3.43Å
280L86.2Confident79.3Confident33 Ų3343.4 Ų43.417%0.17322%0.221CC..Hα-helixtrans-62.5-49.4177.8-175.160.3000111.7I28 V31 T32 I277 N282 A283 I284I28-L280 HydrophobicContact CG2-CB 4.26Å; I28-L280 HydrophobicContact CG2-CD2 4.14Å; V31-L280 HydrophobicContact CB-CD1 4.35Å; V31-L280 HydrophobicContact CG1-CD1 3.69Å; T32-L280 WeakPolarHBondContact OG1-CA 3.18Å; T32-L280 VanDerWaalsContact OG1-CB 3.32Å; T32-L280 WeakPolarHBondContact OG1-CB 3.35Å; T32-L280 PolarHBondContact OG1-N 3.19Å; I277-L280 PolarHBondContact O-N 3.38Å; L280-N282 VanDerWaalsContact C-N 3.29Å; L280-N282 PolarHBondContact O-N 2.91Å; L280-A283 PolarHBondContact O-N 2.99Å; L280-I284 HydrophobicContact CD1-CD1 3.87Å; L280-I284 HydrophobicContact CD1-CG1 4.27Å; L280-I284 HydrophobicContact CD2-CD1 4.5Å; L280-I284 HydrophobicContact CG-CD1 3.81Å; L280-I284 WeakPolarHBondContact O-CB 3.47Å; L280-I284 VanDerWaalsContact O-CG1 3.3Å; L280-I284 WeakPolarHBondContact O-CG1 3.48Å; L280-I284 PolarHBondContact O-N 3.45Å
281L86.3Confident79.9Confident78 Ų7849.9 Ų49.941%0.40824%0.244SC..Hα-helixtrans-60.1-42.7179.8-72.6177.6000111.1I241 I277 S278 F285I241-L281 HydrophobicContact CG2-CB 4.17Å; I241-L281 HydrophobicContact CG2-CD1 4.06Å; I277-L281 HydrophobicContact CG2-CD1 3.71Å; I277-L281 HydrophobicContact CG2-CG 3.86Å; I277-L281 WeakPolarHBondContact O-CG 3.39Å; I277-L281 PolarHBondContact O-N 2.94Å; S278-L281 PolarHBondContact O-N 2.85Å; L281-F285 WeakPolarHBondContact O-CB 3.42Å; L281-F285 PolarHBondContact O-N 3.02Å
282N85.5Confident80.4Confident0 Ų047.5 Ų47.50%024%0.238CC..Hα-helixtrans-68.9-41.2-179.8-73.8-21.5000112.2Y65 C238 S278 G279 L280 F285 L286Y65-N282 HydrophobicContact CE1-CB 4.49Å; Y65-N282 HydrophobicContact CE2-CB 4.19Å; Y65-N282 PolarHBondContact OH-ND2 3.45Å; C238-N282 WeakPolarHBondContact CA-OD1 3.39Å; C238-N282 PolarHBondContact O-ND2 3.46Å; C238-N282 PolarHBondContact O-OD1 2.93Å; C238-N282 VanDerWaalsContact SG-CB 3.56Å; C238-N282 PolarHBondContact SG-OD1 3.41Å; S278-N282 WeakPolarHBondContact O-CB 3.06Å; S278-N282 PolarHBondContact O-N 3.4Å; S278-N282 PolarHBondContact O-ND2 2.77Å; G279-N282 PolarHBondContact O-N 2.84Å; L280-N282 VanDerWaalsContact C-N 3.29Å; L280-N282 PolarHBondContact O-N 2.91Å; N282-F285 PolarHBondContact O-N 3.43Å; N282-L286 VanDerWaalsContact O-CB 3.25Å; N282-L286 WeakPolarHBondContact O-CB 2.99Å; N282-L286 WeakPolarHBondContact O-CG 3.37Å; N282-L286 PolarHBondContact O-N 3.09Å
283A83.8Confident81Confident1 Ų146.2 Ų46.21%0.00822%0.224CC..Hα-helixtrans-59.4-53.5173.400000111.2M35 T36 G279 L280 F285 L286 F287M35-A283 HydrophobicContact CB-CB 4.4Å; T36-A283 HydrophobicContact CG2-CB 3.91Å; G279-A283 WeakPolarHBondContact O-CB 3.47Å; G279-A283 PolarHBondContact O-N 3.43Å; L280-A283 PolarHBondContact O-N 2.99Å; A283-F285 VanDerWaalsContact C-N 3.29Å; A283-F285 PolarHBondContact O-N 3.5Å; A283-L286 PolarHBondContact O-N 2.97Å; A283-F287 WeakPolarHBondContact O-CB 3.49Å; A283-F287 PolarHBondContact O-N 3.34Å
284I87Confident81.7Confident74 Ų7447.6 Ų47.638%0.37923%0.229SC..Hα-helixtrans-57.7-44.3178.4-66.8170.4000110.7L280 F287 C288L280-I284 HydrophobicContact CD1-CD1 3.87Å; L280-I284 HydrophobicContact CD1-CG1 4.27Å; L280-I284 HydrophobicContact CD2-CD1 4.5Å; L280-I284 HydrophobicContact CG-CD1 3.81Å; L280-I284 WeakPolarHBondContact O-CB 3.47Å; L280-I284 VanDerWaalsContact O-CG1 3.3Å; L280-I284 WeakPolarHBondContact O-CG1 3.48Å; L280-I284 PolarHBondContact O-N 3.45Å; I284-F287 PolarHBondContact O-N 2.75Å; I284-C288 VanDerWaalsContact O-CB 3.29Å; I284-C288 WeakPolarHBondContact O-CB 3.19Å; I284-C288 PolarHBondContact O-N 3.35Å; I284-C288 PolarHBondContact O-SG 2.87Å
285F85.4Confident82.2Confident45 Ų4547.8 Ų47.820%0.19723%0.23CC..Hα-helixtrans-68.7-43.5-177.1-169.1-97.5000112.3T234 T237 L281 N282 A283 C288 R289T234-F285 WeakPolarHBondContact O-CE1 3.05Å; T237-F285 HydrophobicContact CG2-CE1 4Å; T237-F285 HydrophobicContact CG2-CE2 4.19Å; T237-F285 HydrophobicContact CG2-CZ 3.62Å; L281-F285 WeakPolarHBondContact O-CB 3.42Å; L281-F285 PolarHBondContact O-N 3.02Å; N282-F285 PolarHBondContact O-N 3.43Å; A283-F285 VanDerWaalsContact C-N 3.29Å; A283-F285 PolarHBondContact O-N 3.5Å; F285-C288 PolarHBondContact O-N 3.14Å; F285-R289 VanDerWaalsContact O-CB 3.3Å; F285-R289 WeakPolarHBondContact O-CB 3.44Å; F285-R289 PolarHBondContact O-N 3.17Å
286L83.4Confident82.4Confident1 Ų146.3 Ų46.31%0.00522%0.221CC..Hα-helixtrans-60.9-45.6174.7-75.4172.6000110.9L61 L235 N282 A283 T290 I293L61-L286 HydrophobicContact CD2-CD1 4.32Å; L235-L286 HydrophobicContact CD2-CD2 4.29Å; N282-L286 VanDerWaalsContact O-CB 3.25Å; N282-L286 WeakPolarHBondContact O-CB 2.99Å; N282-L286 WeakPolarHBondContact O-CG 3.37Å; N282-L286 PolarHBondContact O-N 3.09Å; A283-L286 PolarHBondContact O-N 2.97Å; L286-T290 WeakPolarHBondContact O-CB 3.49Å; L286-T290 PolarHBondContact O-N 3.04Å; L286-T290 PolarHBondContact O-OG1 3.36Å; L286-I293 HydrophobicContact CB-CD1 4.2Å
287F82.3Confident82.7Confident62 Ų6245.4 Ų45.427%0.27222%0.215SC..Hα-helixtrans-60.3-52.9175.2-175.2-100.9000112.1E39 A283 I284 R289 I293 K294 V297E39-F287 HydrophobicContact CG-CD2 4.46Å; E39-F287 WeakPolarHBondContact OE1-CB 3.42Å; A283-F287 WeakPolarHBondContact O-CB 3.49Å; A283-F287 PolarHBondContact O-N 3.34Å; I284-F287 PolarHBondContact O-N 2.75Å; F287-R289 VanDerWaalsContact C-N 3.28Å; F287-R289 PolarHBondContact O-N 3.02Å; F287-I293 HydrophobicContact CD2-CG2 4.14Å; F287-K294 HydrophobicContact CD1-CG 4.49Å; F287-K294 HydrophobicContact CD2-CG 4.32Å; F287-K294 HydrophobicContact CE1-CG 4.31Å; F287-K294 HydrophobicContact CE2-CG 4.12Å; F287-K294 HydrophobicContact CG-CG 4.49Å; F287-K294 HydrophobicContact CZ-CG 4.12Å; F287-K294 WeakPolarHBondContact O-CD 3.45Å; F287-K294 WeakPolarHBondContact O-CG 3.33Å; F287-V297 HydrophobicContact CD2-CG2 4.49Å; F287-V297 HydrophobicContact CE2-CB 4.1Å; F287-V297 HydrophobicContact CE2-CG1 4.09Å; F287-V297 HydrophobicContact CE2-CG2 4.06Å
288C83.2Confident82.8Confident76 Ų7650.5 Ų50.551%0.51423%0.231SC..Hα-helixtrans-61-38.5-175.6-72.80000112.1I284 F285 K294I284-C288 VanDerWaalsContact O-CB 3.29Å; I284-C288 WeakPolarHBondContact O-CB 3.19Å; I284-C288 PolarHBondContact O-N 3.35Å; I284-C288 PolarHBondContact O-SG 2.87Å; F285-C288 PolarHBondContact O-N 3.14Å; C288-K294 WeakPolarHBondContact O-CE 3.01Å; C288-K294 PolarHBondContact O-NZ 2.86Å
289R83.2Confident82.7Confident113 Ų11355.4 Ų55.443%0.42625%0.249SC..Hα-helixtrans-98.9-24.3-168.7-145.8167.9162.1146.8-10.4114.1L233 T234 F285 F287 R291L233-R289 VanDerWaalsContact CD2-NH2 3.28Å; T234-R289 HydrophobicContact CG2-CB 3.81Å; T234-R289 HydrophobicContact CG2-CG 3.38Å; T234-R289 VanDerWaalsContact CG2-NE 3.26Å; F285-R289 VanDerWaalsContact O-CB 3.3Å; F285-R289 WeakPolarHBondContact O-CB 3.44Å; F285-R289 PolarHBondContact O-N 3.17Å; F287-R289 VanDerWaalsContact C-N 3.28Å; F287-R289 PolarHBondContact O-N 3.02Å; R289-R291 PolarHBondContact O-N 3.27Å
290T80.8Confident82.7Confident7 Ų756.3 Ų56.34%0.04325%0.253CS..  trans-93105.3-179.1-42.60000110.6L231 L286 E292 I293 K294L231-T290 HydrophobicContact CD1-CG2 4.12Å; L286-T290 WeakPolarHBondContact O-CB 3.49Å; L286-T290 PolarHBondContact O-N 3.04Å; L286-T290 PolarHBondContact O-OG1 3.36Å; T290-E292 HydrophobicContact CG2-CB 4.35Å; T290-E292 PolarHBondContact O-N 3.37Å; T290-I293 HydrophobicContact CG2-CB 4.45Å; T290-I293 HydrophobicContact CG2-CD1 4.02Å; T290-I293 HydrophobicContact CG2-CG1 3.81Å; T290-I293 PolarHBondContact O-N 2.94Å; T290-K294 PolarHBondContact O-N 3.44Å
291R78.9Confident82.5Confident183 Ų18356.6 Ų56.669%0.69125%0.254SS*.Hα-helixtrans-59.5-34.5178.6-172.5178.9178.7-179.7-0.4112.1R289 K294 L295R289-R291 PolarHBondContact O-N 3.27Å; R291-K294 PolarHBondContact O-N 2.7Å; R291-L295 HydrophobicContact CG-CD1 3.94Å; R291-L295 HydrophobicContact CG-CG 4.26Å; R291-L295 WeakPolarHBondContact O-CB 3.46Å; R291-L295 VanDerWaalsContact O-CG 3.27Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 3.22Å
292E76.9Confident82.3Confident76 Ų7659.1 Ų59.136%0.35526%0.262SS..Hα-helixtrans-65.1-44.7-179.3-60.7-169.5-144.700111.5R52 F55 T290 K294 L295 A296R52-E292 IonicContact NH1-OE1 2.81Å; R52-E292 PolarHBondContact NH1-OE1 3.05Å; R52-E292 IonicContact NH1-OE2 3.57Å; R52-E292 PolarHBondContact NH1-OE2 3.41Å; F55-E292 HydrophobicContact CE1-CB 3.96Å; F55-E292 WeakPolarHBondContact CE2-OE2 3.31Å; F55-E292 HydrophobicContact CZ-CB 3.76Å; F55-E292 HydrophobicContact CZ-CG 4.02Å; F55-E292 WeakPolarHBondContact CZ-OE2 3.37Å; T290-E292 HydrophobicContact CG2-CB 4.35Å; T290-E292 PolarHBondContact O-N 3.37Å; E292-K294 PolarHBondContact O-N 3.03Å; E292-L295 PolarHBondContact O-N 2.99Å; E292-A296 WeakPolarHBondContact O-CB 3.4Å; E292-A296 PolarHBondContact O-N 3Å
293I77.7Confident82Confident0 Ų066 Ų660%029%0.292CS..Hα-helixtrans-60.3-47.9174.4-60.6177.7000110.4E39 L43 I62 L286 F287 T290 L295 A296 V297E39-I293 HydrophobicContact CB-CG2 4.44Å; E39-I293 HydrophobicContact CG-CG2 3.94Å; L43-I293 HydrophobicContact CD1-CG1 4.26Å; L43-I293 HydrophobicContact CD2-CG1 4.2Å; I62-I293 HydrophobicContact CD1-CD1 4.37Å; L286-I293 HydrophobicContact CB-CD1 4.2Å; F287-I293 HydrophobicContact CD2-CG2 4.14Å; T290-I293 HydrophobicContact CG2-CB 4.45Å; T290-I293 HydrophobicContact CG2-CD1 4.02Å; T290-I293 HydrophobicContact CG2-CG1 3.81Å; T290-I293 PolarHBondContact O-N 2.94Å; I293-L295 VanDerWaalsContact C-N 3.3Å; I293-L295 PolarHBondContact O-N 3.13Å; I293-A296 PolarHBondContact O-N 3.44Å; I293-V297 HydrophobicContact CG2-CG2 4.26Å; I293-V297 WeakPolarHBondContact O-CG2 3.41Å; I293-V297 PolarHBondContact O-N 3.19Å
294K83.2Confident81.8Confident65 Ų6569.7 Ų69.728%0.28332%0.317SS..Hα-helixtrans-59.8-39.9177.9-70.1-175.9-70.6-168.60113F287 C288 T290 R291 E292 R298F287-K294 HydrophobicContact CD1-CG 4.49Å; F287-K294 HydrophobicContact CD2-CG 4.32Å; F287-K294 HydrophobicContact CE1-CG 4.31Å; F287-K294 HydrophobicContact CE2-CG 4.12Å; F287-K294 HydrophobicContact CG-CG 4.49Å; F287-K294 HydrophobicContact CZ-CG 4.12Å; F287-K294 WeakPolarHBondContact O-CD 3.45Å; F287-K294 WeakPolarHBondContact O-CG 3.33Å; C288-K294 WeakPolarHBondContact O-CE 3.01Å; C288-K294 PolarHBondContact O-NZ 2.86Å; T290-K294 PolarHBondContact O-N 3.44Å; R291-K294 PolarHBondContact O-N 2.7Å; E292-K294 PolarHBondContact O-N 3.03Å; K294-R298 WeakPolarHBondContact O-CB 3.41Å; K294-R298 VanDerWaalsContact O-CG 3.26Å; K294-R298 WeakPolarHBondContact O-CG 3.18Å; K294-R298 PolarHBondContact O-N 3.38Å
295L82.9Confident80.9Confident62 Ų6268.6 Ų68.633%0.32532%0.324SS..Hα-helixtrans-68.6-42.4177.2-73.4171.7000111.1R291 E292 I293 R298 R299R291-L295 HydrophobicContact CG-CD1 3.94Å; R291-L295 HydrophobicContact CG-CG 4.26Å; R291-L295 WeakPolarHBondContact O-CB 3.46Å; R291-L295 VanDerWaalsContact O-CG 3.27Å; R291-L295 WeakPolarHBondContact O-CG 3.41Å; R291-L295 PolarHBondContact O-N 3.22Å; E292-L295 PolarHBondContact O-N 2.99Å; I293-L295 VanDerWaalsContact C-N 3.3Å; I293-L295 PolarHBondContact O-N 3.13Å; L295-R298 PolarHBondContact O-N 3.21Å; L295-R299 VanDerWaalsContact O-CG 3.31Å; L295-R299 WeakPolarHBondContact O-CG 3.33Å; L295-R299 PolarHBondContact O-N 3.42Å
296A80.6Confident80Confident3 Ų369.6 Ų69.63%0.02533%0.331CS..Hα-helixtrans-60.6-48.4176.100000111.1A42 L43 D46 E292 I293 R298 R299 L300A42-A296 HydrophobicContact CB-CB 4.15Å; L43-A296 HydrophobicContact CD2-CB 4.34Å; D46-A296 HydrophobicContact CB-CB 4.37Å; E292-A296 WeakPolarHBondContact O-CB 3.4Å; E292-A296 PolarHBondContact O-N 3Å; I293-A296 PolarHBondContact O-N 3.44Å; A296-R298 PolarHBondContact O-N 2.94Å; A296-R299 PolarHBondContact O-N 3.44Å; A296-L300 PolarHBondContact O-N 3.09Å
297V81.9Confident78.8Confident9 Ų974 Ų746%0.05535%0.351CS..Hα-helixtrans-62.1-44.3177.7173.50000111.1V38 E39 A42 F287 I293 R299 L300 L301V38-V297 HydrophobicContact CG1-CG1 4.05Å; V38-V297 HydrophobicContact CG1-CG2 4.42Å; E39-V297 HydrophobicContact CG-CG2 4.47Å; A42-V297 HydrophobicContact CB-CB 4.26Å; A42-V297 HydrophobicContact CB-CG2 3.58Å; F287-V297 HydrophobicContact CD2-CG2 4.49Å; F287-V297 HydrophobicContact CE2-CB 4.1Å; F287-V297 HydrophobicContact CE2-CG1 4.09Å; F287-V297 HydrophobicContact CE2-CG2 4.06Å; I293-V297 HydrophobicContact CG2-CG2 4.26Å; I293-V297 WeakPolarHBondContact O-CG2 3.41Å; I293-V297 PolarHBondContact O-N 3.19Å; V297-R299 VanDerWaalsContact C-N 3.34Å; V297-R299 PolarHBondContact O-N 3.39Å; V297-L300 WeakPolarHBondContact O-CB 3.49Å; V297-L300 PolarHBondContact O-N 3.49Å; V297-L301 HydrophobicContact CG1-CD1 4.05Å; V297-L301 HydrophobicContact CG1-CG 4.39Å; V297-L301 WeakPolarHBondContact O-CG 3.47Å; V297-L301 PolarHBondContact O-N 3.44Å
298R83.6Confident77.5Confident164 Ų16478.5 Ų78.562%0.61937%0.373SS*.Hα-helixtrans-61.6-40.1175-76.8178.3-175.8-173.1-0.2112.6K294 L295 A296 L300 L301 K302K294-R298 WeakPolarHBondContact O-CB 3.41Å; K294-R298 VanDerWaalsContact O-CG 3.26Å; K294-R298 WeakPolarHBondContact O-CG 3.18Å; K294-R298 PolarHBondContact O-N 3.38Å; L295-R298 PolarHBondContact O-N 3.21Å; A296-R298 PolarHBondContact O-N 2.94Å; R298-L300 VanDerWaalsContact C-N 3.34Å; R298-L301 PolarHBondContact O-N 2.96Å; R298-K302 WeakPolarHBondContact O-CB 3.35Å; R298-K302 WeakPolarHBondContact O-CG 3.48Å; R298-K302 PolarHBondContact O-N 3.29Å
299R83Confident76.1Confident106 Ų10680.8 Ų80.840%0.438%0.38SS..Hα-helixtrans-65.3-39.7175.8-73.2-177-146.4150.512.2111.3D46 L295 A296 V297 K302 K303D46-R299 VanDerWaalsContact CG-NH1 3.28Å; D46-R299 IonicContact OD1-NH1 3.69Å; D46-R299 PolarHBondContact OD1-NH1 3.35Å; D46-R299 IonicContact OD2-CZ 3.61Å; D46-R299 IonicContact OD2-NH1 3.45Å; D46-R299 PolarHBondContact OD2-NH1 2.91Å; D46-R299 IonicContact OD2-NH2 2.62Å; L295-R299 VanDerWaalsContact O-CG 3.31Å; L295-R299 WeakPolarHBondContact O-CG 3.33Å; L295-R299 PolarHBondContact O-N 3.42Å; A296-R299 PolarHBondContact O-N 3.44Å; V297-R299 VanDerWaalsContact C-N 3.34Å; V297-R299 PolarHBondContact O-N 3.39Å; R299-K302 PolarHBondContact O-N 3.01Å; R299-K303 WeakPolarHBondContact O-CG 3.42Å; R299-K303 PolarHBondContact O-N 3.27Å
300L81.8Confident74.7Confident24 Ų2481.5 Ų81.513%0.12639%0.386CS..Hα-helixtrans-61.6-49.8174.5-173.772.8000110.7V41 A42 N45 A296 V297 R298 K302 K303 C304V41-L300 HydrophobicContact CB-CD2 4.31Å; V41-L300 HydrophobicContact CG1-CD1 4.1Å; V41-L300 HydrophobicContact CG1-CD2 3.86Å; A42-L300 HydrophobicContact CB-CB 4.25Å; A42-L300 HydrophobicContact CB-CD2 3.99Å; N45-L300 WeakPolarHBondContact ND2-CD1 3.4Å; A296-L300 PolarHBondContact O-N 3.09Å; V297-L300 WeakPolarHBondContact O-CB 3.49Å; V297-L300 PolarHBondContact O-N 3.49Å; R298-L300 VanDerWaalsContact C-N 3.34Å; L300-K302 VanDerWaalsContact C-N 3.29Å; L300-K302 PolarHBondContact O-N 3.5Å; L300-K303 PolarHBondContact O-N 3.43Å; L300-K303 VanDerWaalsContact O-N 3.11Å; L300-C304 PolarHBondContact O-N 3.04Å; L300-C304 PolarHBondContact O-SG 2.97Å
301L81.9Confident73.3Confident40 Ų4084.8 Ų84.821%0.20941%0.406CS..Hα-helixtrans-58.6-39.2177.7-70.6171.8000112.4V297 R298 C304 G305 L306 F310V297-L301 HydrophobicContact CG1-CD1 4.05Å; V297-L301 HydrophobicContact CG1-CG 4.39Å; V297-L301 WeakPolarHBondContact O-CG 3.47Å; V297-L301 PolarHBondContact O-N 3.44Å; R298-L301 PolarHBondContact O-N 2.96Å; L301-C304 PolarHBondContact O-N 3.09Å; L301-G305 PolarHBondContact O-N 2.66Å; L301-L306 HydrophobicContact CD2-CB 3.89Å; L301-L306 HydrophobicContact CD2-CD2 4.1Å; L301-L306 PolarHBondContact O-N 2.94Å; L301-F310 HydrophobicContact CD1-CD2 4.21Å; L301-F310 HydrophobicContact CD1-CE2 4.09Å; L301-F310 HydrophobicContact CD2-CD2 4.24Å; L301-F310 HydrophobicContact CD2-CE2 3.77Å
302K81.5Confident71.6Confident131 Ų13183.8 Ų83.857%0.5741%0.407SS*.Hα-helixtrans-63.5-46.3173.3-77.4-179.1174.6-165.80112.6R298 R299 L300 C304 G305 E307R298-K302 WeakPolarHBondContact O-CB 3.35Å; R298-K302 WeakPolarHBondContact O-CG 3.48Å; R298-K302 PolarHBondContact O-N 3.29Å; R299-K302 PolarHBondContact O-N 3.01Å; L300-K302 VanDerWaalsContact C-N 3.29Å; L300-K302 PolarHBondContact O-N 3.5Å; K302-C304 VanDerWaalsContact C-N 3.31Å; K302-C304 PolarHBondContact O-N 3.39Å; K302-G305 PolarHBondContact O-N 3.45Å; K302-E307 WeakPolarHBondContact CE-OE1 3.31Å; K302-E307 HydrophobicContact CG-CG 4.09Å; K302-E307 WeakPolarHBondContact CG-OE1 3.42Å
303K80.2Confident70.1Confident144 Ų14484 Ų8463%0.62642%0.416SS*.Hα-helixtrans-62.8-37.9177.7-76.1-178.6178.6-1760112.1R299 L300 G305R299-K303 WeakPolarHBondContact O-CG 3.42Å; R299-K303 PolarHBondContact O-N 3.27Å; L300-K303 PolarHBondContact O-N 3.43Å; L300-K303 VanDerWaalsContact O-N 3.11Å; K303-G305 PolarHBondContact O-N 2.97Å
304C78.9Confident68.5Low79 Ų7987.5 Ų87.553%0.53444%0.441SS..THydrogen-bonded Turntrans-79.30.1178.6-66.20000113.8L300 L301 K302 L306L300-C304 PolarHBondContact O-N 3.04Å; L300-C304 PolarHBondContact O-SG 2.97Å; L301-C304 PolarHBondContact O-N 3.09Å; K302-C304 VanDerWaalsContact C-N 3.31Å; K302-C304 PolarHBondContact O-N 3.39Å; C304-L306 HydrophobicContact CB-CD1 3.94Å; C304-L306 PolarHBondContact O-N 3.21Å
305G68.3Low66.4Low51 Ų5188.8 Ų88.853%0.52646%0.458SS..THydrogen-bonded Turntrans66.812.7-176.800000114.3L301 K302 K303 E307L301-G305 PolarHBondContact O-N 2.66Å; K302-G305 PolarHBondContact O-N 3.45Å; K303-G305 PolarHBondContact O-N 2.97Å; G305-E307 VanDerWaalsContact C-N 3.26Å; G305-E307 PolarHBondContact O-N 3.05Å
306L65.2Low64.3Low66 Ų6692.5 Ų92.535%0.34648%0.477SS..THydrogen-bonded Turntrans-79.6-2.3-173.6-113.8106.8000114L301 C304 Q308 L309 F310L301-L306 HydrophobicContact CD2-CB 3.89Å; L301-L306 HydrophobicContact CD2-CD2 4.1Å; L301-L306 PolarHBondContact O-N 2.94Å; C304-L306 HydrophobicContact CB-CD1 3.94Å; C304-L306 PolarHBondContact O-N 3.21Å; L306-Q308 PolarHBondContact O-N 3.47Å; L306-Q308 VanDerWaalsContact O-N 3.15Å; L306-L309 HydrophobicContact CD2-CD1 3.73Å; L306-L309 HydrophobicContact CG-CD1 3.93Å; L306-L309 PolarHBondContact O-N 2.88Å; L306-F310 HydrophobicContact CD2-CE2 4.2Å; L306-F310 PolarHBondContact O-N 3.43Å
307E58.1Low61.9Low94 Ų9498.8 Ų98.844%0.43951%0.509SS..Hα-helixtrans-56.6-30.1175-80.9-161.2158.900111.8K302 G305 L309 F310 T311K302-E307 WeakPolarHBondContact CE-OE1 3.31Å; K302-E307 HydrophobicContact CG-CG 4.09Å; K302-E307 WeakPolarHBondContact CG-OE1 3.42Å; G305-E307 VanDerWaalsContact C-N 3.26Å; G305-E307 PolarHBondContact O-N 3.05Å; E307-L309 VanDerWaalsContact C-N 3.25Å; E307-L309 PolarHBondContact O-N 3.5Å; E307-F310 PolarHBondContact O-N 3.38Å; E307-T311 WeakPolarHBondContact O-CB 3.48Å; E307-T311 WeakPolarHBondContact O-CG2 3.38Å; E307-T311 PolarHBondContact O-N 3.45Å; E307-T311 PolarHBondContact O-OG1 3.02Å
308Q54.9Low59.7Low156 Ų156104.2 Ų104.273%0.72955%0.545SS*.Hα-helixtrans-62.9-29.5177.3-66.1-1720.300113.2L306 K312L306-Q308 PolarHBondContact O-N 3.47Å; L306-Q308 VanDerWaalsContact O-N 3.15Å; Q308-K312 WeakPolarHBondContact O-CB 3.32Å; Q308-K312 PolarHBondContact O-N 3.48Å
309L55.2Low57.5Low124 Ų124101.5 Ų101.565%0.64955%0.551SS**Hα-helixtrans-75.5-40.9176-75.5171.5000111.7L306 E307L306-L309 HydrophobicContact CD2-CD1 3.73Å; L306-L309 HydrophobicContact CG-CD1 3.93Å; L306-L309 PolarHBondContact O-N 2.88Å; E307-L309 VanDerWaalsContact C-N 3.25Å; E307-L309 PolarHBondContact O-N 3.5Å
310F53.5Low55.1Low127 Ų127102.4 Ų102.456%0.55757%0.574SS**Hα-helixtrans-81.4-34.3-178.1-76.4-78.2000113.6L301 L306 E307 S313 S314L301-F310 HydrophobicContact CD1-CD2 4.21Å; L301-F310 HydrophobicContact CD1-CE2 4.09Å; L301-F310 HydrophobicContact CD2-CD2 4.24Å; L301-F310 HydrophobicContact CD2-CE2 3.77Å; L306-F310 HydrophobicContact CD2-CE2 4.2Å; L306-F310 PolarHBondContact O-N 3.43Å; E307-F310 PolarHBondContact O-N 3.38Å; F310-S313 PolarHBondContact O-N 3.24Å; F310-S314 PolarHBondContact O-N 3.49Å
311T50.3Low52.6Low76 Ų76107.4 Ų107.447%0.46660%0.601SS.*Hα-helixtrans-69.1-36.6176.548.90000112E307 S313 S314 S315E307-T311 WeakPolarHBondContact O-CB 3.48Å; E307-T311 WeakPolarHBondContact O-CG2 3.38Å; E307-T311 PolarHBondContact O-N 3.45Å; E307-T311 PolarHBondContact O-OG1 3.02Å; T311-S313 VanDerWaalsContact C-N 3.29Å; T311-S313 PolarHBondContact O-N 2.97Å; T311-S314 PolarHBondContact O-N 3.06Å; T311-S314 VanDerWaalsContact O-N 3.16Å; T311-S314 PolarHBondContact O-OG 2.77Å; T311-S315 PolarHBondContact O-N 3.22Å
312K44.8Very low50.1Low162 Ų162115.9 Ų115.970%0.70463%0.63SS**Hα-helixtrans-63.6-31.1171.7-95.2-176.1173179.80113.4Q308 S314 S315Q308-K312 WeakPolarHBondContact O-CB 3.32Å; Q308-K312 PolarHBondContact O-N 3.48Å; K312-S314 VanDerWaalsContact C-N 3.35Å; K312-S315 PolarHBondContact O-N 3.27Å; K312-S315 PolarHBondContact O-OG 3.35Å
313S45.3Very low47.8Very low80 Ų80116.2 Ų116.256%0.55964%0.643SS**Hα-helixtrans-69.7-35174.3-176.70000111.7F310 T311 S315 I316F310-S313 PolarHBondContact O-N 3.24Å; T311-S313 VanDerWaalsContact C-N 3.29Å; T311-S313 PolarHBondContact O-N 2.97Å; S313-S315 VanDerWaalsContact C-N 3.31Å; S313-S315 PolarHBondContact O-N 2.97Å; S313-I316 PolarHBondContact O-N 3.36Å
314S43.3Very low45.3Very low75 Ų75117.4 Ų117.452%0.52465%0.65SS.*Hα-helixtrans-73-16.7176.963.50000114.9F310 T311 K312 I316 L317F310-S314 PolarHBondContact O-N 3.49Å; T311-S314 PolarHBondContact O-N 3.06Å; T311-S314 VanDerWaalsContact O-N 3.16Å; T311-S314 PolarHBondContact O-OG 2.77Å; K312-S314 VanDerWaalsContact C-N 3.35Å; S314-I316 PolarHBondContact O-N 2.89Å; S314-L317 PolarHBondContact O-N 3.49Å
315S39Very low43.1Very low91 Ų91120.6 Ų120.664%0.63667%0.668SS**THydrogen-bonded Turntrans-75.7-2.6176.168.90000113.9T311 K312 S313T311-S315 PolarHBondContact O-N 3.22Å; K312-S315 PolarHBondContact O-N 3.27Å; K312-S315 PolarHBondContact O-OG 3.35Å; S313-S315 VanDerWaalsContact C-N 3.31Å; S313-S315 PolarHBondContact O-N 2.97Å
316I39.8Very low41.2Very low140 Ų140124.3 Ų124.372%0.71868%0.68SS**THydrogen-bonded Turntrans-91.2-9.9175.6-57.6175.2000111.6S313 S314S313-I316 PolarHBondContact O-N 3.36Å; S314-I316 PolarHBondContact O-N 2.89Å
317L29.7Very low39.4Very low135 Ų135124.1 Ų124.171%0.70769%0.694SS**SBendtrans-89.2121.3166.6-85.495.8000109.9S314 S319S314-L317 PolarHBondContact O-N 3.49Å; L317-S319 PolarHBondContact O-N 2.83Å; L317-S319 VanDerWaalsContact O-N 3.09Å
318P34.6Very low38.2Very low124 Ų124127.5 Ų127.581%0.80571%0.713SS**  trans-60.8119.4177.323.9-30.5000108.8S320P318-S320 PolarHBondContact O-N 3.26Å
319S37.6Very low36.9Very low107 Ų107123.4 Ų123.475%0.74871%0.713SS**  trans-61.2107.2173.8620000108.5L317 N321L317-S319 PolarHBondContact O-N 2.83Å; L317-S319 VanDerWaalsContact O-N 3.09Å; S319-N321 PolarHBondContact O-N 3.3Å; S319-N321 VanDerWaalsContact O-N 3.15Å
320S32.3Very low35.7Very low124 Ų124123.3 Ų123.387%0.86772%0.718SS**  trans-56.7120.3166.4-173.80000108.6P318P318-S320 PolarHBondContact O-N 3.26Å
321N30.1Very low34.7Very low130 Ų130121.5 Ų121.570%0.69572%0.721SS**  trans-65.2147.9-173.4-112-32.9000112.8S319S319-N321 PolarHBondContact O-N 3.3Å; S319-N321 VanDerWaalsContact O-N 3.15Å
322R29.1Very low34Very low217 Ų217123.7 Ų123.782%0.81974%0.735SS**  trans65.8118.3149-71.5178.8176.4164.9-1118.9
323T33.1Very low33.5Very low138 Ų138121.9 Ų121.985%0.84774%0.737SS**  -171.8136.988.724.90000111.6
324H27.8Very low32.9Very low169 Ų169126.1 Ų126.178%0.78275%0.748SS**  trans-55.1135.9174-85-124.7000112.7
325T32.6Very low32.5Very low146 Ų146129.2 Ų129.290%0.89675%0.754SS**  trans-135.8121135.832.90000108.7
326V29.4Very low32.2Very low129 Ų129131.6 Ų131.678%0.78276%0.759SS**  trans-84.1130.3-175.51660000109.1
327G27.6Very low31.7Very low63 Ų63133.8 Ų133.865%0.64976%0.763SS**  trans58.2104.7137.600000119.6
328I31.7Very low31.9Very low164 Ų164132.7 Ų132.784%0.84176%0.763SS**  trans-139108133.4-61-175.8000106.9
329G27.4Very low31.8Very low70 Ų70135.6 Ų135.672%0.72276%0.758SS**  trans-72.6142.116900000110.7
330T30.3Very low31.4Very low122 Ų122138 Ų13875%0.74876%0.757SS**  trans-166.4107.3149.914.30000108.5
331S33.1Very low31Very low89 Ų89138.1 Ų138.162%0.62276%0.757SS**  trans31.191.5151.559.70000118.6T333S331-T333 PolarHBondContact O-N 3.25Å
332T35.2Very low31Very low123 Ų123137.3 Ų137.376%0.75577%0.768SS**THydrogen-bonded Turntrans-78.49.5170.831.70000115
333T35.6Very low31.1Very low124 Ų124133.4 Ų133.476%0.76177%0.766SS**THydrogen-bonded Turntrans-87.8-15.4-177.639.40000115.1S331S331-T333 PolarHBondContact O-N 3.25Å
334E32.6Very low31Very low169 Ų169133.1 Ų133.179%0.7976%0.761SS**SBendtrans-88.8-19.4175.9-91.8-168.8144.500114.7L336E334-L336 VanDerWaalsContact C-N 3.27Å; E334-L336 PolarHBondContact O-N 3.03Å
335Q33.3Very low31.2Very low139 Ų139131.1 Ų131.165%0.6576%0.76SS**THydrogen-bonded Turntrans-76.5-10.2-178.2-76.6-92.2-30.200113.8
336L33.2Very low31.1Very low141 Ų141130.2 Ų130.274%0.73875%0.752SS**THydrogen-bonded Turntrans-89.3-17.3-177.7-116.199.9000114.9E334E334-L336 VanDerWaalsContact C-N 3.27Å; E334-L336 PolarHBondContact O-N 3.03Å
337K29.9Very low31.2Very low186 Ų186130.3 Ų130.381%0.80975%0.75SS**G310 helixtrans-83.2-13.9-177.1-103.4-176.2177.7-179.60115
338T33.9Very low31.5Very low113 Ų113134.8 Ų134.869%0.69376%0.757SS**G310 helixtrans-93.52.8-178.948.80000114.4
339W31.3Very low31.5Very low184 Ų184132.7 Ų132.770%0.69775%0.751SS**G310 helixtrans-94.60.3-179.4-73.282000115
340E29.5Very low31.8Very low158 Ų158137.5 Ų137.574%0.73875%0.753SS**SBendtrans-933.5-176.6-69.5-171.2153.500115
341C24.3Very low31.9Very low127 Ų127138.8 Ų138.886%0.85875%0.754SS**  trans-116.864.1171.3-70.40000111.8
342A30.9Very low31.8Very low113 Ų113143.4 Ų143.493%0.93477%0.766SS**  trans-173.10159.900000111.4R52R52-A342 PolarHBondContact NH2-OXT 2.98Å

Retrieved 342 of 342 residues in 185.4 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).