A0A060XI90_ONCMY Loading...

MARVEL domain containing 1

AlphaFold DB , UniProt , Accession A0A060XI90, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene marveld1, Length 162 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.3Very low63.6Low231 Ų231118.5 Ų118.5100%1.13862%0.622SS**  0123.90-89.6171.217200107.7P3M1-P3 VanDerWaalsContact O-CD 3.22Å; M1-P3 WeakPolarHBondContact O-CD 3.22Å
2P51Low65.1Low98 Ų98120.7 Ų120.764%0.63662%0.616SS**  trans-90.1113.3172.231.5-24.7000109.9Q4P2-Q4 VanDerWaalsContact C-N 3.26Å; P2-Q4 HydrophobicContact CB-CB 4.48Å; P2-Q4 HydrophobicContact CB-CG 4.36Å; P2-Q4 PolarHBondContact O-N 3.42Å; P2-Q4 VanDerWaalsContact O-N 3.15Å
3P52.4Low66.6Low110 Ų110117.4 Ų117.471%0.71460%0.601SS**  trans-81.876.8162.834.1-29.2000107.6M1M1-P3 VanDerWaalsContact O-CD 3.22Å; M1-P3 WeakPolarHBondContact O-CD 3.22Å
4Q57.2Low67.8Low135 Ų135109.1 Ų109.163%0.63156%0.558SS**  trans-110.7-27.6-177.4-88.3178.3-3400116.7P2P2-Q4 VanDerWaalsContact C-N 3.26Å; P2-Q4 HydrophobicContact CB-CB 4.48Å; P2-Q4 HydrophobicContact CB-CG 4.36Å; P2-Q4 PolarHBondContact O-N 3.42Å; P2-Q4 VanDerWaalsContact O-N 3.15Å
5P60.8Low68.9Low103 Ų103104.5 Ų104.567%0.66954%0.535SS*.Hα-helixtrans-74.6-32.3-175.524.3-28.5000113.7K9P5-K9 PolarHBondContact O-N 3.42Å
6E62.7Low69.9Low168 Ų168107.5 Ų107.579%0.78554%0.543SS*.Hα-helixtrans-78.4-39.4-176.1-63.7-146.3144.200113.7N8 K9 H10E6-N8 VanDerWaalsContact C-N 3.33Å; E6-N8 PolarHBondContact O-N 2.89Å; E6-K9 PolarHBondContact O-N 3.31Å; E6-K9 VanDerWaalsContact O-N 3.15Å; E6-H10 PolarHBondContact O-N 3.47Å; E6-H10 VanDerWaalsContact O-N 3.08Å
7V65.6Low71Confident95 Ų95102.4 Ų102.458%0.57652%0.519SS*.Hα-helixtrans-61.9-42.2178.4179.20000111.1K9 F11V7-K9 VanDerWaalsContact C-N 3.3Å; V7-K9 PolarHBondContact O-N 3.14Å; V7-F11 WeakPolarHBondContact O-CB 3.37Å; V7-F11 PolarHBondContact O-N 2.99Å
8N68.8Low71.9Confident99 Ų99102 Ų10253%0.52951%0.514SS..Hα-helixtrans-63.3-37.5177.2-81.1-14.4000111.8E6 W12E6-N8 VanDerWaalsContact C-N 3.33Å; E6-N8 PolarHBondContact O-N 2.89Å; N8-W12 PolarHBondContact O-N 3.39Å; N8-W12 VanDerWaalsContact O-N 3.15Å
9K76.6Confident72.7Confident142 Ų14297.2 Ų97.262%0.61749%0.49SS*.Hα-helixtrans-68.1-48.9179.8-168.8178.5175.8-173.30111.6P5 E6 V7 F11 W12 D13P5-K9 PolarHBondContact O-N 3.42Å; E6-K9 PolarHBondContact O-N 3.31Å; E6-K9 VanDerWaalsContact O-N 3.15Å; V7-K9 VanDerWaalsContact C-N 3.3Å; V7-K9 PolarHBondContact O-N 3.14Å; K9-F11 VanDerWaalsContact C-N 3.3Å; K9-F11 PolarHBondContact O-N 2.91Å; K9-W12 PolarHBondContact O-N 3.15Å; K9-D13 WeakPolarHBondContact O-CB 3.48Å; K9-D13 VanDerWaalsContact O-CG 3.25Å; K9-D13 PolarHBondContact O-N 3.25Å
10H77.9Confident73.5Confident47 Ų4792.4 Ų92.422%0.21847%0.465CS..Hα-helixtrans-58.5-41.9176.4-177.7-94.8000112.3E6 W12 D13 F14E6-H10 PolarHBondContact O-N 3.47Å; E6-H10 VanDerWaalsContact O-N 3.08Å; H10-W12 PolarHBondContact O-N 2.96Å; H10-D13 PolarHBondContact O-N 2.95Å; H10-F14 WeakPolarHBondContact O-CB 3.14Å; H10-F14 PolarHBondContact O-N 3.4Å
11F80.6Confident74.4Confident75 Ų7591.8 Ų91.833%0.32946%0.463SS..Hα-helixtrans-56.7-50.7175.4176.5-87.9000112.2V7 K9 F14 L15 L68V7-F11 WeakPolarHBondContact O-CB 3.37Å; V7-F11 PolarHBondContact O-N 2.99Å; K9-F11 VanDerWaalsContact C-N 3.3Å; K9-F11 PolarHBondContact O-N 2.91Å; F11-F14 PolarHBondContact O-N 2.99Å; F11-L15 HydrophobicContact CD1-CD1 3.77Å; F11-L15 HydrophobicContact CD1-CG 4.5Å; F11-L15 HydrophobicContact CE1-CD1 3.2Å; F11-L15 HydrophobicContact CE1-CG 4.25Å; F11-L15 HydrophobicContact CE2-CD1 4.41Å; F11-L15 HydrophobicContact CZ-CD1 3.57Å; F11-L15 HydrophobicContact CZ-CG 4.46Å; F11-L15 WeakPolarHBondContact O-CG 3.4Å; F11-L15 PolarHBondContact O-N 3.27Å; F11-L68 HydrophobicContact CD2-CD1 3.44Å; F11-L68 VanDerWaalsContact CD2-CD1 3.44Å; F11-L68 HydrophobicContact CD2-CD2 3.98Å; F11-L68 HydrophobicContact CD2-CG 3.64Å; F11-L68 HydrophobicContact CE2-CD1 3.69Å; F11-L68 HydrophobicContact CE2-CD2 3.66Å; F11-L68 HydrophobicContact CE2-CG 3.86Å; F11-L68 HydrophobicContact CG-CD1 4.2Å
12W81.1Confident76.7Confident145 Ų14581.3 Ų81.355%0.54941%0.411SS..Hα-helixtrans-68.3-36.3180-78.8113.1000112.8N8 K9 H10 L15 K16N8-W12 PolarHBondContact O-N 3.39Å; N8-W12 VanDerWaalsContact O-N 3.15Å; K9-W12 PolarHBondContact O-N 3.15Å; H10-W12 PolarHBondContact O-N 2.96Å; W12-L15 PolarHBondContact O-N 2.87Å; W12-K16 WeakPolarHBondContact O-CB 3.44Å; W12-K16 WeakPolarHBondContact O-CG 3.06Å; W12-K16 PolarHBondContact O-N 3.47Å; W12-K16 VanDerWaalsContact O-N 3.1Å
13D84.3Confident78.7Confident78 Ų7877 Ų7742%0.41738%0.383SS..Hα-helixtrans-65.8-43.3177.1-70.3-17.7000110.7K9 H10 K16 S17K9-D13 WeakPolarHBondContact O-CB 3.48Å; K9-D13 VanDerWaalsContact O-CG 3.25Å; K9-D13 PolarHBondContact O-N 3.25Å; H10-D13 PolarHBondContact O-N 2.95Å; D13-K16 PolarHBondContact O-N 3.39Å; D13-S17 PolarHBondContact O-N 3.31Å
14F83.1Confident80.8Confident2 Ų274.5 Ų74.51%0.00936%0.362CS..Hα-helixtrans-64.5-44.2175.3178.6-107.3000112.6H10 F11 K16 S17 G20 F64 T67 L68 V161H10-F14 WeakPolarHBondContact O-CB 3.14Å; H10-F14 PolarHBondContact O-N 3.4Å; F11-F14 PolarHBondContact O-N 2.99Å; F14-K16 VanDerWaalsContact C-N 3.26Å; F14-K16 PolarHBondContact O-N 3.33Å; F14-S17 VanDerWaalsContact O-CB 3.28Å; F14-S17 WeakPolarHBondContact O-CB 3.15Å; F14-S17 PolarHBondContact O-N 3.1Å; F14-S17 PolarHBondContact O-OG 3.01Å; F14-G20 WeakPolarHBondContact O-CA 3.46Å; F14-F64 HydrophobicContact CD1-CE2 4.43Å; F14-F64 AromaticContact CE1-CD2 3.76Å; F14-F64 HydrophobicContact CE1-CD2 3.76Å; F14-F64 AromaticContact CE1-CE2 3.6Å; F14-F64 HydrophobicContact CE1-CE2 3.6Å; F14-F64 HydrophobicContact CE1-CZ 4.42Å; F14-F64 HydrophobicContact CZ-CD2 4.27Å; F14-F64 HydrophobicContact CZ-CE2 4.44Å; F14-T67 HydrophobicContact CD2-CG2 3.85Å; F14-T67 HydrophobicContact CE1-CG2 4.39Å; F14-T67 HydrophobicContact CE2-CG2 3.28Å; F14-T67 HydrophobicContact CZ-CG2 3.59Å; F14-L68 HydrophobicContact CD1-CB 4.43Å; F14-L68 HydrophobicContact CD1-CD1 3.61Å; F14-L68 HydrophobicContact CE1-CD1 4.23Å; F14-V161 HydrophobicContact CE2-CG1 4.27Å
15L84.4Confident82.6Confident39 Ų3971 Ų7120%0.20435%0.348CS..Hα-helixtrans-63.5-31.4178.5-74.4-179.8000113.3F11 W12 I24 F64 L68F11-L15 HydrophobicContact CD1-CD1 3.77Å; F11-L15 HydrophobicContact CD1-CG 4.5Å; F11-L15 HydrophobicContact CE1-CD1 3.2Å; F11-L15 HydrophobicContact CE1-CG 4.25Å; F11-L15 HydrophobicContact CE2-CD1 4.41Å; F11-L15 HydrophobicContact CZ-CD1 3.57Å; F11-L15 HydrophobicContact CZ-CG 4.46Å; F11-L15 WeakPolarHBondContact O-CG 3.4Å; F11-L15 PolarHBondContact O-N 3.27Å; W12-L15 PolarHBondContact O-N 2.87Å; L15-I24 HydrophobicContact CD2-CD1 3.82Å; L15-F64 HydrophobicContact CD2-CE2 4.33Å; L15-F64 HydrophobicContact CD2-CZ 3.89Å; L15-L68 HydrophobicContact CD2-CD1 4.37Å; L15-L68 HydrophobicContact CG-CD1 4.39Å
16K86.2Confident84.3Confident153 Ų15366.1 Ų66.167%0.66532%0.316SS*.Hα-helixtrans-82.2-18174.8-72.4177.5-178.2175.10112.9W12 D13 F14W12-K16 WeakPolarHBondContact O-CB 3.44Å; W12-K16 WeakPolarHBondContact O-CG 3.06Å; W12-K16 PolarHBondContact O-N 3.47Å; W12-K16 VanDerWaalsContact O-N 3.1Å; D13-K16 PolarHBondContact O-N 3.39Å; F14-K16 VanDerWaalsContact C-N 3.26Å; F14-K16 PolarHBondContact O-N 3.33Å
17S88Confident85.9Confident20 Ų2059.3 Ų59.314%0.1428%0.284CS..SBendtrans-63.1149.1176.781.90000110.9D13 F14 L19 G20 I21D13-S17 PolarHBondContact O-N 3.31Å; F14-S17 VanDerWaalsContact O-CB 3.28Å; F14-S17 WeakPolarHBondContact O-CB 3.15Å; F14-S17 PolarHBondContact O-N 3.1Å; F14-S17 PolarHBondContact O-OG 3.01Å; S17-L19 VanDerWaalsContact C-N 3.26Å; S17-L19 PolarHBondContact O-N 2.95Å; S17-G20 PolarHBondContact O-N 3.26Å; S17-G20 PolarHBondContact OG-N 3.04Å; S17-I21 WeakPolarHBondContact O-CG1 3.02Å; S17-I21 PolarHBondContact O-N 2.69Å
18F87.1Confident87.5Confident96 Ų9659.8 Ų59.842%0.42128%0.283SS..Hα-helixtrans-56.9-41.2177.3-178.8-102.5000112.1I21 I22 V145 Y149F18-I21 PolarHBondContact O-N 3.06Å; F18-I22 HydrophobicContact CD1-CG1 4.13Å; F18-I22 HydrophobicContact CE1-CD1 3.84Å; F18-I22 HydrophobicContact CE1-CG1 3.8Å; F18-I22 HydrophobicContact CE2-CD1 4.4Å; F18-I22 HydrophobicContact CE2-CG1 4.34Å; F18-I22 HydrophobicContact CZ-CD1 3.7Å; F18-I22 HydrophobicContact CZ-CG1 3.92Å; F18-I22 WeakPolarHBondContact O-CB 3.28Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 3.26Å; F18-V145 HydrophobicContact CZ-CG1 4.29Å; F18-Y149 AromaticContact CD1-CD1 3.88Å; F18-Y149 HydrophobicContact CD1-CD1 3.88Å; F18-Y149 AromaticContact CD1-CD2 3.88Å; F18-Y149 HydrophobicContact CD1-CD2 3.88Å; F18-Y149 AromaticContact CD1-CE1 3.78Å; F18-Y149 HydrophobicContact CD1-CE1 3.78Å; F18-Y149 AromaticContact CD1-CE2 3.8Å; F18-Y149 HydrophobicContact CD1-CE2 3.8Å; F18-Y149 AromaticContact CD1-CG 3.91Å; F18-Y149 HydrophobicContact CD1-CG 3.91Å; F18-Y149 AromaticContact CD1-CZ 3.74Å; F18-Y149 HydrophobicContact CE1-CD1 4.07Å; F18-Y149 AromaticContact CE1-CD2 3.7Å; F18-Y149 HydrophobicContact CE1-CD2 3.7Å; F18-Y149 HydrophobicContact CE1-CE1 4.4Å; F18-Y149 HydrophobicContact CE1-CE2 4.08Å; F18-Y149 AromaticContact CE1-CG 3.69Å; F18-Y149 HydrophobicContact CE1-CG 3.69Å
19L86.4Confident88.8Confident11 Ų1157.2 Ų57.26%0.05827%0.268CS..Hα-helixtrans-67.5-39178-75.3179.4000112.7S17 I22 R23 Y149 V150 V161S17-L19 VanDerWaalsContact C-N 3.26Å; S17-L19 PolarHBondContact O-N 2.95Å; L19-I22 PolarHBondContact O-N 2.8Å; L19-R23 WeakPolarHBondContact O-CB 3.45Å; L19-R23 WeakPolarHBondContact O-CG 3.5Å; L19-R23 PolarHBondContact O-N 2.85Å; L19-Y149 HydrophobicContact CD1-CE1 4.13Å; L19-Y149 HydrophobicContact CD2-CD1 3.62Å; L19-Y149 HydrophobicContact CD2-CE1 3.88Å; L19-Y149 HydrophobicContact CG-CD1 4.06Å; L19-Y149 HydrophobicContact CG-CE1 3.75Å; L19-V150 HydrophobicContact CD1-CG2 4.38Å; L19-V150 HydrophobicContact CD2-CG2 3.78Å; L19-V161 HydrophobicContact CB-CG1 4.4Å; L19-V161 HydrophobicContact CD1-CG1 3.67Å
20G89.4Confident89.7Confident0 Ų050.5 Ų50.50%024%0.238CC..Hα-helixtrans-59.6-46.6173.600000111.9F14 S17 R23 I24F14-G20 WeakPolarHBondContact O-CA 3.46Å; S17-G20 PolarHBondContact O-N 3.26Å; S17-G20 PolarHBondContact OG-N 3.04Å; G20-R23 PolarHBondContact O-N 3.45Å; G20-I24 VanDerWaalsContact O-CG1 3.32Å; G20-I24 WeakPolarHBondContact O-CG1 3.38Å; G20-I24 PolarHBondContact O-N 2.84Å
21I92.8Very high90.6Very high81 Ų8149.4 Ų49.442%0.41524%0.238SC..Hα-helixtrans-61.8-46.5177.4-63.7167.9000111S17 F18 R23 I24 L25S17-I21 WeakPolarHBondContact O-CG1 3.02Å; S17-I21 PolarHBondContact O-N 2.69Å; F18-I21 PolarHBondContact O-N 3.06Å; I21-R23 VanDerWaalsContact C-N 3.34Å; I21-R23 PolarHBondContact O-N 2.99Å; I21-I24 PolarHBondContact O-N 3.29Å; I21-L25 HydrophobicContact CG2-CD1 4.36Å; I21-L25 WeakPolarHBondContact O-CG 3.49Å; I21-L25 PolarHBondContact O-N 2.99Å
22I93.8Very high91.3Very high11 Ų1146.6 Ų46.66%0.05623%0.23CC..Hα-helixtrans-58.4-45.6176.8-71.1-102.8000110.8F18 L19 I24 L25 Q26 V142 V145F18-I22 HydrophobicContact CD1-CG1 4.13Å; F18-I22 HydrophobicContact CE1-CD1 3.84Å; F18-I22 HydrophobicContact CE1-CG1 3.8Å; F18-I22 HydrophobicContact CE2-CD1 4.4Å; F18-I22 HydrophobicContact CE2-CG1 4.34Å; F18-I22 HydrophobicContact CZ-CD1 3.7Å; F18-I22 HydrophobicContact CZ-CG1 3.92Å; F18-I22 WeakPolarHBondContact O-CB 3.28Å; F18-I22 WeakPolarHBondContact O-CG1 3.27Å; F18-I22 PolarHBondContact O-N 3.26Å; L19-I22 PolarHBondContact O-N 2.8Å; I22-I24 VanDerWaalsContact C-N 3.35Å; I22-I24 PolarHBondContact O-N 2.73Å; I22-L25 WeakPolarHBondContact O-CB 3.49Å; I22-L25 PolarHBondContact O-N 3.41Å; I22-Q26 WeakPolarHBondContact O-CG 3.38Å; I22-Q26 PolarHBondContact O-N 3.38Å; I22-V142 HydrophobicContact CD1-CG1 4.47Å; I22-V142 HydrophobicContact CG2-CG1 3.94Å; I22-V145 HydrophobicContact CD1-CB 4.38Å; I22-V145 HydrophobicContact CD1-CG1 3.76Å
23R94Very high92Very high8 Ų839.8 Ų39.83%0.0320%0.204CC..Hα-helixtrans-62-40.9178.2-72.4-79.3175.2-132.7-4.9111.9L19 G20 I21 Q26 I27 F64 N87 D91L19-R23 WeakPolarHBondContact O-CB 3.45Å; L19-R23 WeakPolarHBondContact O-CG 3.5Å; L19-R23 PolarHBondContact O-N 2.85Å; G20-R23 PolarHBondContact O-N 3.45Å; I21-R23 VanDerWaalsContact C-N 3.34Å; I21-R23 PolarHBondContact O-N 2.99Å; R23-Q26 WeakPolarHBondContact O-CB 3.19Å; R23-Q26 PolarHBondContact O-N 3.3Å; R23-I27 VanDerWaalsContact O-CG1 3.31Å; R23-I27 WeakPolarHBondContact O-CG1 3.33Å; R23-I27 PolarHBondContact O-N 3.18Å; R23-F64 HydrophobicContact CB-CD2 3.82Å; R23-N87 PolarHBondContact NE-OD1 3.26Å; R23-N87 PolarHBondContact NH2-OD1 3.01Å; R23-D91 IonicContact CZ-OD1 3.41Å; R23-D91 IonicContact CZ-OD2 3.74Å; R23-D91 IonicContact NH1-OD1 2.68Å; R23-D91 PolarHBondContact NH1-OD1 3.1Å; R23-D91 IonicContact NH1-OD2 3.7Å; R23-D91 IonicContact NH2-OD1 3.24Å; R23-D91 PolarHBondContact NH2-OD1 3.02Å; R23-D91 IonicContact NH2-OD2 3.05Å; R23-D91 PolarHBondContact NH2-OD2 3.4Å
24I95.4Very high92.6Very high57 Ų5739.2 Ų39.229%0.29220%0.196SC..Hα-helixtrans-61.4-45.6174.6-67.2164.1000110.4L15 G20 I21 I22 Q26 I27 L28 F64L15-I24 HydrophobicContact CD2-CD1 3.82Å; G20-I24 VanDerWaalsContact O-CG1 3.32Å; G20-I24 WeakPolarHBondContact O-CG1 3.38Å; G20-I24 PolarHBondContact O-N 2.84Å; I21-I24 PolarHBondContact O-N 3.29Å; I22-I24 VanDerWaalsContact C-N 3.35Å; I22-I24 PolarHBondContact O-N 2.73Å; I24-Q26 VanDerWaalsContact C-N 3.34Å; I24-Q26 PolarHBondContact O-N 3.43Å; I24-I27 PolarHBondContact O-N 3.5Å; I24-L28 HydrophobicContact CG2-CD1 3.88Å; I24-L28 HydrophobicContact CG2-CG 4.22Å; I24-L28 WeakPolarHBondContact O-CG 3.25Å; I24-L28 PolarHBondContact O-N 3.39Å; I24-F64 HydrophobicContact CD1-CE2 4.46Å; I24-F64 HydrophobicContact CG1-CE2 3.87Å; I24-F64 HydrophobicContact CG1-CZ 4.15Å
25L96.1Very high93.2Very high62 Ų6242.3 Ų42.333%0.32522%0.215SC..Hα-helixtrans-60.7-41.8177-70174.2000112.1I21 I22 I27 L28 F29 V142I21-L25 HydrophobicContact CG2-CD1 4.36Å; I21-L25 WeakPolarHBondContact O-CG 3.49Å; I21-L25 PolarHBondContact O-N 2.99Å; I22-L25 WeakPolarHBondContact O-CB 3.49Å; I22-L25 PolarHBondContact O-N 3.41Å; L25-I27 VanDerWaalsContact C-N 3.33Å; L25-I27 PolarHBondContact O-N 3.34Å; L25-L28 PolarHBondContact O-N 2.91Å; L25-F29 HydrophobicContact CB-CD2 4.31Å; L25-F29 HydrophobicContact CB-CE2 4.01Å; L25-F29 HydrophobicContact CD2-CE2 4.11Å; L25-F29 HydrophobicContact CD2-CZ 4.13Å; L25-F29 WeakPolarHBondContact O-CB 3.37Å; L25-F29 WeakPolarHBondContact O-CD2 3.35Å; L25-F29 WeakPolarHBondContact O-CG 3.43Å; L25-F29 PolarHBondContact O-N 3.37Å; L25-V142 HydrophobicContact CB-CG1 4Å; L25-V142 HydrophobicContact CB-CG2 4.42Å
26Q96.2Very high93.6Very high0 Ų041.9 Ų41.90%021%0.214CC..Hα-helixtrans-60-42.7174.5-68168.6-12.800111.9I22 R23 I24 G30 T60 V142 Y143I22-Q26 WeakPolarHBondContact O-CG 3.38Å; I22-Q26 PolarHBondContact O-N 3.38Å; R23-Q26 WeakPolarHBondContact O-CB 3.19Å; R23-Q26 PolarHBondContact O-N 3.3Å; I24-Q26 VanDerWaalsContact C-N 3.34Å; I24-Q26 PolarHBondContact O-N 3.43Å; Q26-G30 WeakPolarHBondContact O-CA 3.31Å; Q26-G30 PolarHBondContact O-N 3.49Å; Q26-T60 HydrophobicContact CB-CG2 3.95Å; Q26-V142 HydrophobicContact CG-CB 4.25Å; Q26-V142 HydrophobicContact CG-CG1 3.52Å; Q26-Y143 HydrophobicContact CB-CE1 4.19Å; Q26-Y143 HydrophobicContact CB-CE2 4.44Å; Q26-Y143 VanDerWaalsContact CD-CE1 3.4Å; Q26-Y143 HydrophobicContact CG-CD1 4.05Å; Q26-Y143 HydrophobicContact CG-CE1 3.86Å; Q26-Y143 HydrophobicContact CG-CE2 4.38Å; Q26-Y143 HydrophobicContact CG-CG 4.38Å
27I97.1Very high93.9Very high24 Ų2434.8 Ų34.812%0.12318%0.183CC..Hα-helixtrans-65-44.8177.5-68.3165.7000110.6R23 I24 L25 A31 W57 T60 L61 F64R23-I27 VanDerWaalsContact O-CG1 3.31Å; R23-I27 WeakPolarHBondContact O-CG1 3.33Å; R23-I27 PolarHBondContact O-N 3.18Å; I24-I27 PolarHBondContact O-N 3.5Å; L25-I27 VanDerWaalsContact C-N 3.33Å; L25-I27 PolarHBondContact O-N 3.34Å; I27-A31 WeakPolarHBondContact O-CB 3.44Å; I27-A31 PolarHBondContact O-N 2.98Å; I27-W57 VanDerWaalsContact O-CD1 3.23Å; I27-W57 PolarHBondContact O-NE1 2.88Å; I27-T60 HydrophobicContact CD1-CG2 4.43Å; I27-T60 HydrophobicContact CG1-CG2 3.86Å; I27-L61 HydrophobicContact CD1-CD1 3.93Å; I27-L61 HydrophobicContact CG1-CD1 4.46Å; I27-L61 HydrophobicContact CG2-CD1 4.33Å; I27-F64 HydrophobicContact CD1-CB 3.91Å; I27-F64 HydrophobicContact CD1-CD1 4.19Å; I27-F64 HydrophobicContact CD1-CD2 4.35Å; I27-F64 HydrophobicContact CD1-CG 3.9Å
28L97.4Very high94.1Very high106 Ų10636.1 Ų36.156%0.55520%0.196SC*.Hα-helixtrans-66-48.5-179.3-70.3176.4000112.1I24 L25 A31 G32I24-L28 HydrophobicContact CG2-CD1 3.88Å; I24-L28 HydrophobicContact CG2-CG 4.22Å; I24-L28 WeakPolarHBondContact O-CG 3.25Å; I24-L28 PolarHBondContact O-N 3.39Å; L25-L28 PolarHBondContact O-N 2.91Å; L28-A31 PolarHBondContact O-N 3.05Å; L28-G32 PolarHBondContact O-N 3.36Å
29F96.9Very high94.3Very high45 Ų4535.2 Ų35.220%0.19721%0.206CC..Hα-helixtrans-70.9-36.9179.1-61.1-41.3000112.3L25 G32 L33 F135 L138 A139 V142L25-F29 HydrophobicContact CB-CD2 4.31Å; L25-F29 HydrophobicContact CB-CE2 4.01Å; L25-F29 HydrophobicContact CD2-CE2 4.11Å; L25-F29 HydrophobicContact CD2-CZ 4.13Å; L25-F29 WeakPolarHBondContact O-CB 3.37Å; L25-F29 WeakPolarHBondContact O-CD2 3.35Å; L25-F29 WeakPolarHBondContact O-CG 3.43Å; L25-F29 PolarHBondContact O-N 3.37Å; F29-G32 PolarHBondContact O-N 3.42Å; F29-L33 WeakPolarHBondContact O-CB 3.47Å; F29-L33 PolarHBondContact O-N 3.46Å; F29-F135 HydrophobicContact CD1-CD1 4.14Å; F29-F135 HydrophobicContact CD1-CE1 4.4Å; F29-L138 HydrophobicContact CB-CB 4.5Å; F29-L138 HydrophobicContact CD1-CB 4.18Å; F29-L138 HydrophobicContact CD1-CD1 4.12Å; F29-L138 HydrophobicContact CD2-CB 3.94Å; F29-L138 HydrophobicContact CE1-CB 4.38Å; F29-L138 HydrophobicContact CE1-CD1 3.89Å; F29-L138 HydrophobicContact CE2-CB 4.14Å; F29-L138 HydrophobicContact CG-CB 3.96Å; F29-L138 HydrophobicContact CZ-CB 4.36Å; F29-L138 HydrophobicContact CZ-CD1 4.28Å; F29-A139 HydrophobicContact CB-CB 4.07Å; F29-V142 HydrophobicContact CD2-CG2 3.84Å; F29-V142 HydrophobicContact CE2-CG2 3.71Å
30G95.8Very high94.4Very high0 Ų036.4 Ų36.40%021%0.213CC..Hα-helixtrans-60.4-46.8172.400000111.8Q26 L33 W34Q26-G30 WeakPolarHBondContact O-CA 3.31Å; Q26-G30 PolarHBondContact O-N 3.49Å; G30-L33 WeakPolarHBondContact O-CB 3.1Å; G30-L33 PolarHBondContact O-N 3.15Å; G30-W34 PolarHBondContact O-N 3.41Å
31A96.8Very high94.1Very high25 Ų2544 Ų4421%0.20725%0.246CC..Hα-helixtrans-60.1-49174.300000111.9I27 L28 L33 W34 V35I27-A31 WeakPolarHBondContact O-CB 3.44Å; I27-A31 PolarHBondContact O-N 2.98Å; L28-A31 PolarHBondContact O-N 3.05Å; A31-L33 VanDerWaalsContact C-N 3.26Å; A31-L33 PolarHBondContact O-N 3.15Å; A31-W34 PolarHBondContact O-N 3.08Å; A31-V35 WeakPolarHBondContact O-CB 3.46Å; A31-V35 WeakPolarHBondContact O-CG2 3.4Å; A31-V35 PolarHBondContact O-N 2.92Å
32G96Very high93.7Very high16 Ų1643.3 Ų43.317%0.16524%0.238CC..Hα-helixtrans-53.2-44.8175.900000112.1L28 F29 T36L28-G32 PolarHBondContact O-N 3.36Å; F29-G32 PolarHBondContact O-N 3.42Å; G32-T36 WeakPolarHBondContact O-CB 3.3Å; G32-T36 PolarHBondContact O-N 2.88Å; G32-T36 VanDerWaalsContact O-N 3.09Å; G32-T36 PolarHBondContact O-OG1 2.89Å
33L95.6Very high93.4Very high1 Ų148.1 Ų48.11%0.00526%0.261CS..Hα-helixtrans-61.7-60.6177.917557.8000112.4F29 G30 A31 V35 T36 I37 V49 A53 Y98 A132 F135 A136F29-L33 WeakPolarHBondContact O-CB 3.47Å; F29-L33 PolarHBondContact O-N 3.46Å; G30-L33 WeakPolarHBondContact O-CB 3.1Å; G30-L33 PolarHBondContact O-N 3.15Å; A31-L33 VanDerWaalsContact C-N 3.26Å; A31-L33 PolarHBondContact O-N 3.15Å; L33-V35 PolarHBondContact O-N 3.2Å; L33-T36 PolarHBondContact O-N 3.47Å; L33-I37 HydrophobicContact CD1-CD1 3.73Å; L33-I37 HydrophobicContact CD1-CG1 4.43Å; L33-I37 HydrophobicContact CG-CD1 4.29Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 2.95Å; L33-I37 VanDerWaalsContact O-N 3.16Å; L33-V49 HydrophobicContact CD1-CG1 4.42Å; L33-A53 HydrophobicContact CD2-CB 3.55Å; L33-A53 HydrophobicContact CG-CB 3.84Å; L33-Y98 HydrophobicContact CD2-CD1 4.45Å; L33-Y98 HydrophobicContact CD2-CE1 3.53Å; L33-A132 HydrophobicContact CD1-CB 3.74Å; L33-A132 VanDerWaalsContact CD1-O 3.23Å; L33-A132 WeakPolarHBondContact CD1-O 3.36Å; L33-F135 HydrophobicContact CB-CB 3.88Å; L33-A136 HydrophobicContact CD1-CB 4.16Å; L33-A136 HydrophobicContact CD2-CB 3.93Å
34W95.1Very high93.2Very high66 Ų6650.1 Ų50.125%0.2528%0.284CS..Hα-helixtrans-71.8-33.1-171.173.8-109.7000111.8G30 A31 I37 A38 L50 A53 V54 W57G30-W34 PolarHBondContact O-N 3.41Å; A31-W34 PolarHBondContact O-N 3.08Å; W34-I37 PolarHBondContact O-N 3.26Å; W34-A38 HydrophobicContact CE3-CB 4.22Å; W34-A38 WeakPolarHBondContact O-CB 3.49Å; W34-A38 PolarHBondContact O-N 3.05Å; W34-L50 HydrophobicContact CB-CD1 3.73Å; W34-A53 HydrophobicContact CB-CB 3.94Å; W34-V54 HydrophobicContact CB-CG2 3.73Å; W34-V54 HydrophobicContact CD2-CG2 4.24Å; W34-V54 HydrophobicContact CG-CG2 3.85Å; W34-W57 AromaticContact CD1-CG 3.99Å; W34-W57 HydrophobicContact CZ2-CH2 4.35Å; W34-W57 HydrophobicContact CZ2-CZ3 4.39Å; W34-W57 AromaticContact NE1-CD2 3.45Å; W34-W57 AromaticContact NE1-CE2 3.76Å; W34-W57 AromaticContact NE1-CE3 3.75Å; W34-W57 AromaticContact NE1-CG 3.67Å
35V95.8Very high93Very high68 Ų6849.8 Ų49.841%0.41229%0.286SS..Hα-helixtrans-65.2-43.6174.41730000110.7A31 L33 I37 A38 A39A31-V35 WeakPolarHBondContact O-CB 3.46Å; A31-V35 WeakPolarHBondContact O-CG2 3.4Å; A31-V35 PolarHBondContact O-N 2.92Å; L33-V35 PolarHBondContact O-N 3.2Å; V35-I37 VanDerWaalsContact C-N 3.27Å; V35-I37 PolarHBondContact O-N 3.46Å; V35-A38 PolarHBondContact O-N 3.27Å; V35-A39 VanDerWaalsContact O-CB 3.24Å; V35-A39 WeakPolarHBondContact O-CB 3.45Å; V35-A39 PolarHBondContact O-N 3.3Å
36T93.9Very high92.9Very high30 Ų3046.8 Ų46.818%0.18427%0.271CS..Hα-helixtrans-58.3-42177-63.60000111.3G32 L33 N40 V128 A131 A132G32-T36 WeakPolarHBondContact O-CB 3.3Å; G32-T36 PolarHBondContact O-N 2.88Å; G32-T36 VanDerWaalsContact O-N 3.09Å; G32-T36 PolarHBondContact O-OG1 2.89Å; L33-T36 PolarHBondContact O-N 3.47Å; T36-N40 PolarHBondContact O-ND2 3.46Å; T36-V128 HydrophobicContact CG2-CG1 3.78Å; T36-A131 HydrophobicContact CG2-CB 4.3Å; T36-A132 HydrophobicContact CG2-CB 4.1Å
37I92.2Very high92.8Very high3 Ų351.8 Ų51.82%0.01529%0.294CS..Hα-helixtrans-70.6-49.4177.4-65.7171.9000110.8L33 W34 V35 A39 N40 Y42 I46 V49 L50 M105 A132L33-I37 HydrophobicContact CD1-CD1 3.73Å; L33-I37 HydrophobicContact CD1-CG1 4.43Å; L33-I37 HydrophobicContact CG-CD1 4.29Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 2.95Å; L33-I37 VanDerWaalsContact O-N 3.16Å; W34-I37 PolarHBondContact O-N 3.26Å; V35-I37 VanDerWaalsContact C-N 3.27Å; V35-I37 PolarHBondContact O-N 3.46Å; I37-A39 VanDerWaalsContact C-N 3.31Å; I37-A39 PolarHBondContact O-N 3.19Å; I37-N40 PolarHBondContact O-N 3.46Å; I37-N40 VanDerWaalsContact O-N 3.12Å; I37-N40 VanDerWaalsContact O-O 3.05Å; I37-Y42 HydrophobicContact CG2-CD1 3.8Å; I37-Y42 HydrophobicContact CG2-CD2 4.43Å; I37-Y42 HydrophobicContact CG2-CE1 4.37Å; I37-Y42 HydrophobicContact CG2-CG 3.87Å; I37-Y42 WeakPolarHBondContact O-CD1 3.44Å; I37-I46 HydrophobicContact CD1-CG2 4.37Å; I37-I46 HydrophobicContact CG2-CG2 3.38Å; I37-V49 HydrophobicContact CD1-CB 4.27Å; I37-V49 HydrophobicContact CD1-CG1 3.58Å; I37-L50 HydrophobicContact CB-CD1 4.08Å; I37-L50 HydrophobicContact CG2-CB 4.45Å; I37-L50 HydrophobicContact CG2-CD1 3.93Å; I37-M105 HydrophobicContact CD1-SD 4.26Å; I37-A132 HydrophobicContact CD1-CB 4.34Å; I37-A132 HydrophobicContact CG1-CB 3.97Å
38A92.4Very high92.7Very high49 Ų4954.2 Ų54.241%0.40530%0.304SS..Hα-helixtrans-67.8-27.4-174.100000113.8W34 V35 N40W34-A38 HydrophobicContact CE3-CB 4.22Å; W34-A38 WeakPolarHBondContact O-CB 3.49Å; W34-A38 PolarHBondContact O-N 3.05Å; V35-A38 PolarHBondContact O-N 3.27Å; A38-N40 PolarHBondContact O-N 3.15Å
39A91.2Very high92.6Very high77 Ų7749.2 Ų49.264%0.63628%0.277SS*.THydrogen-bonded Turntrans-70.7-8.7175.100000113.5V35 I37V35-A39 VanDerWaalsContact O-CB 3.24Å; V35-A39 WeakPolarHBondContact O-CB 3.45Å; V35-A39 PolarHBondContact O-N 3.3Å; I37-A39 VanDerWaalsContact C-N 3.31Å; I37-A39 PolarHBondContact O-N 3.19Å
40N87.8Confident92.5Very high36 Ų3648.2 Ų48.219%0.19327%0.274CS..SBendtrans-124158.5-176.5-67.4-83.2000110.4T36 I37 A38 Y42 L125 V128T36-N40 PolarHBondContact O-ND2 3.46Å; I37-N40 PolarHBondContact O-N 3.46Å; I37-N40 VanDerWaalsContact O-N 3.12Å; I37-N40 VanDerWaalsContact O-O 3.05Å; A38-N40 PolarHBondContact O-N 3.15Å; N40-Y42 VanDerWaalsContact O-CD1 3.29Å; N40-Y42 WeakPolarHBondContact O-CD1 3.29Å; N40-Y42 PolarHBondContact O-N 3.05Å; N40-L125 HydrophobicContact CB-CD2 4.29Å; N40-V128 HydrophobicContact CB-CG1 4.16Å; N40-V128 VanDerWaalsContact ND2-CG1 3.33Å; N40-V128 WeakPolarHBondContact ND2-CG1 3.31Å
41K83.9Confident92.5Very high159 Ų15954.1 Ų54.169%0.69130%0.3SS*.  trans-71.4120.4172.3-167.9-178.5178.1-1580108.9E43K41-E43 WeakPolarHBondContact CE-OE1 3.36Å; K41-E43 IonicContact NZ-OE1 2.96Å; K41-E43 PolarHBondContact NZ-OE1 3.33Å
42Y84.2Confident92.5Very high67 Ų6753 Ų5326%0.26329%0.29SS..  trans-124147.9178.961.1-89.4000111.4I37 N40 I46 H47 L50I37-Y42 HydrophobicContact CG2-CD1 3.8Å; I37-Y42 HydrophobicContact CG2-CD2 4.43Å; I37-Y42 HydrophobicContact CG2-CE1 4.37Å; I37-Y42 HydrophobicContact CG2-CG 3.87Å; I37-Y42 WeakPolarHBondContact O-CD1 3.44Å; N40-Y42 VanDerWaalsContact O-CD1 3.29Å; N40-Y42 WeakPolarHBondContact O-CD1 3.29Å; N40-Y42 PolarHBondContact O-N 3.05Å; Y42-I46 HydrophobicContact CD2-CB 4.26Å; Y42-I46 HydrophobicContact CD2-CG2 3.93Å; Y42-I46 HydrophobicContact CG-CB 4.48Å; Y42-I46 HydrophobicContact CG-CG2 3.89Å; Y42-H47 AromaticContact CD2-CE1 3.83Å; Y42-H47 AromaticContact CD2-ND1 3.91Å; Y42-H47 AromaticContact CE2-CE1 3.48Å; Y42-H47 VanDerWaalsContact CE2-CE1 3.48Å; Y42-H47 WeakPolarHBondContact CE2-CE1 3.47Å; Y42-H47 AromaticContact CE2-ND1 3.39Å; Y42-H47 WeakPolarHBondContact CE2-ND1 3.35Å; Y42-L50 HydrophobicContact CE1-CD2 4.09Å; Y42-L50 HydrophobicContact CE2-CD2 3.76Å; Y42-L50 VanDerWaalsContact CZ-CD2 3.41Å; Y42-L50 WeakPolarHBondContact OH-CD2 3.16Å
43E86.6Confident92.5Very high112 Ų11252.2 Ų52.252%0.52328%0.282SS..  trans-145.1154.4-177-64.5-179.5-175.600111.2K41K41-E43 WeakPolarHBondContact CE-OE1 3.36Å; K41-E43 IonicContact NZ-OE1 2.96Å; K41-E43 PolarHBondContact NZ-OE1 3.33Å
44G90.8Very high92.6Very high50 Ų5054.3 Ų54.352%0.51530%0.295SS..THydrogen-bonded Turntrans69.2-129.9173.800000113.3I46 H47G44-I46 PolarHBondContact O-N 3.46Å; G44-H47 PolarHBondContact O-CD2 3.49Å; G44-H47 PolarHBondContact O-N 3.45Å
45S92.2Very high92.7Very high49 Ų4954.2 Ų54.234%0.34330%0.299SS..THydrogen-bonded Turntrans-60.4-14.4-174.755.60000115.1H47 F48 V104 K108S45-H47 PolarHBondContact O-N 2.97Å; S45-F48 WeakPolarHBondContact O-CB 3.44Å; S45-F48 PolarHBondContact O-N 3.21Å; S45-V104 WeakPolarHBondContact OG-CG1 3.39Å; S45-K108 WeakPolarHBondContact OG-CE 3.38Å
46I93Very high92.7Very high0 Ų051.4 Ų51.40%028%0.281CS..Hα-helixtrans-66.2-25.7174.8-55-62.4000112I37 Y42 G44 F48 V49 L50 V104 M105 K108 Y129I37-I46 HydrophobicContact CD1-CG2 4.37Å; I37-I46 HydrophobicContact CG2-CG2 3.38Å; Y42-I46 HydrophobicContact CD2-CB 4.26Å; Y42-I46 HydrophobicContact CD2-CG2 3.93Å; Y42-I46 HydrophobicContact CG-CB 4.48Å; Y42-I46 HydrophobicContact CG-CG2 3.89Å; G44-I46 PolarHBondContact O-N 3.46Å; I46-F48 VanDerWaalsContact C-N 3.26Å; I46-F48 PolarHBondContact O-N 2.92Å; I46-V49 PolarHBondContact O-N 2.99Å; I46-V49 VanDerWaalsContact O-N 3.17Å; I46-L50 PolarHBondContact O-N 2.93Å; I46-V104 HydrophobicContact CD1-CG1 4.37Å; I46-M105 HydrophobicContact CD1-SD 3.74Å; I46-K108 HydrophobicContact CD1-CB 4.34Å; I46-K108 HydrophobicContact CD1-CD 4.32Å; I46-K108 HydrophobicContact CD1-CG 3.84Å; I46-Y129 HydrophobicContact CD1-CD1 4.28Å; I46-Y129 HydrophobicContact CD1-CE1 3.88Å; I46-Y129 HydrophobicContact CG1-CE1 4.15Å
47H94.2Very high92.9Very high104 Ų10452.2 Ų52.248%0.48128%0.281SS..Hα-helixtrans-59.4-38.2173.4-68.8-69.5000112.1Y42 G44 S45 L50 F51Y42-H47 AromaticContact CD2-CE1 3.83Å; Y42-H47 AromaticContact CD2-ND1 3.91Å; Y42-H47 AromaticContact CE2-CE1 3.48Å; Y42-H47 VanDerWaalsContact CE2-CE1 3.48Å; Y42-H47 WeakPolarHBondContact CE2-CE1 3.47Å; Y42-H47 AromaticContact CE2-ND1 3.39Å; Y42-H47 WeakPolarHBondContact CE2-ND1 3.35Å; G44-H47 PolarHBondContact O-CD2 3.49Å; G44-H47 PolarHBondContact O-N 3.45Å; S45-H47 PolarHBondContact O-N 2.97Å; H47-L50 PolarHBondContact O-N 2.93Å; H47-F51 WeakPolarHBondContact O-CB 3.24Å; H47-F51 PolarHBondContact O-N 3.01Å
48F94.6Very high93.1Very high76 Ų7656 Ų5633%0.33330%0.301SS..Hα-helixtrans-65-45.1175.1169.8-103.5000111.5S45 I46 L50 F51 V52 P100 A101S45-F48 WeakPolarHBondContact O-CB 3.44Å; S45-F48 PolarHBondContact O-N 3.21Å; I46-F48 VanDerWaalsContact C-N 3.26Å; I46-F48 PolarHBondContact O-N 2.92Å; F48-L50 VanDerWaalsContact C-N 3.31Å; F48-L50 PolarHBondContact O-N 3.49Å; F48-F51 WeakPolarHBondContact O-CB 3.45Å; F48-F51 PolarHBondContact O-N 3.39Å; F48-V52 HydrophobicContact CD2-CG2 4.21Å; F48-V52 HydrophobicContact CE1-CG2 4.09Å; F48-V52 HydrophobicContact CE2-CG2 3.71Å; F48-V52 HydrophobicContact CZ-CG2 3.64Å; F48-V52 WeakPolarHBondContact O-CG2 3.27Å; F48-V52 PolarHBondContact O-N 2.9Å; F48-P100 HydrophobicContact CE1-CB 4.14Å; F48-P100 HydrophobicContact CE1-CG 4.06Å; F48-P100 HydrophobicContact CZ-CB 4.47Å; F48-P100 HydrophobicContact CZ-CG 4.01Å; F48-A101 HydrophobicContact CE1-CB 4.25Å
49V95.6Very high93.3Very high0 Ų057.4 Ų57.40%030%0.301CS..Hα-helixtrans-59.6-45.2177.4-178.60000110.7L33 I37 I46 V52 A53 A101 V104 M105L33-V49 HydrophobicContact CD1-CG1 4.42Å; I37-V49 HydrophobicContact CD1-CB 4.27Å; I37-V49 HydrophobicContact CD1-CG1 3.58Å; I46-V49 PolarHBondContact O-N 2.99Å; I46-V49 VanDerWaalsContact O-N 3.17Å; V49-V52 PolarHBondContact O-N 3.45Å; V49-A53 VanDerWaalsContact O-CB 3.28Å; V49-A53 WeakPolarHBondContact O-CB 3.47Å; V49-A53 PolarHBondContact O-N 3.42Å; V49-A101 HydrophobicContact CG1-CB 4.28Å; V49-A101 HydrophobicContact CG2-CB 4.22Å; V49-V104 HydrophobicContact CG2-CB 3.9Å; V49-V104 HydrophobicContact CG2-CG1 3.66Å; V49-M105 HydrophobicContact CB-SD 4.27Å; V49-M105 HydrophobicContact CG1-CG 3.89Å; V49-M105 HydrophobicContact CG1-SD 3.83Å; V49-M105 HydrophobicContact CG2-CG 4.11Å; V49-M105 HydrophobicContact CG2-SD 3.97Å
50L95.4Very high93.5Very high25 Ų2553.7 Ų53.713%0.13127%0.271CS..Hα-helixtrans-65.6-41.2179-168.371.9000111.8W34 I37 Y42 I46 H47 F48 A53 V54W34-L50 HydrophobicContact CB-CD1 3.73Å; I37-L50 HydrophobicContact CB-CD1 4.08Å; I37-L50 HydrophobicContact CG2-CB 4.45Å; I37-L50 HydrophobicContact CG2-CD1 3.93Å; Y42-L50 HydrophobicContact CE1-CD2 4.09Å; Y42-L50 HydrophobicContact CE2-CD2 3.76Å; Y42-L50 VanDerWaalsContact CZ-CD2 3.41Å; Y42-L50 WeakPolarHBondContact OH-CD2 3.16Å; I46-L50 PolarHBondContact O-N 2.93Å; H47-L50 PolarHBondContact O-N 2.93Å; F48-L50 VanDerWaalsContact C-N 3.31Å; F48-L50 PolarHBondContact O-N 3.49Å; L50-A53 PolarHBondContact O-N 2.93Å; L50-V54 HydrophobicContact CD1-CG2 4.16Å; L50-V54 HydrophobicContact CG-CG2 4.17Å; L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 WeakPolarHBondContact O-CG2 3.21Å; L50-V54 PolarHBondContact O-N 3.37Å
51F95.8Very high93.8Very high123 Ų12354 Ų5454%0.53927%0.272SS..Hα-helixtrans-57.4-51.5174.6169-101.9000111.4H47 F48 A53 L55H47-F51 WeakPolarHBondContact O-CB 3.24Å; H47-F51 PolarHBondContact O-N 3.01Å; F48-F51 WeakPolarHBondContact O-CB 3.45Å; F48-F51 PolarHBondContact O-N 3.39Å; F51-A53 PolarHBondContact O-N 2.9Å; F51-L55 HydrophobicContact CE1-CD2 4.08Å; F51-L55 HydrophobicContact CE2-CD2 4.32Å; F51-L55 HydrophobicContact CZ-CD2 3.75Å; F51-L55 WeakPolarHBondContact O-CB 3.16Å; F51-L55 PolarHBondContact O-N 3.4Å
52V96.4Very high94.3Very high1 Ų150.1 Ų50.11%0.00626%0.262CS..Hα-helixtrans-58.6-49.6177.2173.40000110.2F48 V49 F56 L97 Y98F48-V52 HydrophobicContact CD2-CG2 4.21Å; F48-V52 HydrophobicContact CE1-CG2 4.09Å; F48-V52 HydrophobicContact CE2-CG2 3.71Å; F48-V52 HydrophobicContact CZ-CG2 3.64Å; F48-V52 WeakPolarHBondContact O-CG2 3.27Å; F48-V52 PolarHBondContact O-N 2.9Å; V49-V52 PolarHBondContact O-N 3.45Å; V52-F56 HydrophobicContact CG1-CD2 3.86Å; V52-F56 HydrophobicContact CG1-CE2 4.18Å; V52-F56 VanDerWaalsContact O-CD2 3.28Å; V52-F56 WeakPolarHBondContact O-CD2 3.34Å; V52-F56 PolarHBondContact O-N 3.46Å; V52-F56 VanDerWaalsContact O-N 3.1Å; V52-L97 HydrophobicContact CG1-CB 4.06Å; V52-L97 HydrophobicContact CG2-CB 4.27Å; V52-Y98 HydrophobicContact CG1-CD2 3.8Å; V52-Y98 HydrophobicContact CG1-CE2 3.97Å; V52-Y98 HydrophobicContact CG1-CG 4.3Å
53A96.1Very high94.6Very high0 Ų047.5 Ų47.50%025%0.254CS..Hα-helixtrans-61.2-48.9-176.800000112.6L33 W34 V49 L50 F51 W57L33-A53 HydrophobicContact CD2-CB 3.55Å; L33-A53 HydrophobicContact CG-CB 3.84Å; W34-A53 HydrophobicContact CB-CB 3.94Å; V49-A53 VanDerWaalsContact O-CB 3.28Å; V49-A53 WeakPolarHBondContact O-CB 3.47Å; V49-A53 PolarHBondContact O-N 3.42Å; L50-A53 PolarHBondContact O-N 2.93Å; F51-A53 PolarHBondContact O-N 2.9Å; A53-W57 WeakPolarHBondContact O-CB 3.38Å; A53-W57 PolarHBondContact O-N 3.09Å
54V97.2Very high94.8Very high45 Ų4543.2 Ų43.227%0.27323%0.234SC..Hα-helixtrans-71.2-42.9-177.9174.50000111.3W34 L50 W57 L58W34-V54 HydrophobicContact CB-CG2 3.73Å; W34-V54 HydrophobicContact CD2-CG2 4.24Å; W34-V54 HydrophobicContact CG-CG2 3.85Å; L50-V54 HydrophobicContact CD1-CG2 4.16Å; L50-V54 HydrophobicContact CG-CG2 4.17Å; L50-V54 WeakPolarHBondContact O-CB 3.39Å; L50-V54 WeakPolarHBondContact O-CG2 3.21Å; L50-V54 PolarHBondContact O-N 3.37Å; V54-W57 PolarHBondContact O-N 3.4Å; V54-L58 HydrophobicContact CG1-CD1 3.89Å; V54-L58 HydrophobicContact CG1-CG 4.26Å; V54-L58 WeakPolarHBondContact O-CB 3.45Å; V54-L58 WeakPolarHBondContact O-CG 3.33Å; V54-L58 PolarHBondContact O-N 2.87Å
55L97.1Very high94.8Very high64 Ų6445.8 Ų45.834%0.33523%0.231SC..Hα-helixtrans-57.7-54.6179175.764000111F51 W57 L58 L59F51-L55 HydrophobicContact CE1-CD2 4.08Å; F51-L55 HydrophobicContact CE2-CD2 4.32Å; F51-L55 HydrophobicContact CZ-CD2 3.75Å; F51-L55 WeakPolarHBondContact O-CB 3.16Å; F51-L55 PolarHBondContact O-N 3.4Å; L55-W57 VanDerWaalsContact C-N 3.34Å; L55-W57 PolarHBondContact O-N 2.88Å; L55-L58 PolarHBondContact O-N 2.84Å; L55-L59 HydrophobicContact CD1-CD1 3.96Å; L55-L59 HydrophobicContact CD1-CG 4.3Å; L55-L59 HydrophobicContact CG-CD1 4.04Å; L55-L59 WeakPolarHBondContact O-CB 3.5Å; L55-L59 VanDerWaalsContact O-CG 3.29Å; L55-L59 WeakPolarHBondContact O-CG 3.43Å; L55-L59 PolarHBondContact O-N 2.75Å
56F96.6Very high94.7Very high9 Ų945.2 Ų45.24%0.03922%0.224CC..Hα-helixtrans-70.7-31.6-178.5-76-69.2000112.4V52 T60 H90 A93 A94 L97 Y98 Y143V52-F56 HydrophobicContact CG1-CD2 3.86Å; V52-F56 HydrophobicContact CG1-CE2 4.18Å; V52-F56 VanDerWaalsContact O-CD2 3.28Å; V52-F56 WeakPolarHBondContact O-CD2 3.34Å; V52-F56 PolarHBondContact O-N 3.46Å; V52-F56 VanDerWaalsContact O-N 3.1Å; F56-T60 VanDerWaalsContact O-CB 3.24Å; F56-T60 WeakPolarHBondContact O-CB 3.37Å; F56-T60 PolarHBondContact O-N 3.21Å; F56-T60 PolarHBondContact O-OG1 3.24Å; F56-H90 AromaticContact CD1-CE1 3.54Å; F56-H90 AromaticContact CD1-ND1 3.82Å; F56-A93 HydrophobicContact CE1-CB 4.08Å; F56-A93 HydrophobicContact CZ-CB 4.02Å; F56-A94 HydrophobicContact CB-CB 4.42Å; F56-A94 HydrophobicContact CD1-CB 3.47Å; F56-A94 VanDerWaalsContact CD1-CB 3.47Å; F56-A94 HydrophobicContact CD2-CB 4.27Å; F56-A94 HydrophobicContact CE1-CB 3.7Å; F56-A94 HydrophobicContact CE2-CB 4.47Å; F56-A94 HydrophobicContact CG-CB 3.8Å; F56-A94 HydrophobicContact CZ-CB 4.21Å; F56-L97 HydrophobicContact CE2-CB 3.92Å; F56-L97 HydrophobicContact CE2-CD1 3.62Å; F56-L97 HydrophobicContact CE2-CG 4.37Å; F56-L97 HydrophobicContact CZ-CD1 3.79Å; F56-Y98 HydrophobicContact CB-CE2 4.15Å; F56-Y98 HydrophobicContact CD2-CE2 4.28Å; F56-Y98 HydrophobicContact CG-CE2 4.48Å; F56-Y143 PolarHBondContact O-OH 3.01Å
57W97.6Very high94.4Very high47 Ų4745.3 Ų45.318%0.17822%0.224CC..Hα-helixtrans-62.6-47.7172.9179.981.7000112I27 W34 A53 V54 L55 T60 L61I27-W57 VanDerWaalsContact O-CD1 3.23Å; I27-W57 PolarHBondContact O-NE1 2.88Å; W34-W57 AromaticContact CD1-CG 3.99Å; W34-W57 HydrophobicContact CZ2-CH2 4.35Å; W34-W57 HydrophobicContact CZ2-CZ3 4.39Å; W34-W57 AromaticContact NE1-CD2 3.45Å; W34-W57 AromaticContact NE1-CE2 3.76Å; W34-W57 AromaticContact NE1-CE3 3.75Å; W34-W57 AromaticContact NE1-CG 3.67Å; A53-W57 WeakPolarHBondContact O-CB 3.38Å; A53-W57 PolarHBondContact O-N 3.09Å; V54-W57 PolarHBondContact O-N 3.4Å; L55-W57 VanDerWaalsContact C-N 3.34Å; L55-W57 PolarHBondContact O-N 2.88Å; W57-T60 PolarHBondContact O-N 2.87Å; W57-L61 HydrophobicContact CH2-CD2 3.78Å; W57-L61 HydrophobicContact CZ2-CD2 4.07Å; W57-L61 HydrophobicContact CZ3-CD2 4.16Å; W57-L61 VanDerWaalsContact O-CB 3.27Å; W57-L61 WeakPolarHBondContact O-CB 3.28Å; W57-L61 PolarHBondContact O-N 2.81Å
58L97.4Very high94Very high83 Ų8341.2 Ų41.244%0.43521%0.206SC..Hα-helixtrans-63.3-46.8177.6-74174.7000111.6V54 L55 T60 L61 T62V54-L58 HydrophobicContact CG1-CD1 3.89Å; V54-L58 HydrophobicContact CG1-CG 4.26Å; V54-L58 WeakPolarHBondContact O-CB 3.45Å; V54-L58 WeakPolarHBondContact O-CG 3.33Å; V54-L58 PolarHBondContact O-N 2.87Å; L55-L58 PolarHBondContact O-N 2.84Å; L58-T60 VanDerWaalsContact C-N 3.35Å; L58-T60 PolarHBondContact O-N 3.36Å; L58-L61 WeakPolarHBondContact O-CB 3.35Å; L58-L61 PolarHBondContact O-N 3.49Å; L58-T62 WeakPolarHBondContact O-CB 3.49Å; L58-T62 PolarHBondContact O-N 3.04Å; L58-T62 PolarHBondContact O-OG1 3.33Å; L58-T62 VanDerWaalsContact O-OG1 3.06Å
59L95.1Very high93.6Very high78 Ų7842.8 Ų42.841%0.40822%0.217SC..Hα-helixtrans-60.7-43.7178-72.9175.3000111.8L55 T62 A63 H90L55-L59 HydrophobicContact CD1-CD1 3.96Å; L55-L59 HydrophobicContact CD1-CG 4.3Å; L55-L59 HydrophobicContact CG-CD1 4.04Å; L55-L59 WeakPolarHBondContact O-CB 3.5Å; L55-L59 VanDerWaalsContact O-CG 3.29Å; L55-L59 WeakPolarHBondContact O-CG 3.43Å; L55-L59 PolarHBondContact O-N 2.75Å; L59-T62 PolarHBondContact O-N 2.68Å; L59-A63 WeakPolarHBondContact O-CB 3.48Å; L59-A63 PolarHBondContact O-N 3.25Å; L59-H90 WeakPolarHBondContact CB-CE1 3.33Å
60T95.2Very high93Very high0 Ų047.3 Ų47.30%024%0.241CC..Hα-helixtrans-64.2-40.9175.2-640000111.5Q26 I27 F56 W57 L58 A63 F64 H90 Y143Q26-T60 HydrophobicContact CB-CG2 3.95Å; I27-T60 HydrophobicContact CD1-CG2 4.43Å; I27-T60 HydrophobicContact CG1-CG2 3.86Å; F56-T60 VanDerWaalsContact O-CB 3.24Å; F56-T60 WeakPolarHBondContact O-CB 3.37Å; F56-T60 PolarHBondContact O-N 3.21Å; F56-T60 PolarHBondContact O-OG1 3.24Å; W57-T60 PolarHBondContact O-N 2.87Å; L58-T60 VanDerWaalsContact C-N 3.35Å; L58-T60 PolarHBondContact O-N 3.36Å; T60-A63 PolarHBondContact O-N 3.47Å; T60-F64 WeakPolarHBondContact O-CB 3.42Å; T60-F64 PolarHBondContact O-N 3.04Å; T60-H90 PolarHBondContact OG1-NE2 2.98Å; T60-Y143 PolarHBondContact OG1-OH 3.3Å
61L95.4Very high92.5Very high41 Ų4151.2 Ų51.222%0.21526%0.257CS..Hα-helixtrans-62.8-45177.1-172.967.5000111.2I27 W57 L58 F64 F65I27-L61 HydrophobicContact CD1-CD1 3.93Å; I27-L61 HydrophobicContact CG1-CD1 4.46Å; I27-L61 HydrophobicContact CG2-CD1 4.33Å; W57-L61 HydrophobicContact CH2-CD2 3.78Å; W57-L61 HydrophobicContact CZ2-CD2 4.07Å; W57-L61 HydrophobicContact CZ3-CD2 4.16Å; W57-L61 VanDerWaalsContact O-CB 3.27Å; W57-L61 WeakPolarHBondContact O-CB 3.28Å; W57-L61 PolarHBondContact O-N 2.81Å; L58-L61 WeakPolarHBondContact O-CB 3.35Å; L58-L61 PolarHBondContact O-N 3.49Å; L61-F64 WeakPolarHBondContact O-CB 3.26Å; L61-F64 PolarHBondContact O-N 3.31Å; L61-F65 HydrophobicContact CD1-CD2 4.12Å; L61-F65 HydrophobicContact CD1-CE2 3.51Å; L61-F65 HydrophobicContact CD1-CZ 4.31Å; L61-F65 HydrophobicContact CD2-CE2 4.33Å; L61-F65 HydrophobicContact CG-CD2 3.98Å; L61-F65 HydrophobicContact CG-CE2 3.67Å; L61-F65 WeakPolarHBondContact O-CD2 3.39Å; L61-F65 PolarHBondContact O-N 3.4Å
62T93.1Very high91.9Very high79 Ų7946.8 Ų46.849%0.48524%0.238SC..Hα-helixtrans-62.2-48.6175.4-60.70000111.3L58 L59 F64 F65 I66L58-T62 WeakPolarHBondContact O-CB 3.49Å; L58-T62 PolarHBondContact O-N 3.04Å; L58-T62 PolarHBondContact O-OG1 3.33Å; L58-T62 VanDerWaalsContact O-OG1 3.06Å; L59-T62 PolarHBondContact O-N 2.68Å; T62-F64 VanDerWaalsContact C-N 3.28Å; T62-F64 PolarHBondContact O-N 3.06Å; T62-F65 PolarHBondContact O-N 2.85Å; T62-I66 HydrophobicContact CG2-CD1 3.69Å; T62-I66 HydrophobicContact CG2-CG1 4.46Å; T62-I66 VanDerWaalsContact O-CG1 3.28Å; T62-I66 WeakPolarHBondContact O-CG1 3.48Å; T62-I66 PolarHBondContact O-N 3.26Å
63A90.7Very high91.2Very high12 Ų1252.9 Ų52.910%0.09927%0.271CS..Hα-helixtrans-61-38.8177.300000112L59 T60 T67 W83L59-A63 WeakPolarHBondContact O-CB 3.48Å; L59-A63 PolarHBondContact O-N 3.25Å; T60-A63 PolarHBondContact O-N 3.47Å; A63-T67 WeakPolarHBondContact O-CB 3.29Å; A63-T67 PolarHBondContact O-N 2.97Å; A63-T67 PolarHBondContact O-OG1 3.37Å; A63-W83 HydrophobicContact CB-CH2 4.23Å; A63-W83 HydrophobicContact CB-CZ2 4.13Å
64F91.4Very high90.5Very high21 Ų2158.9 Ų58.99%0.09230%0.302CS..Hα-helixtrans-60.1-52.2175.4177.3-98.5000111.2F14 L15 R23 I24 I27 T60 L61 T62 I66 T67 L68F14-F64 HydrophobicContact CD1-CE2 4.43Å; F14-F64 AromaticContact CE1-CD2 3.76Å; F14-F64 HydrophobicContact CE1-CD2 3.76Å; F14-F64 AromaticContact CE1-CE2 3.6Å; F14-F64 HydrophobicContact CE1-CE2 3.6Å; F14-F64 HydrophobicContact CE1-CZ 4.42Å; F14-F64 HydrophobicContact CZ-CD2 4.27Å; F14-F64 HydrophobicContact CZ-CE2 4.44Å; L15-F64 HydrophobicContact CD2-CE2 4.33Å; L15-F64 HydrophobicContact CD2-CZ 3.89Å; R23-F64 HydrophobicContact CB-CD2 3.82Å; I24-F64 HydrophobicContact CD1-CE2 4.46Å; I24-F64 HydrophobicContact CG1-CE2 3.87Å; I24-F64 HydrophobicContact CG1-CZ 4.15Å; I27-F64 HydrophobicContact CD1-CB 3.91Å; I27-F64 HydrophobicContact CD1-CD1 4.19Å; I27-F64 HydrophobicContact CD1-CD2 4.35Å; I27-F64 HydrophobicContact CD1-CG 3.9Å; T60-F64 WeakPolarHBondContact O-CB 3.42Å; T60-F64 PolarHBondContact O-N 3.04Å; L61-F64 WeakPolarHBondContact O-CB 3.26Å; L61-F64 PolarHBondContact O-N 3.31Å; T62-F64 VanDerWaalsContact C-N 3.28Å; T62-F64 PolarHBondContact O-N 3.06Å; F64-I66 PolarHBondContact O-N 3.28Å; F64-T67 PolarHBondContact O-N 2.93Å; F64-L68 HydrophobicContact CE1-CD2 3.89Å; F64-L68 HydrophobicContact CZ-CD1 4.38Å; F64-L68 HydrophobicContact CZ-CD2 4.37Å; F64-L68 WeakPolarHBondContact O-CB 3.34Å; F64-L68 PolarHBondContact O-N 3.25Å
65F90.6Very high89.7Confident104 Ų10458.4 Ų58.446%0.45630%0.299SS..Hα-helixtrans-64.8-38.4179.7-77.1-63000113.3L61 T62 T67 L68 L69L61-F65 HydrophobicContact CD1-CD2 4.12Å; L61-F65 HydrophobicContact CD1-CE2 3.51Å; L61-F65 HydrophobicContact CD1-CZ 4.31Å; L61-F65 HydrophobicContact CD2-CE2 4.33Å; L61-F65 HydrophobicContact CG-CD2 3.98Å; L61-F65 HydrophobicContact CG-CE2 3.67Å; L61-F65 WeakPolarHBondContact O-CD2 3.39Å; L61-F65 PolarHBondContact O-N 3.4Å; T62-F65 PolarHBondContact O-N 2.85Å; F65-T67 VanDerWaalsContact C-N 3.33Å; F65-T67 PolarHBondContact O-N 2.9Å; F65-L68 HydrophobicContact CD1-CD2 4.12Å; F65-L68 HydrophobicContact CE1-CD2 4.46Å; F65-L68 PolarHBondContact O-N 3.3Å; F65-L69 WeakPolarHBondContact O-CB 3.39Å; F65-L69 VanDerWaalsContact O-CG 3.27Å; F65-L69 WeakPolarHBondContact O-CG 3.12Å; F65-L69 PolarHBondContact O-N 3.5Å
66I89.4Confident88.6Confident37 Ų3760.4 Ų60.419%0.1932%0.316CS..Hα-helixtrans-62.9-43.3176.6-69.4167.9000110.8T62 F64 D70 K71 Q72 V75 W83T62-I66 HydrophobicContact CG2-CD1 3.69Å; T62-I66 HydrophobicContact CG2-CG1 4.46Å; T62-I66 VanDerWaalsContact O-CG1 3.28Å; T62-I66 WeakPolarHBondContact O-CG1 3.48Å; T62-I66 PolarHBondContact O-N 3.26Å; F64-I66 PolarHBondContact O-N 3.28Å; I66-D70 PolarHBondContact O-N 3.47Å; I66-K71 PolarHBondContact O-N 3.42Å; I66-Q72 HydrophobicContact CG2-CG 4.4Å; I66-V75 HydrophobicContact CD1-CG2 3.79Å; I66-V75 HydrophobicContact CG2-CG2 4.08Å; I66-W83 HydrophobicContact CB-CH2 3.92Å; I66-W83 HydrophobicContact CB-CZ2 4Å; I66-W83 HydrophobicContact CD1-CH2 4.03Å; I66-W83 HydrophobicContact CG2-CH2 3.61Å; I66-W83 HydrophobicContact CG2-CZ2 3.73Å; I66-W83 HydrophobicContact CG2-CZ3 4.24Å
67T87.3Confident87.6Confident3 Ų365.4 Ų65.42%0.01835%0.347CS..Hα-helixtrans-68.3-41.8178-51.20000111F14 A63 F64 F65 L69 D70 W83 V161F14-T67 HydrophobicContact CD2-CG2 3.85Å; F14-T67 HydrophobicContact CE1-CG2 4.39Å; F14-T67 HydrophobicContact CE2-CG2 3.28Å; F14-T67 HydrophobicContact CZ-CG2 3.59Å; A63-T67 WeakPolarHBondContact O-CB 3.29Å; A63-T67 PolarHBondContact O-N 2.97Å; A63-T67 PolarHBondContact O-OG1 3.37Å; F64-T67 PolarHBondContact O-N 2.93Å; F65-T67 VanDerWaalsContact C-N 3.33Å; F65-T67 PolarHBondContact O-N 2.9Å; T67-L69 VanDerWaalsContact C-N 3.34Å; T67-L69 PolarHBondContact O-N 2.97Å; T67-D70 PolarHBondContact O-N 3.43Å; T67-W83 WeakPolarHBondContact OG1-CZ2 3.21Å; T67-W83 PolarHBondContact OG1-NE1 3.35Å; T67-V161 HydrophobicContact CG2-CB 4.43Å; T67-V161 HydrophobicContact CG2-CG1 3.98Å
68L86.3Confident86.8Confident17 Ų1767.7 Ų67.79%0.08936%0.363CS..Hα-helixtrans-62.1-39.4179.6-170.171.3000112.7F11 F14 L15 F64 F65 D70F11-L68 HydrophobicContact CD2-CD1 3.44Å; F11-L68 VanDerWaalsContact CD2-CD1 3.44Å; F11-L68 HydrophobicContact CD2-CD2 3.98Å; F11-L68 HydrophobicContact CD2-CG 3.64Å; F11-L68 HydrophobicContact CE2-CD1 3.69Å; F11-L68 HydrophobicContact CE2-CD2 3.66Å; F11-L68 HydrophobicContact CE2-CG 3.86Å; F11-L68 HydrophobicContact CG-CD1 4.2Å; F14-L68 HydrophobicContact CD1-CB 4.43Å; F14-L68 HydrophobicContact CD1-CD1 3.61Å; F14-L68 HydrophobicContact CE1-CD1 4.23Å; L15-L68 HydrophobicContact CD2-CD1 4.37Å; L15-L68 HydrophobicContact CG-CD1 4.39Å; F64-L68 HydrophobicContact CE1-CD2 3.89Å; F64-L68 HydrophobicContact CZ-CD1 4.38Å; F64-L68 HydrophobicContact CZ-CD2 4.37Å; F64-L68 WeakPolarHBondContact O-CB 3.34Å; F64-L68 PolarHBondContact O-N 3.25Å; F65-L68 HydrophobicContact CD1-CD2 4.12Å; F65-L68 HydrophobicContact CE1-CD2 4.46Å; F65-L68 PolarHBondContact O-N 3.3Å; L68-D70 VanDerWaalsContact C-N 3.27Å
69L85.8Confident85.9Confident109 Ų10964.4 Ų64.457%0.57135%0.348SS*.THydrogen-bonded Turntrans-84.2-0.3179.6-66.1173.9000113.6F65 T67 K71F65-L69 WeakPolarHBondContact O-CB 3.39Å; F65-L69 VanDerWaalsContact O-CG 3.27Å; F65-L69 WeakPolarHBondContact O-CG 3.12Å; F65-L69 PolarHBondContact O-N 3.5Å; T67-L69 VanDerWaalsContact C-N 3.34Å; T67-L69 PolarHBondContact O-N 2.97Å; L69-K71 HydrophobicContact CB-CB 4.42Å; L69-K71 HydrophobicContact CB-CG 3.84Å; L69-K71 WeakPolarHBondContact O-CG 3.4Å; L69-K71 PolarHBondContact O-N 3.26Å
70D83.3Confident85.3Confident95 Ų9561.6 Ų61.651%0.50834%0.338SS..THydrogen-bonded Turntrans52.242.4-173-160.533000112.6I66 T67 L68I66-D70 PolarHBondContact O-N 3.47Å; T67-D70 PolarHBondContact O-N 3.43Å; L68-D70 VanDerWaalsContact C-N 3.27Å
71K85Confident84.5Confident108 Ų10868 Ų6847%0.4737%0.373SS..  trans-11030.3-178.7-64.1-57.8177.1-1710112.4I66 L69 D73 L74I66-K71 PolarHBondContact O-N 3.42Å; L69-K71 HydrophobicContact CB-CB 4.42Å; L69-K71 HydrophobicContact CB-CG 3.84Å; L69-K71 WeakPolarHBondContact O-CG 3.4Å; L69-K71 PolarHBondContact O-N 3.26Å; K71-D73 PolarHBondContact O-N 2.86Å; K71-L74 HydrophobicContact CB-CD1 4.13Å; K71-L74 HydrophobicContact CB-CD2 4.45Å; K71-L74 HydrophobicContact CD-CD1 3.79Å; K71-L74 HydrophobicContact CD-CD2 4.3Å; K71-L74 WeakPolarHBondContact O-CB 3.04Å; K71-L74 PolarHBondContact O-N 3.46Å; K71-L74 VanDerWaalsContact O-N 3.14Å
72Q83.3Confident84Confident30 Ų3073.3 Ų73.314%0.1439%0.39CS..G310 helixtrans-62.9-34.4-175.3-56173.123.800111.5I66 L74 V75 G79 G80 W83I66-Q72 HydrophobicContact CG2-CG 4.4Å; Q72-L74 PolarHBondContact O-N 2.94Å; Q72-V75 PolarHBondContact O-N 2.86Å; Q72-G79 WeakPolarHBondContact O-CA 3.31Å; Q72-G80 PolarHBondContact O-N 3.42Å; Q72-W83 HydrophobicContact CB-CB 4.44Å; Q72-W83 HydrophobicContact CB-CD2 4.22Å; Q72-W83 HydrophobicContact CB-CG 4.06Å; Q72-W83 HydrophobicContact CG-CD2 4.23Å; Q72-W83 HydrophobicContact CG-CG 4.07Å
73D81.3Confident83.8Confident129 Ų12970.3 Ų70.369%0.6937%0.369SS*.G310 helixtrans-70.5-16178.8-62.8-37.5000114.4K71 V75 G80K71-D73 PolarHBondContact O-N 2.86Å; D73-V75 PolarHBondContact O-N 3.16Å; D73-G80 WeakPolarHBondContact OD1-CA 3.33Å
74L82.2Confident83.4Confident126 Ų12670.2 Ų70.266%0.6637%0.367SS*.G310 helixtrans-76.8-13.6179.2-83.671.3000112.5K71 Q72 P76K71-L74 HydrophobicContact CB-CD1 4.13Å; K71-L74 HydrophobicContact CB-CD2 4.45Å; K71-L74 HydrophobicContact CD-CD1 3.79Å; K71-L74 HydrophobicContact CD-CD2 4.3Å; K71-L74 WeakPolarHBondContact O-CB 3.04Å; K71-L74 PolarHBondContact O-N 3.46Å; K71-L74 VanDerWaalsContact O-N 3.14Å; Q72-L74 PolarHBondContact O-N 2.94Å; L74-P76 WeakPolarHBondContact O-CD 3.36Å
75V80.6Confident83.2Confident34 Ų3472.7 Ų72.721%0.20638%0.381CS..SBendtrans-83.3107.3179.6-173.60000108.7I66 Q72 D73 V77 L78 G79 W83I66-V75 HydrophobicContact CD1-CG2 3.79Å; I66-V75 HydrophobicContact CG2-CG2 4.08Å; Q72-V75 PolarHBondContact O-N 2.86Å; D73-V75 PolarHBondContact O-N 3.16Å; V75-V77 PolarHBondContact O-N 3.4Å; V75-L78 HydrophobicContact CG1-CB 3.89Å; V75-G79 WeakPolarHBondContact O-CA 3.43Å; V75-G79 PolarHBondContact O-N 2.61Å; V75-W83 HydrophobicContact CB-CZ3 4.39Å; V75-W83 HydrophobicContact CG2-CH2 4.46Å; V75-W83 HydrophobicContact CG2-CZ3 3.9Å
76P72.6Confident83.2Confident107 Ų10768.9 Ų68.970%0.69537%0.367SS*.THydrogen-bonded Turntrans-60.8139.7178.725.4-32.6000109.8L74 L78L74-P76 WeakPolarHBondContact O-CD 3.36Å; P76-L78 PolarHBondContact O-N 2.87Å
77V76.6Confident83.2Confident114 Ų11467.7 Ų67.769%0.69136%0.361SS*.THydrogen-bonded Turntrans71.5-34.4175.9-175.30000115.9V75 R82V75-V77 PolarHBondContact O-N 3.4Å; V77-R82 WeakPolarHBondContact O-CD 3.5Å
78L80Confident83.4Confident95 Ų9568.5 Ų68.550%0.49737%0.366SS..THydrogen-bonded Turntrans-109.2-10.8-174.2-63.1174.8000114.5V75 P76 R82 W83 S86V75-L78 HydrophobicContact CG1-CB 3.89Å; P76-L78 PolarHBondContact O-N 2.87Å; L78-R82 CarbonylContact O-C 3.51Å; L78-W83 WeakPolarHBondContact O-CA 3.37Å; L78-W83 PolarHBondContact O-N 3.24Å; L78-S86 PolarHBondContact O-OG 2.86Å
79G78.8Confident83.7Confident13 Ų1371.8 Ų71.813%0.13439%0.386CS..SBendtrans-81.2-175.5-179.200000115.5Q72 V75 D81 R82Q72-G79 WeakPolarHBondContact O-CA 3.31Å; V75-G79 WeakPolarHBondContact O-CA 3.43Å; V75-G79 PolarHBondContact O-N 2.61Å; G79-D81 PolarHBondContact O-N 3.05Å; G79-R82 PolarHBondContact O-N 3.49Å
80G82.3Confident84.1Confident19 Ų1967.8 Ų67.820%0.19636%0.364CS..G310 helixtrans54.6-129.5179.200000113.3Q72 D73 R82 W83Q72-G80 PolarHBondContact O-N 3.42Å; D73-G80 WeakPolarHBondContact OD1-CA 3.33Å; G80-R82 PolarHBondContact O-N 2.97Å; G80-W83 WeakPolarHBondContact O-CB 3.2Å; G80-W83 PolarHBondContact O-N 3.38Å
81D79.2Confident84.7Confident135 Ų13563.3 Ų63.372%0.72234%0.34SS*.G310 helixtrans-57.1-22-178.2-58-21.3000114.2G79G79-D81 PolarHBondContact O-N 3.05Å
82R84.6Confident85.1Confident153 Ų15362 Ų6258%0.57734%0.338SS*.G310 helixtrans-90.3-8.3179.9-58.8-178.7-166.9-177.52.8112.7V77 L78 G79 G80 L84 L85 S86V77-R82 WeakPolarHBondContact O-CD 3.5Å; L78-R82 CarbonylContact O-C 3.51Å; G79-R82 PolarHBondContact O-N 3.49Å; G80-R82 PolarHBondContact O-N 2.97Å; R82-L84 VanDerWaalsContact C-N 3.29Å; R82-L84 PolarHBondContact O-N 2.99Å; R82-L85 WeakPolarHBondContact O-CA 3.43Å; R82-L85 WeakPolarHBondContact O-CB 3.32Å; R82-L85 PolarHBondContact O-N 3.1Å; R82-S86 PolarHBondContact O-N 3.05Å; R82-S86 PolarHBondContact O-OG 3.45Å; R82-S86 VanDerWaalsContact O-OG 3.1Å
83W87.5Confident85.7Confident15 Ų1562.4 Ų62.46%0.05735%0.346CS..Hα-helixtrans-57.5-41.8-174.8-172.9-117.6000112.4A63 I66 T67 Q72 V75 L78 G80 L85 S86 N87A63-W83 HydrophobicContact CB-CH2 4.23Å; A63-W83 HydrophobicContact CB-CZ2 4.13Å; I66-W83 HydrophobicContact CB-CH2 3.92Å; I66-W83 HydrophobicContact CB-CZ2 4Å; I66-W83 HydrophobicContact CD1-CH2 4.03Å; I66-W83 HydrophobicContact CG2-CH2 3.61Å; I66-W83 HydrophobicContact CG2-CZ2 3.73Å; I66-W83 HydrophobicContact CG2-CZ3 4.24Å; T67-W83 WeakPolarHBondContact OG1-CZ2 3.21Å; T67-W83 PolarHBondContact OG1-NE1 3.35Å; Q72-W83 HydrophobicContact CB-CB 4.44Å; Q72-W83 HydrophobicContact CB-CD2 4.22Å; Q72-W83 HydrophobicContact CB-CG 4.06Å; Q72-W83 HydrophobicContact CG-CD2 4.23Å; Q72-W83 HydrophobicContact CG-CG 4.07Å; V75-W83 HydrophobicContact CB-CZ3 4.39Å; V75-W83 HydrophobicContact CG2-CH2 4.46Å; V75-W83 HydrophobicContact CG2-CZ3 3.9Å; L78-W83 WeakPolarHBondContact O-CA 3.37Å; L78-W83 PolarHBondContact O-N 3.24Å; G80-W83 WeakPolarHBondContact O-CB 3.2Å; G80-W83 PolarHBondContact O-N 3.38Å; W83-L85 PolarHBondContact O-N 2.91Å; W83-S86 WeakPolarHBondContact O-CB 3.19Å; W83-S86 PolarHBondContact O-N 2.89Å; W83-N87 VanDerWaalsContact CE2-ND2 3.31Å; W83-N87 PolarHBondContact NE1-ND2 3.45Å; W83-N87 PolarHBondContact O-N 3.48Å; W83-N87 PolarHBondContact O-ND2 2.87Å
84L83.9Confident86.4Confident11 Ų1156.3 Ų56.36%0.05831%0.313CS..Hα-helixtrans-63.4-40.8176.7-166.3155.6000111.8R82 N87 L88 V150 K154R82-L84 VanDerWaalsContact C-N 3.29Å; R82-L84 PolarHBondContact O-N 2.99Å; L84-N87 PolarHBondContact O-N 3.18Å; L84-L88 WeakPolarHBondContact O-CB 3.42Å; L84-L88 PolarHBondContact O-N 3.3Å; L84-V150 HydrophobicContact CD2-CG1 3.36Å; L84-V150 HydrophobicContact CG-CG1 3.85Å; L84-K154 HydrophobicContact CD2-CB 3.94Å; L84-K154 HydrophobicContact CD2-CD 4.27Å; L84-K154 HydrophobicContact CD2-CG 4.29Å
85L86.6Confident87Confident72 Ų7250.5 Ų50.538%0.37728%0.284SS..Hα-helixtrans-66.6-42174.7173.561.9000111.6R82 W83 N87 L88 V89R82-L85 WeakPolarHBondContact O-CA 3.43Å; R82-L85 WeakPolarHBondContact O-CB 3.32Å; R82-L85 PolarHBondContact O-N 3.1Å; W83-L85 PolarHBondContact O-N 2.91Å; L85-N87 VanDerWaalsContact C-N 3.32Å; L85-N87 PolarHBondContact O-N 2.79Å; L85-L88 WeakPolarHBondContact O-CB 3.48Å; L85-L88 PolarHBondContact O-N 2.68Å; L85-V89 HydrophobicContact CD1-CG2 3.89Å; L85-V89 HydrophobicContact CG-CG2 4.36Å; L85-V89 WeakPolarHBondContact O-CG2 3.31Å; L85-V89 PolarHBondContact O-N 3.4Å
86S89.8Confident87.7Confident24 Ų2453 Ų5317%0.16830%0.299CS..Hα-helixtrans-59.3-44.5177.1-58.80000111.1L78 R82 W83 V89 H90L78-S86 PolarHBondContact O-OG 2.86Å; R82-S86 PolarHBondContact O-N 3.05Å; R82-S86 PolarHBondContact O-OG 3.45Å; R82-S86 VanDerWaalsContact O-OG 3.1Å; W83-S86 WeakPolarHBondContact O-CB 3.19Å; W83-S86 PolarHBondContact O-N 2.89Å; S86-V89 PolarHBondContact O-N 3.06Å; S86-H90 VanDerWaalsContact O-CB 3.3Å; S86-H90 WeakPolarHBondContact O-CB 3.05Å; S86-H90 PolarHBondContact O-N 3.39Å
87N90.9Very high88.8Confident12 Ų1251 Ų516%0.06428%0.282CS..Hα-helixtrans-61.9-42.5174.5-83.7-91000112.1R23 W83 L84 L85 H90 D91R23-N87 PolarHBondContact NE-OD1 3.26Å; R23-N87 PolarHBondContact NH2-OD1 3.01Å; W83-N87 VanDerWaalsContact CE2-ND2 3.31Å; W83-N87 PolarHBondContact NE1-ND2 3.45Å; W83-N87 PolarHBondContact O-N 3.48Å; W83-N87 PolarHBondContact O-ND2 2.87Å; L84-N87 PolarHBondContact O-N 3.18Å; L85-N87 VanDerWaalsContact C-N 3.32Å; L85-N87 PolarHBondContact O-N 2.79Å; N87-H90 PolarHBondContact O-N 3.31Å; N87-D91 WeakPolarHBondContact O-CB 3.48Å; N87-D91 PolarHBondContact O-N 3.01Å
88L90.4Very high89.7Confident21 Ų2145.5 Ų45.511%0.1125%0.249CC..Hα-helixtrans-62.8-48.1177.3179.360.1000112.2L84 L85 H90 D91 I92 S147 V150 K154L84-L88 WeakPolarHBondContact O-CB 3.42Å; L84-L88 PolarHBondContact O-N 3.3Å; L85-L88 WeakPolarHBondContact O-CB 3.48Å; L85-L88 PolarHBondContact O-N 2.68Å; L88-H90 VanDerWaalsContact C-N 3.3Å; L88-H90 PolarHBondContact O-N 3.3Å; L88-D91 PolarHBondContact O-N 2.91Å; L88-I92 HydrophobicContact CD1-CD1 3.89Å; L88-I92 HydrophobicContact CD1-CG1 4.24Å; L88-I92 HydrophobicContact CG-CD1 3.92Å; L88-I92 VanDerWaalsContact O-CG1 3.31Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 3.44Å; L88-S147 WeakPolarHBondContact CD1-O 3.49Å; L88-V150 HydrophobicContact CB-CG1 3.83Å; L88-V150 HydrophobicContact CD1-CB 4.25Å; L88-V150 HydrophobicContact CD1-CG1 4.29Å; L88-K154 HydrophobicContact CD2-CD 4.3Å
89V93.7Very high90.4Very high85 Ų8546.2 Ų46.252%0.51525%0.252SS..Hα-helixtrans-62-42.4178.9171.20000110.4L85 S86 I92 A93L85-V89 HydrophobicContact CD1-CG2 3.89Å; L85-V89 HydrophobicContact CG-CG2 4.36Å; L85-V89 WeakPolarHBondContact O-CG2 3.31Å; L85-V89 PolarHBondContact O-N 3.4Å; S86-V89 PolarHBondContact O-N 3.06Å; V89-I92 PolarHBondContact O-N 3Å; V89-A93 VanDerWaalsContact O-CB 3.25Å; V89-A93 WeakPolarHBondContact O-CB 3.44Å; V89-A93 PolarHBondContact O-N 3.18Å
90H94.3Very high91.3Very high26 Ų2648.5 Ų48.512%0.1227%0.265CS..Hα-helixtrans-58-49.2173.917180.1000112F56 L59 T60 S86 N87 L88 I92 A93 A94 Y143F56-H90 AromaticContact CD1-CE1 3.54Å; F56-H90 AromaticContact CD1-ND1 3.82Å; L59-H90 WeakPolarHBondContact CB-CE1 3.33Å; T60-H90 PolarHBondContact OG1-NE2 2.98Å; S86-H90 VanDerWaalsContact O-CB 3.3Å; S86-H90 WeakPolarHBondContact O-CB 3.05Å; S86-H90 PolarHBondContact O-N 3.39Å; N87-H90 PolarHBondContact O-N 3.31Å; L88-H90 VanDerWaalsContact C-N 3.3Å; L88-H90 PolarHBondContact O-N 3.3Å; H90-I92 PolarHBondContact O-N 3.5Å; H90-A93 PolarHBondContact O-N 3.48Å; H90-A94 WeakPolarHBondContact O-CB 3.26Å; H90-A94 PolarHBondContact O-N 3.11Å; H90-Y143 AromaticContact NE2-CE1 3.87Å
91D94.2Very high91.9Very high0 Ų047.6 Ų47.60%026%0.256CS..Hα-helixtrans-65.6-38.4-178.6-70-23.7000112.4R23 N87 L88 A95 Y143 S146R23-D91 IonicContact CZ-OD1 3.41Å; R23-D91 IonicContact CZ-OD2 3.74Å; R23-D91 IonicContact NH1-OD1 2.68Å; R23-D91 PolarHBondContact NH1-OD1 3.1Å; R23-D91 IonicContact NH1-OD2 3.7Å; R23-D91 IonicContact NH2-OD1 3.24Å; R23-D91 PolarHBondContact NH2-OD1 3.02Å; R23-D91 IonicContact NH2-OD2 3.05Å; R23-D91 PolarHBondContact NH2-OD2 3.4Å; N87-D91 WeakPolarHBondContact O-CB 3.48Å; N87-D91 PolarHBondContact O-N 3.01Å; L88-D91 PolarHBondContact O-N 2.91Å; D91-A95 WeakPolarHBondContact O-CB 3.49Å; D91-A95 PolarHBondContact O-N 2.64Å; D91-Y143 HydrophobicContact CB-CD1 4.44Å; D91-Y143 WeakPolarHBondContact OD1-CD1 3.42Å; D91-S146 VanDerWaalsContact OD2-CB 3.26Å; D91-S146 WeakPolarHBondContact OD2-CB 3.41Å; D91-S146 PolarHBondContact OD2-OG 3.23Å
92I94.6Very high92.6Very high82 Ų8242.2 Ų42.242%0.42123%0.227SC..Hα-helixtrans-66.1-47.5174.5-68.2170.2000110.5L88 V89 H90 A94 A95 V96L88-I92 HydrophobicContact CD1-CD1 3.89Å; L88-I92 HydrophobicContact CD1-CG1 4.24Å; L88-I92 HydrophobicContact CG-CD1 3.92Å; L88-I92 VanDerWaalsContact O-CG1 3.31Å; L88-I92 WeakPolarHBondContact O-CG1 3.28Å; L88-I92 PolarHBondContact O-N 3.44Å; V89-I92 PolarHBondContact O-N 3Å; H90-I92 PolarHBondContact O-N 3.5Å; I92-A94 VanDerWaalsContact C-N 3.28Å; I92-A94 PolarHBondContact O-N 3.35Å; I92-A95 PolarHBondContact O-N 3.18Å; I92-V96 HydrophobicContact CG2-CG2 4.37Å; I92-V96 WeakPolarHBondContact O-CG2 3.46Å; I92-V96 PolarHBondContact O-N 3.27Å
93A96.3Very high93.1Very high38 Ų3836.8 Ų36.831%0.31422%0.218SC..Hα-helixtrans-60.6-41.2178.900000111.3F56 V89 H90 L97F56-A93 HydrophobicContact CE1-CB 4.08Å; F56-A93 HydrophobicContact CZ-CB 4.02Å; V89-A93 VanDerWaalsContact O-CB 3.25Å; V89-A93 WeakPolarHBondContact O-CB 3.44Å; V89-A93 PolarHBondContact O-N 3.18Å; H90-A93 PolarHBondContact O-N 3.48Å; A93-L97 WeakPolarHBondContact O-CB 3.3Å; A93-L97 PolarHBondContact O-N 3.25Å
94A95.1Very high93.4Very high0 Ų037.5 Ų37.50%022%0.224CC..Hα-helixtrans-59.7-55.1173.800000110.3F56 H90 I92 V96 L97 Y98 Y143F56-A94 HydrophobicContact CB-CB 4.42Å; F56-A94 HydrophobicContact CD1-CB 3.47Å; F56-A94 VanDerWaalsContact CD1-CB 3.47Å; F56-A94 HydrophobicContact CD2-CB 4.27Å; F56-A94 HydrophobicContact CE1-CB 3.7Å; F56-A94 HydrophobicContact CE2-CB 4.47Å; F56-A94 HydrophobicContact CG-CB 3.8Å; F56-A94 HydrophobicContact CZ-CB 4.21Å; H90-A94 WeakPolarHBondContact O-CB 3.26Å; H90-A94 PolarHBondContact O-N 3.11Å; I92-A94 VanDerWaalsContact C-N 3.28Å; I92-A94 PolarHBondContact O-N 3.35Å; A94-V96 VanDerWaalsContact C-N 3.3Å; A94-V96 PolarHBondContact O-N 3.34Å; A94-L97 PolarHBondContact O-N 3.36Å; A94-Y98 HydrophobicContact CB-CD2 4.48Å; A94-Y98 WeakPolarHBondContact O-CB 3.4Å; A94-Y98 VanDerWaalsContact O-CD2 3.26Å; A94-Y98 WeakPolarHBondContact O-CD2 3.43Å; A94-Y98 PolarHBondContact O-N 3.05Å; A94-Y143 HydrophobicContact CB-CD1 3.58Å; A94-Y143 HydrophobicContact CB-CD2 3.83Å; A94-Y143 HydrophobicContact CB-CE1 3.83Å; A94-Y143 HydrophobicContact CB-CE2 4.06Å; A94-Y143 HydrophobicContact CB-CG 3.6Å
95A94.1Very high93.8Very high5 Ų537 Ų374%0.04122%0.221CC..Hα-helixtrans-54.5-45.7-179.700000112.5D91 I92 Y98 L99 L144D91-A95 WeakPolarHBondContact O-CB 3.49Å; D91-A95 PolarHBondContact O-N 2.64Å; I92-A95 PolarHBondContact O-N 3.18Å; A95-Y98 PolarHBondContact O-N 3.22Å; A95-L99 WeakPolarHBondContact O-CG 3.4Å; A95-L99 PolarHBondContact O-N 2.97Å; A95-L144 HydrophobicContact CB-CD2 3.52Å; A95-L144 HydrophobicContact CB-CG 3.74Å
96V96.3Very high94.1Very high87 Ų8738.2 Ų38.253%0.52723%0.228SC..Hα-helixtrans-64-43.5179.7171.10000112I92 A94 L99 P100I92-V96 HydrophobicContact CG2-CG2 4.37Å; I92-V96 WeakPolarHBondContact O-CG2 3.46Å; I92-V96 PolarHBondContact O-N 3.27Å; A94-V96 VanDerWaalsContact C-N 3.3Å; A94-V96 PolarHBondContact O-N 3.34Å; V96-L99 PolarHBondContact O-N 3.17Å; V96-P100 WeakPolarHBondContact O-CD 3.28Å
97L96.5Very high94.3Very high63 Ų6343 Ų4333%0.3324%0.243SC..Hα-helixtrans-79.5-23.4-178.3-72.8175.6000113.4V52 F56 A93 A94 L99 P100V52-L97 HydrophobicContact CG1-CB 4.06Å; V52-L97 HydrophobicContact CG2-CB 4.27Å; F56-L97 HydrophobicContact CE2-CB 3.92Å; F56-L97 HydrophobicContact CE2-CD1 3.62Å; F56-L97 HydrophobicContact CE2-CG 4.37Å; F56-L97 HydrophobicContact CZ-CD1 3.79Å; A93-L97 WeakPolarHBondContact O-CB 3.3Å; A93-L97 PolarHBondContact O-N 3.25Å; A94-L97 PolarHBondContact O-N 3.36Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-P100 VanDerWaalsContact O-CD 3.31Å; L97-P100 WeakPolarHBondContact O-CD 3.12Å; L97-P100 WeakPolarHBondContact O-CG 3.3Å
98Y95.1Very high94.2Very high0 Ų043.9 Ų43.90%025%0.246CC..Hα-helixtrans-70.3-28171.6-94.2-95.3000112.6L33 V52 F56 A94 A95 A101 I102 A136 A139 A140 Y143L33-Y98 HydrophobicContact CD2-CD1 4.45Å; L33-Y98 HydrophobicContact CD2-CE1 3.53Å; V52-Y98 HydrophobicContact CG1-CD2 3.8Å; V52-Y98 HydrophobicContact CG1-CE2 3.97Å; V52-Y98 HydrophobicContact CG1-CG 4.3Å; F56-Y98 HydrophobicContact CB-CE2 4.15Å; F56-Y98 HydrophobicContact CD2-CE2 4.28Å; F56-Y98 HydrophobicContact CG-CE2 4.48Å; A94-Y98 HydrophobicContact CB-CD2 4.48Å; A94-Y98 WeakPolarHBondContact O-CB 3.4Å; A94-Y98 VanDerWaalsContact O-CD2 3.26Å; A94-Y98 WeakPolarHBondContact O-CD2 3.43Å; A94-Y98 PolarHBondContact O-N 3.05Å; A95-Y98 PolarHBondContact O-N 3.22Å; Y98-A101 WeakPolarHBondContact O-CB 3.28Å; Y98-A101 PolarHBondContact O-N 3.27Å; Y98-I102 VanDerWaalsContact O-CG1 3.24Å; Y98-I102 WeakPolarHBondContact O-CG1 3.29Å; Y98-I102 PolarHBondContact O-N 3.44Å; Y98-A136 HydrophobicContact CD1-CB 4.33Å; Y98-A139 HydrophobicContact CD1-CB 4.2Å; Y98-A139 HydrophobicContact CE1-CB 3.61Å; Y98-A140 HydrophobicContact CG-CB 4.49Å; Y98-Y143 HydrophobicContact CD2-CD2 4.37Å; Y98-Y143 HydrophobicContact CD2-CE2 4.44Å; Y98-Y143 HydrophobicContact CE2-CD2 4.19Å; Y98-Y143 AromaticContact CE2-CE2 3.83Å; Y98-Y143 HydrophobicContact CE2-CE2 3.83Å
99L95.2Very high94.1Very high109 Ų10943.5 Ų43.557%0.57124%0.244SC*.Hα-helixtrans-57.1-55.5176.6-70.5174.2000113.9A95 V96 L97 A101 I102 G103A95-L99 WeakPolarHBondContact O-CG 3.4Å; A95-L99 PolarHBondContact O-N 2.97Å; V96-L99 PolarHBondContact O-N 3.17Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L99-A101 VanDerWaalsContact C-N 3.26Å; L99-A101 PolarHBondContact O-N 3.36Å; L99-I102 PolarHBondContact O-N 2.85Å; L99-G103 PolarHBondContact O-N 3.37Å; L99-G103 VanDerWaalsContact O-N 3.07Å
100P96.1Very high93.9Very high62 Ų6241.4 Ų41.440%0.40324%0.24SC..Hα-helixtrans-65.4-31.3175.325.9-33.8000111.9F48 V96 L97 G103 V104F48-P100 HydrophobicContact CE1-CB 4.14Å; F48-P100 HydrophobicContact CE1-CG 4.06Å; F48-P100 HydrophobicContact CZ-CB 4.47Å; F48-P100 HydrophobicContact CZ-CG 4.01Å; V96-P100 WeakPolarHBondContact O-CD 3.28Å; L97-P100 VanDerWaalsContact O-CD 3.31Å; L97-P100 WeakPolarHBondContact O-CD 3.12Å; L97-P100 WeakPolarHBondContact O-CG 3.3Å; P100-G103 PolarHBondContact O-N 2.88Å; P100-V104 WeakPolarHBondContact O-CG2 3.16Å; P100-V104 PolarHBondContact O-N 2.71Å
101A95.1Very high93.5Very high0 Ų047.6 Ų47.60%026%0.263CS..Hα-helixtrans-63-43.4175.700000111.7F48 V49 Y98 L99 G103 V104 M105F48-A101 HydrophobicContact CE1-CB 4.25Å; V49-A101 HydrophobicContact CG1-CB 4.28Å; V49-A101 HydrophobicContact CG2-CB 4.22Å; Y98-A101 WeakPolarHBondContact O-CB 3.28Å; Y98-A101 PolarHBondContact O-N 3.27Å; L99-A101 VanDerWaalsContact C-N 3.26Å; L99-A101 PolarHBondContact O-N 3.36Å; A101-G103 VanDerWaalsContact C-N 3.35Å; A101-V104 PolarHBondContact O-N 3.37Å; A101-M105 WeakPolarHBondContact O-CG 3.47Å; A101-M105 PolarHBondContact O-N 2.85Å
102I95.1Very high93Very high22 Ų2250.5 Ų50.511%0.11327%0.274CS..Hα-helixtrans-59-46.8172-70161.6000110.2Y98 L99 V104 M105 I106 A136 A140Y98-I102 VanDerWaalsContact O-CG1 3.24Å; Y98-I102 WeakPolarHBondContact O-CG1 3.29Å; Y98-I102 PolarHBondContact O-N 3.44Å; L99-I102 PolarHBondContact O-N 2.85Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 2.95Å; I102-M105 PolarHBondContact O-N 3.29Å; I102-M105 VanDerWaalsContact O-N 3.1Å; I102-I106 HydrophobicContact CG2-CD1 3.57Å; I102-I106 HydrophobicContact CG2-CG1 4.17Å; I102-I106 WeakPolarHBondContact O-CG1 3.18Å; I102-I106 PolarHBondContact O-N 3.3Å; I102-A136 HydrophobicContact CG1-CB 3.73Å; I102-A140 HydrophobicContact CD1-CB 3.69Å
103G93.9Very high92.3Very high38 Ų3852.3 Ų52.339%0.39228%0.281SS..Hα-helixtrans-56.9-44.5177.600000112.8L99 P100 A101 M105 Y107L99-G103 PolarHBondContact O-N 3.37Å; L99-G103 VanDerWaalsContact O-N 3.07Å; P100-G103 PolarHBondContact O-N 2.88Å; A101-G103 VanDerWaalsContact C-N 3.35Å; G103-M105 PolarHBondContact O-N 3.43Å; G103-Y107 VanDerWaalsContact O-CB 3.3Å; G103-Y107 WeakPolarHBondContact O-CB 3.46Å; G103-Y107 PolarHBondContact O-N 2.94Å
104V94.3Very high91.4Very high30 Ų3057 Ų5718%0.18229%0.291CS..Hα-helixtrans-60.9-44.6174.5169.20000111.4S45 I46 V49 P100 A101 I102 Y107 K108S45-V104 WeakPolarHBondContact OG-CG1 3.39Å; I46-V104 HydrophobicContact CD1-CG1 4.37Å; V49-V104 HydrophobicContact CG2-CB 3.9Å; V49-V104 HydrophobicContact CG2-CG1 3.66Å; P100-V104 WeakPolarHBondContact O-CG2 3.16Å; P100-V104 PolarHBondContact O-N 2.71Å; A101-V104 PolarHBondContact O-N 3.37Å; I102-V104 VanDerWaalsContact C-N 3.32Å; I102-V104 PolarHBondContact O-N 2.95Å; V104-Y107 PolarHBondContact O-N 2.93Å; V104-K108 HydrophobicContact CG1-CG 4.47Å; V104-K108 WeakPolarHBondContact O-CB 3.39Å; V104-K108 WeakPolarHBondContact O-CG 3.15Å; V104-K108 PolarHBondContact O-N 3.49Å
105M92.9Very high90.6Very high0 Ų057.4 Ų57.40%029%0.294CS..Hα-helixtrans-65.4-45.7-179.8-69.5-53.7-56.100112I37 I46 V49 A101 I102 G103 Y107 K108 T109 Y129 A132 A133I37-M105 HydrophobicContact CD1-SD 4.26Å; I46-M105 HydrophobicContact CD1-SD 3.74Å; V49-M105 HydrophobicContact CB-SD 4.27Å; V49-M105 HydrophobicContact CG1-CG 3.89Å; V49-M105 HydrophobicContact CG1-SD 3.83Å; V49-M105 HydrophobicContact CG2-CG 4.11Å; V49-M105 HydrophobicContact CG2-SD 3.97Å; A101-M105 WeakPolarHBondContact O-CG 3.47Å; A101-M105 PolarHBondContact O-N 2.85Å; I102-M105 PolarHBondContact O-N 3.29Å; I102-M105 VanDerWaalsContact O-N 3.1Å; G103-M105 PolarHBondContact O-N 3.43Å; M105-Y107 PolarHBondContact O-N 2.92Å; M105-K108 PolarHBondContact O-N 2.81Å; M105-T109 WeakPolarHBondContact O-CB 3.49Å; M105-T109 PolarHBondContact O-N 3.35Å; M105-T109 PolarHBondContact O-OG1 2.91Å; M105-Y129 HydrophobicContact CE-CD1 3.71Å; M105-Y129 HydrophobicContact CE-CG 4.24Å; M105-Y129 WeakPolarHBondContact CE-O 3.18Å; M105-A132 HydrophobicContact CE-CB 3.28Å; M105-A132 HydrophobicContact SD-CB 4.47Å; M105-A133 HydrophobicContact CB-CB 3.89Å
106I92.6Very high89.7Confident99 Ų9961.1 Ų61.151%0.50831%0.313SS..Hα-helixtrans-61.1-46.1176.7-67.5172.2000110.5I102 K108 T109 G110I102-I106 HydrophobicContact CG2-CD1 3.57Å; I102-I106 HydrophobicContact CG2-CG1 4.17Å; I102-I106 WeakPolarHBondContact O-CG1 3.18Å; I102-I106 PolarHBondContact O-N 3.3Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 3.12Å; I106-T109 PolarHBondContact O-N 3.35Å; I106-G110 PolarHBondContact O-N 2.93Å
107Y92.9Very high88.8Confident125 Ų12562.8 Ų62.849%0.4932%0.318SS..Hα-helixtrans-59.2-44.7177.4175.1-100.8000112G103 V104 M105 G110 R111G103-Y107 VanDerWaalsContact O-CB 3.3Å; G103-Y107 WeakPolarHBondContact O-CB 3.46Å; G103-Y107 PolarHBondContact O-N 2.94Å; V104-Y107 PolarHBondContact O-N 2.93Å; M105-Y107 PolarHBondContact O-N 2.92Å; Y107-G110 PolarHBondContact O-N 3.21Å; Y107-R111 HydrophobicContact CE1-CG 4.24Å; Y107-R111 PolarHBondContact O-N 3.3Å; Y107-R111 PolarHBondContact OH-NH1 2.91Å; Y107-R111 VanDerWaalsContact OH-NH1 3.11Å; Y107-R111 PolarHBondContact OH-NH2 3.4Å
108K89.3Confident87.4Confident29 Ų2969.4 Ų69.413%0.12635%0.348CS..Hα-helixtrans-64.8-44.2176.2-76.4-82.9-167.4167.10110.8S45 I46 V104 M105 I106 G110 R111 Y112 Y129S45-K108 WeakPolarHBondContact OG-CE 3.38Å; I46-K108 HydrophobicContact CD1-CB 4.34Å; I46-K108 HydrophobicContact CD1-CD 4.32Å; I46-K108 HydrophobicContact CD1-CG 3.84Å; V104-K108 HydrophobicContact CG1-CG 4.47Å; V104-K108 WeakPolarHBondContact O-CB 3.39Å; V104-K108 WeakPolarHBondContact O-CG 3.15Å; V104-K108 PolarHBondContact O-N 3.49Å; M105-K108 PolarHBondContact O-N 2.81Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 3.12Å; K108-G110 VanDerWaalsContact C-N 3.34Å; K108-G110 PolarHBondContact O-N 3.36Å; K108-R111 WeakPolarHBondContact O-CB 3.49Å; K108-R111 PolarHBondContact O-N 3.38Å; K108-R111 VanDerWaalsContact O-N 3.12Å; K108-Y112 HydrophobicContact CD-CE2 4.24Å; K108-Y112 VanDerWaalsContact O-CD2 3.28Å; K108-Y112 WeakPolarHBondContact O-CD2 3.44Å; K108-Y112 PolarHBondContact O-N 3.16Å; K108-Y112 VanDerWaalsContact O-N 3.13Å; K108-Y129 HydrophobicContact CB-CD2 4.26Å; K108-Y129 HydrophobicContact CB-CG 4.38Å
109T89.6Confident86.3Confident13 Ų1378.3 Ų78.38%0.0839%0.389CS..Hα-helixtrans-54.9-48.3175.9-60.40000111.6M105 I106 R111 Y112 E113 Y126 Y129 L130M105-T109 WeakPolarHBondContact O-CB 3.49Å; M105-T109 PolarHBondContact O-N 3.35Å; M105-T109 PolarHBondContact O-OG1 2.91Å; I106-T109 PolarHBondContact O-N 3.35Å; T109-R111 PolarHBondContact O-N 3.48Å; T109-Y112 PolarHBondContact O-N 3.06Å; T109-E113 PolarHBondContact O-N 3.4Å; T109-Y126 HydrophobicContact CG2-CD2 3.84Å; T109-Y126 HydrophobicContact CG2-CE2 3.54Å; T109-Y126 WeakPolarHBondContact O-CD2 3.33Å; T109-Y129 WeakPolarHBondContact OG1-CB 3.09Å; T109-Y129 PolarHBondContact OG1-O 3.07Å; T109-L130 HydrophobicContact CG2-CB 4.04Å; T109-L130 HydrophobicContact CG2-CD1 4.16Å; T109-L130 PolarHBondContact OG1-N 2.99Å
110G88.1Confident84.9Confident42 Ų4277.8 Ų77.843%0.43338%0.38SS..Hα-helixtrans-63.1-38.8176.500000113.2I106 Y107 K108 Y112 E113I106-G110 PolarHBondContact O-N 2.93Å; Y107-G110 PolarHBondContact O-N 3.21Å; K108-G110 VanDerWaalsContact C-N 3.34Å; K108-G110 PolarHBondContact O-N 3.36Å; G110-Y112 PolarHBondContact O-N 3.29Å; G110-E113 VanDerWaalsContact O-CB 3.31Å; G110-E113 WeakPolarHBondContact O-CB 3.48Å; G110-E113 PolarHBondContact O-N 3.09Å
111R86.9Confident83.4Confident155 Ų15584.2 Ų84.259%0.58540%0.402SS*.Hα-helixtrans-61.2-28.6175.5-102.4-110.4176.397.7-2.7113.8Y107 K108 T109 Y114Y107-R111 HydrophobicContact CE1-CG 4.24Å; Y107-R111 PolarHBondContact O-N 3.3Å; Y107-R111 PolarHBondContact OH-NH1 2.91Å; Y107-R111 VanDerWaalsContact OH-NH1 3.11Å; Y107-R111 PolarHBondContact OH-NH2 3.4Å; K108-R111 WeakPolarHBondContact O-CB 3.49Å; K108-R111 PolarHBondContact O-N 3.38Å; K108-R111 VanDerWaalsContact O-N 3.12Å; T109-R111 PolarHBondContact O-N 3.48Å; R111-Y114 VanDerWaalsContact O-CD1 3.23Å; R111-Y114 WeakPolarHBondContact O-CD1 3.24Å; R111-Y114 WeakPolarHBondContact O-CE1 3.33Å
112Y82.9Confident82.4Confident61 Ų6190.9 Ų90.924%0.23943%0.433CS..THydrogen-bonded Turntrans-1037.7179.8-73-90.2000113.2K108 T109 G110 Y114 C115 L125 Y129K108-Y112 HydrophobicContact CD-CE2 4.24Å; K108-Y112 VanDerWaalsContact O-CD2 3.28Å; K108-Y112 WeakPolarHBondContact O-CD2 3.44Å; K108-Y112 PolarHBondContact O-N 3.16Å; K108-Y112 VanDerWaalsContact O-N 3.13Å; T109-Y112 PolarHBondContact O-N 3.06Å; G110-Y112 PolarHBondContact O-N 3.29Å; Y112-Y114 HydrophobicContact CD1-CE1 4.22Å; Y112-Y114 PolarHBondContact O-N 3.3Å; Y112-Y114 VanDerWaalsContact O-N 3.15Å; Y112-C115 PolarHBondContact O-N 2.93Å; Y112-C115 VanDerWaalsContact O-N 3.1Å; Y112-C115 PolarHBondContact O-SG 2.89Å; Y112-L125 HydrophobicContact CD1-CB 4.37Å; Y112-L125 HydrophobicContact CE1-CD1 4.19Å; Y112-Y129 AromaticContact CD2-CD2 3.77Å; Y112-Y129 HydrophobicContact CD2-CD2 3.77Å; Y112-Y129 AromaticContact CD2-CE2 3.5Å; Y112-Y129 HydrophobicContact CD2-CE2 3.5Å; Y112-Y129 VanDerWaalsContact CD2-CE2 3.5Å; Y112-Y129 HydrophobicContact CE2-CD2 4.27Å; Y112-Y129 AromaticContact CE2-CE2 3.54Å; Y112-Y129 HydrophobicContact CE2-CE2 3.54Å; Y112-Y129 HydrophobicContact CG-CD2 4.26Å; Y112-Y129 HydrophobicContact CG-CE2 4.1Å
113E81.1Confident81.3Confident121 Ų12197.1 Ų97.157%0.56546%0.461SS*.G310 helixtrans-57.8-30.6-179.5-172.5176.8179.800112.8T109 G110 C115 N116 Y126T109-E113 PolarHBondContact O-N 3.4Å; G110-E113 VanDerWaalsContact O-CB 3.31Å; G110-E113 WeakPolarHBondContact O-CB 3.48Å; G110-E113 PolarHBondContact O-N 3.09Å; E113-C115 PolarHBondContact O-N 2.88Å; E113-C115 VanDerWaalsContact O-N 3.07Å; E113-N116 VanDerWaalsContact O-CB 3.29Å; E113-N116 WeakPolarHBondContact O-CB 3.43Å; E113-N116 PolarHBondContact O-N 3.45Å; E113-Y126 HydrophobicContact CB-CD2 4.38Å; E113-Y126 HydrophobicContact CB-CE2 4.27Å; E113-Y126 HydrophobicContact CG-CE2 4.29Å
114Y77.1Confident80.6Confident136 Ų13696.7 Ų96.753%0.53345%0.452SS..G310 helixtrans-56.7-25.8177.570.3-93.6000113.8R111 Y112 N116 L117R111-Y114 VanDerWaalsContact O-CD1 3.23Å; R111-Y114 WeakPolarHBondContact O-CD1 3.24Å; R111-Y114 WeakPolarHBondContact O-CE1 3.33Å; Y112-Y114 HydrophobicContact CD1-CE1 4.22Å; Y112-Y114 PolarHBondContact O-N 3.3Å; Y112-Y114 VanDerWaalsContact O-N 3.15Å; Y114-N116 VanDerWaalsContact C-N 3.3Å; Y114-L117 WeakPolarHBondContact O-CD1 3.38Å
115C76.9Confident80Confident8 Ų896.8 Ų96.85%0.05445%0.451CS..G310 helixtrans-85.2-0.4179.272.50000113.9Y112 E113 L117 Y120 C124Y112-C115 PolarHBondContact O-N 2.93Å; Y112-C115 VanDerWaalsContact O-N 3.1Å; Y112-C115 PolarHBondContact O-SG 2.89Å; E113-C115 PolarHBondContact O-N 2.88Å; E113-C115 VanDerWaalsContact O-N 3.07Å; C115-L117 VanDerWaalsContact C-N 3.32Å; C115-Y120 HydrophobicContact CB-CD1 3.69Å; C115-Y120 HydrophobicContact CB-CE1 3.66Å; C115-Y120 HydrophobicContact CB-CG 4.24Å; C115-C124 HydrophobicContact CB-CB 3.73Å; C115-C124 WeakPolarHBondContact CB-SG 3.33Å; C115-C124 PolarHBondContact O-SG 2.99Å; C115-C124 VanDerWaalsContact SG-CA 3.58Å; C115-C124 WeakPolarHBondContact SG-CB 3.39Å; C115-C124 CovalentContact SG-SG 2.03Å; C115-C124 PolarHBondContact SG-SG 2.91Å
116N75.9Confident79.7Confident83 Ų8398.8 Ų98.844%0.44446%0.459SS..G310 helixtrans-86.52176.4-165.448.6000113.6E113 Y114 Y126E113-N116 VanDerWaalsContact O-CB 3.29Å; E113-N116 WeakPolarHBondContact O-CB 3.43Å; E113-N116 PolarHBondContact O-N 3.45Å; Y114-N116 VanDerWaalsContact C-N 3.3Å; N116-Y126 HydrophobicContact CB-CD1 3.86Å; N116-Y126 HydrophobicContact CB-CE1 4.09Å; N116-Y126 HydrophobicContact CB-CG 4.19Å
117L77.7Confident79.4Confident122 Ų122101 Ų10164%0.63947%0.465SS*.SBendtrans-69.5138.2175.3-70164.4000110.8Y114 C115 Q119 Y120Y114-L117 WeakPolarHBondContact O-CD1 3.38Å; C115-L117 VanDerWaalsContact C-N 3.32Å; L117-Q119 PolarHBondContact O-N 2.88Å; L117-Y120 WeakPolarHBondContact O-CB 3.34Å; L117-Y120 PolarHBondContact O-N 3.32Å
118E66.4Low79.2Confident203 Ų20396 Ų9695%0.94945%0.448SS*.THydrogen-bonded Turntrans-57.1-24.1-178.2-69-172.8157.700113.9
119Q71.7Confident79.3Confident186 Ų18695.1 Ų95.187%0.86944%0.444SS*.THydrogen-bonded Turntrans-81.9-10.6178.5-72.5176.1-1700113.8L117 K121L117-Q119 PolarHBondContact O-N 2.88Å; Q119-K121 PolarHBondContact O-N 2.94Å
120Y66.1Low79.4Confident98 Ų9897.9 Ų97.938%0.38446%0.458SS..  trans-86.9109.6-177.6-162.8-95.7000111.3C115 L117 H122C115-Y120 HydrophobicContact CB-CD1 3.69Å; C115-Y120 HydrophobicContact CB-CE1 3.66Å; C115-Y120 HydrophobicContact CB-CG 4.24Å; L117-Y120 WeakPolarHBondContact O-CB 3.34Å; L117-Y120 PolarHBondContact O-N 3.32Å; Y120-H122 HydrophobicContact CD1-CB 4.37Å; Y120-H122 HydrophobicContact CE1-CB 3.66Å; Y120-H122 WeakPolarHBondContact CE1-O 3.33Å
121K64.9Low79.6Confident198 Ų19897.7 Ų97.786%0.86145%0.452SS*.  trans-95.1-5.6-174.3-68.9-175.2177.1-178.70115.2Q119Q119-K121 PolarHBondContact O-N 2.94Å
122H73.2Confident79.9Confident140 Ų14090.3 Ų90.365%0.64842%0.424SS*.SBendtrans-88.7160.3-177.9-62.6-69.7000112.4Y120 C124Y120-H122 HydrophobicContact CD1-CB 4.37Å; Y120-H122 HydrophobicContact CE1-CB 3.66Å; Y120-H122 WeakPolarHBondContact CE1-O 3.33Å; H122-C124 PolarHBondContact O-N 3.43Å
123H72.3Confident80.5Confident152 Ų15287.8 Ų87.870%0.70442%0.416SS*.  trans-54.7123178.5-16980.2000110.7
124C78.9Confident81.2Confident29 Ų2985.7 Ų85.720%0.19641%0.411CS..  trans-117.7120.9-170171.50000110.4C115 H122 Y126C115-C124 HydrophobicContact CB-CB 3.73Å; C115-C124 WeakPolarHBondContact CB-SG 3.33Å; C115-C124 PolarHBondContact O-SG 2.99Å; C115-C124 VanDerWaalsContact SG-CA 3.58Å; C115-C124 WeakPolarHBondContact SG-CB 3.39Å; C115-C124 CovalentContact SG-SG 2.03Å; C115-C124 PolarHBondContact SG-SG 2.91Å; H122-C124 PolarHBondContact O-N 3.43Å; C124-Y126 PolarHBondContact O-N 3.19Å; C124-Y126 WeakPolarHBondContact SG-CB 3.24Å
125L83.2Confident82.1Confident33 Ų3382.2 Ų82.217%0.17340%0.399CS..THydrogen-bonded Turntrans-78.1-8.3-178.4-64.3171000113.1N40 Y112 K127 V128 Y129N40-L125 HydrophobicContact CB-CD2 4.29Å; Y112-L125 HydrophobicContact CD1-CB 4.37Å; Y112-L125 HydrophobicContact CE1-CD1 4.19Å; L125-K127 PolarHBondContact O-N 2.9Å; L125-V128 WeakPolarHBondContact O-CB 3.35Å; L125-V128 PolarHBondContact O-N 2.93Å; L125-V128 VanDerWaalsContact O-N 3.16Å; L125-Y129 HydrophobicContact CB-CD2 3.92Å; L125-Y129 HydrophobicContact CB-CE2 3.53Å; L125-Y129 HydrophobicContact CD1-CE2 4.13Å; L125-Y129 HydrophobicContact CG-CE2 4.41Å; L125-Y129 WeakPolarHBondContact O-CD2 3.33Å; L125-Y129 PolarHBondContact O-N 3.32Å
126Y85.8Confident83Confident41 Ų4181.8 Ų81.816%0.16140%0.396CS..Hα-helixtrans-52.6-52.1177.7174.4-101.3000112T109 E113 N116 C124 V128 Y129 L130T109-Y126 HydrophobicContact CG2-CD2 3.84Å; T109-Y126 HydrophobicContact CG2-CE2 3.54Å; T109-Y126 WeakPolarHBondContact O-CD2 3.33Å; E113-Y126 HydrophobicContact CB-CD2 4.38Å; E113-Y126 HydrophobicContact CB-CE2 4.27Å; E113-Y126 HydrophobicContact CG-CE2 4.29Å; N116-Y126 HydrophobicContact CB-CD1 3.86Å; N116-Y126 HydrophobicContact CB-CE1 4.09Å; N116-Y126 HydrophobicContact CB-CG 4.19Å; C124-Y126 PolarHBondContact O-N 3.19Å; C124-Y126 WeakPolarHBondContact SG-CB 3.24Å; Y126-V128 VanDerWaalsContact C-N 3.26Å; Y126-V128 PolarHBondContact O-N 3.38Å; Y126-Y129 PolarHBondContact O-N 3.23Å; Y126-L130 HydrophobicContact CE1-CD2 4.05Å; Y126-L130 VanDerWaalsContact O-CB 3.25Å; Y126-L130 WeakPolarHBondContact O-CB 3.46Å; Y126-L130 PolarHBondContact O-N 3.1Å
127K86.6Confident83.9Confident146 Ų14680.2 Ų80.264%0.63539%0.391SS*.Hα-helixtrans-63.8-34.3-178.6-67.1-173.4178.21800112.1L125 A131L125-K127 PolarHBondContact O-N 2.9Å; K127-A131 VanDerWaalsContact O-CB 3.3Å; K127-A131 WeakPolarHBondContact O-CB 3.3Å; K127-A131 PolarHBondContact O-N 2.83Å
128V89.3Confident84.8Confident21 Ų2177.8 Ų77.813%0.12738%0.378CS..Hα-helixtrans-67.6-50.4177178.80000110.4T36 N40 L125 Y126 L130 A131 A132T36-V128 HydrophobicContact CG2-CG1 3.78Å; N40-V128 HydrophobicContact CB-CG1 4.16Å; N40-V128 VanDerWaalsContact ND2-CG1 3.33Å; N40-V128 WeakPolarHBondContact ND2-CG1 3.31Å; L125-V128 WeakPolarHBondContact O-CB 3.35Å; L125-V128 PolarHBondContact O-N 2.93Å; L125-V128 VanDerWaalsContact O-N 3.16Å; Y126-V128 VanDerWaalsContact C-N 3.26Å; Y126-V128 PolarHBondContact O-N 3.38Å; V128-L130 VanDerWaalsContact C-N 3.33Å; V128-L130 PolarHBondContact O-N 3.47Å; V128-A131 PolarHBondContact O-N 3.39Å; V128-A132 WeakPolarHBondContact O-CB 3.23Å; V128-A132 PolarHBondContact O-N 3.44Å
129Y90.6Very high86.2Confident9 Ų968.1 Ų68.14%0.03533%0.333CS..Hα-helixtrans-68.2-33.7179.8-64.2-39.7000112.5I46 M105 K108 T109 Y112 L125 Y126 A133I46-Y129 HydrophobicContact CD1-CD1 4.28Å; I46-Y129 HydrophobicContact CD1-CE1 3.88Å; I46-Y129 HydrophobicContact CG1-CE1 4.15Å; M105-Y129 HydrophobicContact CE-CD1 3.71Å; M105-Y129 HydrophobicContact CE-CG 4.24Å; M105-Y129 WeakPolarHBondContact CE-O 3.18Å; K108-Y129 HydrophobicContact CB-CD2 4.26Å; K108-Y129 HydrophobicContact CB-CG 4.38Å; T109-Y129 WeakPolarHBondContact OG1-CB 3.09Å; T109-Y129 PolarHBondContact OG1-O 3.07Å; Y112-Y129 AromaticContact CD2-CD2 3.77Å; Y112-Y129 HydrophobicContact CD2-CD2 3.77Å; Y112-Y129 AromaticContact CD2-CE2 3.5Å; Y112-Y129 HydrophobicContact CD2-CE2 3.5Å; Y112-Y129 VanDerWaalsContact CD2-CE2 3.5Å; Y112-Y129 HydrophobicContact CE2-CD2 4.27Å; Y112-Y129 AromaticContact CE2-CE2 3.54Å; Y112-Y129 HydrophobicContact CE2-CE2 3.54Å; Y112-Y129 HydrophobicContact CG-CD2 4.26Å; Y112-Y129 HydrophobicContact CG-CE2 4.1Å; L125-Y129 HydrophobicContact CB-CD2 3.92Å; L125-Y129 HydrophobicContact CB-CE2 3.53Å; L125-Y129 HydrophobicContact CD1-CE2 4.13Å; L125-Y129 HydrophobicContact CG-CE2 4.41Å; L125-Y129 WeakPolarHBondContact O-CD2 3.33Å; L125-Y129 PolarHBondContact O-N 3.32Å; Y126-Y129 PolarHBondContact O-N 3.23Å; Y129-A133 VanDerWaalsContact O-CB 3.31Å; Y129-A133 WeakPolarHBondContact O-CB 3.37Å; Y129-A133 PolarHBondContact O-N 3.32Å
130L91.5Very high87.3Confident72 Ų7259.5 Ų59.538%0.37729%0.294SS..Hα-helixtrans-63.7-49.5172.2-178.765000111.2T109 Y126 V128 A132 A133 V134T109-L130 HydrophobicContact CG2-CB 4.04Å; T109-L130 HydrophobicContact CG2-CD1 4.16Å; T109-L130 PolarHBondContact OG1-N 2.99Å; Y126-L130 HydrophobicContact CE1-CD2 4.05Å; Y126-L130 VanDerWaalsContact O-CB 3.25Å; Y126-L130 WeakPolarHBondContact O-CB 3.46Å; Y126-L130 PolarHBondContact O-N 3.1Å; V128-L130 VanDerWaalsContact C-N 3.33Å; V128-L130 PolarHBondContact O-N 3.47Å; L130-A132 VanDerWaalsContact C-N 3.35Å; L130-A132 PolarHBondContact O-N 2.94Å; L130-A133 WeakPolarHBondContact O-CB 3.12Å; L130-A133 PolarHBondContact O-N 2.96Å; L130-V134 WeakPolarHBondContact O-CG2 3.19Å; L130-V134 PolarHBondContact O-N 3.33Å
131A93Very high88.8Confident37 Ų3758.9 Ų58.931%0.30630%0.3SS..Hα-helixtrans-60.5-44.9177.400000111.6T36 K127 V128 A133 V134 F135T36-A131 HydrophobicContact CG2-CB 4.3Å; K127-A131 VanDerWaalsContact O-CB 3.3Å; K127-A131 WeakPolarHBondContact O-CB 3.3Å; K127-A131 PolarHBondContact O-N 2.83Å; V128-A131 PolarHBondContact O-N 3.39Å; A131-A133 PolarHBondContact O-N 2.88Å; A131-V134 WeakPolarHBondContact O-CB 3.33Å; A131-V134 PolarHBondContact O-N 3.42Å; A131-F135 WeakPolarHBondContact O-CD2 3.3Å; A131-F135 PolarHBondContact O-N 3.41Å
132A93.4Very high90.2Very high0 Ų050.1 Ų50.10%026%0.263CS..Hα-helixtrans-64.2-36.9175.400000112.3L33 T36 I37 M105 V128 L130 V134 F135 A136L33-A132 HydrophobicContact CD1-CB 3.74Å; L33-A132 VanDerWaalsContact CD1-O 3.23Å; L33-A132 WeakPolarHBondContact CD1-O 3.36Å; T36-A132 HydrophobicContact CG2-CB 4.1Å; I37-A132 HydrophobicContact CD1-CB 4.34Å; I37-A132 HydrophobicContact CG1-CB 3.97Å; M105-A132 HydrophobicContact CE-CB 3.28Å; M105-A132 HydrophobicContact SD-CB 4.47Å; V128-A132 WeakPolarHBondContact O-CB 3.23Å; V128-A132 PolarHBondContact O-N 3.44Å; L130-A132 VanDerWaalsContact C-N 3.35Å; L130-A132 PolarHBondContact O-N 2.94Å; A132-V134 VanDerWaalsContact C-N 3.35Å; A132-V134 PolarHBondContact O-N 2.93Å; A132-F135 PolarHBondContact O-N 2.93Å; A132-A136 VanDerWaalsContact O-CB 3.3Å; A132-A136 WeakPolarHBondContact O-CB 3.43Å; A132-A136 PolarHBondContact O-N 3.48Å
133A94.8Very high91.2Very high8 Ų843.5 Ų43.57%0.06623%0.232CC..Hα-helixtrans-61.3-43.4172.100000111.7M105 Y129 L130 A131 A136 C137M105-A133 HydrophobicContact CB-CB 3.89Å; Y129-A133 VanDerWaalsContact O-CB 3.31Å; Y129-A133 WeakPolarHBondContact O-CB 3.37Å; Y129-A133 PolarHBondContact O-N 3.32Å; L130-A133 WeakPolarHBondContact O-CB 3.12Å; L130-A133 PolarHBondContact O-N 2.96Å; A131-A133 PolarHBondContact O-N 2.88Å; A133-A136 PolarHBondContact O-N 3.49Å; A133-C137 PolarHBondContact O-N 3.42Å; A133-C137 PolarHBondContact O-SG 3.25Å
134V96Very high92.2Very high77 Ų7740.1 Ų40.147%0.46722%0.219SC..Hα-helixtrans-61.6-48.6176.3172.30000111.1L130 A131 A132 A136 C137 L138L130-V134 WeakPolarHBondContact O-CG2 3.19Å; L130-V134 PolarHBondContact O-N 3.33Å; A131-V134 WeakPolarHBondContact O-CB 3.33Å; A131-V134 PolarHBondContact O-N 3.42Å; A132-V134 VanDerWaalsContact C-N 3.35Å; A132-V134 PolarHBondContact O-N 2.93Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.88Å; V134-C137 PolarHBondContact O-N 2.92Å; V134-L138 HydrophobicContact CG1-CD1 3.97Å; V134-L138 HydrophobicContact CG1-CG 4.4Å; V134-L138 WeakPolarHBondContact O-CG 3.18Å; V134-L138 PolarHBondContact O-N 2.94Å
135F96Very high92.9Very high63 Ų6341.9 Ų41.928%0.27623%0.228SC..Hα-helixtrans-61.9-39.1176.8-76-61000112.6F29 L33 A131 A132 L138 A139F29-F135 HydrophobicContact CD1-CD1 4.14Å; F29-F135 HydrophobicContact CD1-CE1 4.4Å; L33-F135 HydrophobicContact CB-CB 3.88Å; A131-F135 WeakPolarHBondContact O-CD2 3.3Å; A131-F135 PolarHBondContact O-N 3.41Å; A132-F135 PolarHBondContact O-N 2.93Å; F135-L138 PolarHBondContact O-N 3.02Å; F135-A139 VanDerWaalsContact O-CB 3.28Å; F135-A139 WeakPolarHBondContact O-CB 3.28Å; F135-A139 PolarHBondContact O-N 3.27Å
136A94.8Very high93.3Very high0 Ų040.3 Ų40.30%022%0.22CC..Hα-helixtrans-63.2-42.8175.900000111.9L33 Y98 I102 A132 A133 V134 A140L33-A136 HydrophobicContact CD1-CB 4.16Å; L33-A136 HydrophobicContact CD2-CB 3.93Å; Y98-A136 HydrophobicContact CD1-CB 4.33Å; I102-A136 HydrophobicContact CG1-CB 3.73Å; A132-A136 VanDerWaalsContact O-CB 3.3Å; A132-A136 WeakPolarHBondContact O-CB 3.43Å; A132-A136 PolarHBondContact O-N 3.48Å; A133-A136 PolarHBondContact O-N 3.49Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 2.88Å; A136-A140 WeakPolarHBondContact O-CB 3.46Å; A136-A140 PolarHBondContact O-N 3.21Å
137C96.3Very high93.6Very high50 Ų5039 Ų3934%0.33822%0.218SC..Hα-helixtrans-63.3-47174.8-71.30000112.1A133 V134 A139 A140 V141A133-C137 PolarHBondContact O-N 3.42Å; A133-C137 PolarHBondContact O-SG 3.25Å; V134-C137 PolarHBondContact O-N 2.92Å; C137-A139 PolarHBondContact O-N 2.63Å; C137-A140 PolarHBondContact O-N 3.11Å; C137-V141 WeakPolarHBondContact O-CG2 3.33Å; C137-V141 PolarHBondContact O-N 3.23Å
138L96.6Very high93.8Very high71 Ų7136.5 Ų36.537%0.37221%0.214SC..Hα-helixtrans-61.2-45.2177.9-70.5173000111.5F29 V134 F135 V141 V142F29-L138 HydrophobicContact CB-CB 4.5Å; F29-L138 HydrophobicContact CD1-CB 4.18Å; F29-L138 HydrophobicContact CD1-CD1 4.12Å; F29-L138 HydrophobicContact CD2-CB 3.94Å; F29-L138 HydrophobicContact CE1-CB 4.38Å; F29-L138 HydrophobicContact CE1-CD1 3.89Å; F29-L138 HydrophobicContact CE2-CB 4.14Å; F29-L138 HydrophobicContact CG-CB 3.96Å; F29-L138 HydrophobicContact CZ-CB 4.36Å; F29-L138 HydrophobicContact CZ-CD1 4.28Å; V134-L138 HydrophobicContact CG1-CD1 3.97Å; V134-L138 HydrophobicContact CG1-CG 4.4Å; V134-L138 WeakPolarHBondContact O-CG 3.18Å; V134-L138 PolarHBondContact O-N 2.94Å; F135-L138 PolarHBondContact O-N 3.02Å; L138-V141 PolarHBondContact O-N 2.83Å; L138-V142 WeakPolarHBondContact O-CG2 3.31Å; L138-V142 PolarHBondContact O-N 3.12Å
139A94.9Very high93.7Very high0 Ų039.5 Ų39.50%022%0.224CC..Hα-helixtrans-59.4-47.8175.600000111.3F29 Y98 F135 C137 V141 V142 Y143F29-A139 HydrophobicContact CB-CB 4.07Å; Y98-A139 HydrophobicContact CD1-CB 4.2Å; Y98-A139 HydrophobicContact CE1-CB 3.61Å; F135-A139 VanDerWaalsContact O-CB 3.28Å; F135-A139 WeakPolarHBondContact O-CB 3.28Å; F135-A139 PolarHBondContact O-N 3.27Å; C137-A139 PolarHBondContact O-N 2.63Å; A139-V141 PolarHBondContact O-N 3.13Å; A139-V142 PolarHBondContact O-N 2.83Å; A139-Y143 WeakPolarHBondContact O-CD2 3.45Å; A139-Y143 PolarHBondContact O-N 3.38Å
140A95.4Very high93.5Very high5 Ų539.2 Ų39.24%0.04122%0.223CC..Hα-helixtrans-59.8-45178.700000112.4Y98 I102 A136 C137 V142 Y143 L144Y98-A140 HydrophobicContact CG-CB 4.49Å; I102-A140 HydrophobicContact CD1-CB 3.69Å; A136-A140 WeakPolarHBondContact O-CB 3.46Å; A136-A140 PolarHBondContact O-N 3.21Å; C137-A140 PolarHBondContact O-N 3.11Å; A140-V142 VanDerWaalsContact C-N 3.32Å; A140-V142 PolarHBondContact O-N 2.96Å; A140-Y143 PolarHBondContact O-N 3.5Å; A140-L144 WeakPolarHBondContact O-CB 3.46Å; A140-L144 VanDerWaalsContact O-CG 3.3Å; A140-L144 WeakPolarHBondContact O-CG 3.3Å; A140-L144 PolarHBondContact O-N 3.03Å
141V96.3Very high93.2Very high84 Ų8436.6 Ų36.651%0.50921%0.213SC..Hα-helixtrans-60.1-44176.5169.30000110.7C137 L138 A139 L144 V145C137-V141 WeakPolarHBondContact O-CG2 3.33Å; C137-V141 PolarHBondContact O-N 3.23Å; L138-V141 PolarHBondContact O-N 2.83Å; A139-V141 PolarHBondContact O-N 3.13Å; V141-L144 PolarHBondContact O-N 3.47Å; V141-V145 HydrophobicContact CG1-CG2 4.32Å; V141-V145 VanDerWaalsContact O-CG2 3.31Å; V141-V145 WeakPolarHBondContact O-CG2 3.38Å; V141-V145 PolarHBondContact O-N 3.49Å
142V95.8Very high92.8Very high15 Ų1538 Ų389%0.09122%0.22CC..Hα-helixtrans-68.8-39.5-178.7-179.80000111.2I22 L25 Q26 F29 L138 A139 A140 V145 S146I22-V142 HydrophobicContact CD1-CG1 4.47Å; I22-V142 HydrophobicContact CG2-CG1 3.94Å; L25-V142 HydrophobicContact CB-CG1 4Å; L25-V142 HydrophobicContact CB-CG2 4.42Å; Q26-V142 HydrophobicContact CG-CB 4.25Å; Q26-V142 HydrophobicContact CG-CG1 3.52Å; F29-V142 HydrophobicContact CD2-CG2 3.84Å; F29-V142 HydrophobicContact CE2-CG2 3.71Å; L138-V142 WeakPolarHBondContact O-CG2 3.31Å; L138-V142 PolarHBondContact O-N 3.12Å; A139-V142 PolarHBondContact O-N 2.83Å; A140-V142 VanDerWaalsContact C-N 3.32Å; A140-V142 PolarHBondContact O-N 2.96Å; V142-V145 PolarHBondContact O-N 2.98Å; V142-S146 WeakPolarHBondContact O-CB 3.18Å; V142-S146 PolarHBondContact O-N 2.91Å
143Y93.6Very high92.2Very high0 Ų039.1 Ų39.10%022%0.224CC..Hα-helixtrans-62.2-41.8171.5-78.9-64.6000111.9Q26 F56 T60 H90 D91 A94 Y98 A139 A140 S146 S147Q26-Y143 HydrophobicContact CB-CE1 4.19Å; Q26-Y143 HydrophobicContact CB-CE2 4.44Å; Q26-Y143 VanDerWaalsContact CD-CE1 3.4Å; Q26-Y143 HydrophobicContact CG-CD1 4.05Å; Q26-Y143 HydrophobicContact CG-CE1 3.86Å; Q26-Y143 HydrophobicContact CG-CE2 4.38Å; Q26-Y143 HydrophobicContact CG-CG 4.38Å; F56-Y143 PolarHBondContact O-OH 3.01Å; T60-Y143 PolarHBondContact OG1-OH 3.3Å; H90-Y143 AromaticContact NE2-CE1 3.87Å; D91-Y143 HydrophobicContact CB-CD1 4.44Å; D91-Y143 WeakPolarHBondContact OD1-CD1 3.42Å; A94-Y143 HydrophobicContact CB-CD1 3.58Å; A94-Y143 HydrophobicContact CB-CD2 3.83Å; A94-Y143 HydrophobicContact CB-CE1 3.83Å; A94-Y143 HydrophobicContact CB-CE2 4.06Å; A94-Y143 HydrophobicContact CB-CG 3.6Å; Y98-Y143 HydrophobicContact CD2-CD2 4.37Å; Y98-Y143 HydrophobicContact CD2-CE2 4.44Å; Y98-Y143 HydrophobicContact CE2-CD2 4.19Å; Y98-Y143 AromaticContact CE2-CE2 3.83Å; Y98-Y143 HydrophobicContact CE2-CE2 3.83Å; A139-Y143 WeakPolarHBondContact O-CD2 3.45Å; A139-Y143 PolarHBondContact O-N 3.38Å; A140-Y143 PolarHBondContact O-N 3.5Å; Y143-S146 WeakPolarHBondContact O-CB 3.33Å; Y143-S146 PolarHBondContact O-N 3.42Å; Y143-S147 WeakPolarHBondContact O-CB 3.45Å; Y143-S147 PolarHBondContact O-N 3.27Å
144L93.5Very high91.5Very high82 Ų8243 Ų4343%0.42924%0.24SC..Hα-helixtrans-62.2-49.4175.6-77.2170.3000111.9A95 A140 V141 S146 S147 V148A95-L144 HydrophobicContact CB-CD2 3.52Å; A95-L144 HydrophobicContact CB-CG 3.74Å; A140-L144 WeakPolarHBondContact O-CB 3.46Å; A140-L144 VanDerWaalsContact O-CG 3.3Å; A140-L144 WeakPolarHBondContact O-CG 3.3Å; A140-L144 PolarHBondContact O-N 3.03Å; V141-L144 PolarHBondContact O-N 3.47Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.3Å; L144-S147 PolarHBondContact O-N 2.82Å; L144-S147 VanDerWaalsContact O-N 3.16Å; L144-S147 PolarHBondContact O-OG 3.21Å; L144-V148 WeakPolarHBondContact O-CG2 3.38Å; L144-V148 PolarHBondContact O-N 3.19Å
145V93.8Very high90.7Very high65 Ų6545 Ų4539%0.39426%0.256SS..Hα-helixtrans-58.9-42.8177.1172.90000110.7F18 I22 V141 V142 V148 Y149F18-V145 HydrophobicContact CZ-CG1 4.29Å; I22-V145 HydrophobicContact CD1-CB 4.38Å; I22-V145 HydrophobicContact CD1-CG1 3.76Å; V141-V145 HydrophobicContact CG1-CG2 4.32Å; V141-V145 VanDerWaalsContact O-CG2 3.31Å; V141-V145 WeakPolarHBondContact O-CG2 3.38Å; V141-V145 PolarHBondContact O-N 3.49Å; V142-V145 PolarHBondContact O-N 2.98Å; V145-V148 PolarHBondContact O-N 3.47Å; V145-Y149 VanDerWaalsContact O-CB 3.3Å; V145-Y149 WeakPolarHBondContact O-CB 3.5Å; V145-Y149 PolarHBondContact O-N 2.85Å
146S92.1Very high90Very high0 Ų051.4 Ų51.40%028%0.278CS..Hα-helixtrans-58.3-49.7174.4-164.60000111.4D91 V142 Y143 L144 V148 Y149 V150D91-S146 VanDerWaalsContact OD2-CB 3.26Å; D91-S146 WeakPolarHBondContact OD2-CB 3.41Å; D91-S146 PolarHBondContact OD2-OG 3.23Å; V142-S146 WeakPolarHBondContact O-CB 3.18Å; V142-S146 PolarHBondContact O-N 2.91Å; Y143-S146 WeakPolarHBondContact O-CB 3.33Å; Y143-S146 PolarHBondContact O-N 3.42Å; L144-S146 VanDerWaalsContact C-N 3.29Å; L144-S146 PolarHBondContact O-N 3.3Å; S146-V148 PolarHBondContact O-N 3.37Å; S146-Y149 PolarHBondContact O-N 2.84Å; S146-V150 WeakPolarHBondContact O-CB 3.23Å; S146-V150 VanDerWaalsContact O-CG2 3.29Å; S146-V150 WeakPolarHBondContact O-CG2 3.31Å; S146-V150 PolarHBondContact O-N 3.48Å
147S90.4Very high88.9Confident15 Ų1554.2 Ų54.211%0.10531%0.307CS..Hα-helixtrans-61.4-41.7-179.471.90000112.8L88 Y143 L144 G151L88-S147 WeakPolarHBondContact CD1-O 3.49Å; Y143-S147 WeakPolarHBondContact O-CB 3.45Å; Y143-S147 PolarHBondContact O-N 3.27Å; L144-S147 PolarHBondContact O-N 2.82Å; L144-S147 VanDerWaalsContact O-N 3.16Å; L144-S147 PolarHBondContact O-OG 3.21Å; S147-G151 WeakPolarHBondContact O-CA 3.25Å; S147-G151 PolarHBondContact O-N 2.97Å
148V91Very high87.7Confident93 Ų9355.6 Ų55.656%0.56431%0.308SS*.Hα-helixtrans-66.6-44.8177.2172.90000110.2L144 V145 S146 G151 C152L144-V148 WeakPolarHBondContact O-CG2 3.38Å; L144-V148 PolarHBondContact O-N 3.19Å; V145-V148 PolarHBondContact O-N 3.47Å; S146-V148 PolarHBondContact O-N 3.37Å; V148-G151 PolarHBondContact O-N 2.89Å; V148-C152 WeakPolarHBondContact O-CB 3.12Å; V148-C152 PolarHBondContact O-N 2.97Å; V148-C152 PolarHBondContact O-SG 3.33Å
149Y88.1Confident86Confident83 Ų8358.9 Ų58.933%0.32532%0.322SS..Hα-helixtrans-63.6-49.2-180179.3-96.3000112.1F18 L19 V145 S146 G151 C152 R153F18-Y149 AromaticContact CD1-CD1 3.88Å; F18-Y149 HydrophobicContact CD1-CD1 3.88Å; F18-Y149 AromaticContact CD1-CD2 3.88Å; F18-Y149 HydrophobicContact CD1-CD2 3.88Å; F18-Y149 AromaticContact CD1-CE1 3.78Å; F18-Y149 HydrophobicContact CD1-CE1 3.78Å; F18-Y149 AromaticContact CD1-CE2 3.8Å; F18-Y149 HydrophobicContact CD1-CE2 3.8Å; F18-Y149 AromaticContact CD1-CG 3.91Å; F18-Y149 HydrophobicContact CD1-CG 3.91Å; F18-Y149 AromaticContact CD1-CZ 3.74Å; F18-Y149 HydrophobicContact CE1-CD1 4.07Å; F18-Y149 AromaticContact CE1-CD2 3.7Å; F18-Y149 HydrophobicContact CE1-CD2 3.7Å; F18-Y149 HydrophobicContact CE1-CE1 4.4Å; F18-Y149 HydrophobicContact CE1-CE2 4.08Å; F18-Y149 AromaticContact CE1-CG 3.69Å; F18-Y149 HydrophobicContact CE1-CG 3.69Å; L19-Y149 HydrophobicContact CD1-CE1 4.13Å; L19-Y149 HydrophobicContact CD2-CD1 3.62Å; L19-Y149 HydrophobicContact CD2-CE1 3.88Å; L19-Y149 HydrophobicContact CG-CD1 4.06Å; L19-Y149 HydrophobicContact CG-CE1 3.75Å; V145-Y149 VanDerWaalsContact O-CB 3.3Å; V145-Y149 WeakPolarHBondContact O-CB 3.5Å; V145-Y149 PolarHBondContact O-N 2.85Å; S146-Y149 PolarHBondContact O-N 2.84Å; Y149-G151 VanDerWaalsContact C-N 3.34Å; Y149-G151 PolarHBondContact O-N 3.16Å; Y149-C152 PolarHBondContact O-N 3.3Å; Y149-R153 VanDerWaalsContact CE1-CD 3.43Å; Y149-R153 HydrophobicContact CE1-CG 4.13Å; Y149-R153 PolarHBondContact O-N 3.46Å
150V85.6Confident84.3Confident4 Ų463 Ų632%0.02435%0.347CS..Hα-helixtrans-64.8-39.8177.7177.10000110.8L19 L84 L88 S146 R153 K154L19-V150 HydrophobicContact CD1-CG2 4.38Å; L19-V150 HydrophobicContact CD2-CG2 3.78Å; L84-V150 HydrophobicContact CD2-CG1 3.36Å; L84-V150 HydrophobicContact CG-CG1 3.85Å; L88-V150 HydrophobicContact CB-CG1 3.83Å; L88-V150 HydrophobicContact CD1-CB 4.25Å; L88-V150 HydrophobicContact CD1-CG1 4.29Å; S146-V150 WeakPolarHBondContact O-CB 3.23Å; S146-V150 VanDerWaalsContact O-CG2 3.29Å; S146-V150 WeakPolarHBondContact O-CG2 3.31Å; S146-V150 PolarHBondContact O-N 3.48Å; V150-R153 PolarHBondContact O-N 3.4Å; V150-K154 WeakPolarHBondContact O-CB 3.45Å; V150-K154 PolarHBondContact O-N 3.19Å
151G85.1Confident82.5Confident17 Ų1763.4 Ų63.418%0.17535%0.349CS..Hα-helixtrans-59.7-47173.500000112.4S147 V148 Y149 R153 K154 C155S147-G151 WeakPolarHBondContact O-CA 3.25Å; S147-G151 PolarHBondContact O-N 2.97Å; V148-G151 PolarHBondContact O-N 2.89Å; Y149-G151 VanDerWaalsContact C-N 3.34Å; Y149-G151 PolarHBondContact O-N 3.16Å; G151-R153 PolarHBondContact O-N 3.39Å; G151-K154 PolarHBondContact O-N 2.91Å; G151-C155 PolarHBondContact O-N 3.44Å; G151-C155 PolarHBondContact O-SG 3.34Å
152C85.5Confident80.6Confident67 Ų6764 Ų6445%0.45335%0.353SS..Hα-helixtrans-60.7-44.1175.8-76.60000112.5V148 Y149 K154 C155 R156V148-C152 WeakPolarHBondContact O-CB 3.12Å; V148-C152 PolarHBondContact O-N 2.97Å; V148-C152 PolarHBondContact O-SG 3.33Å; Y149-C152 PolarHBondContact O-N 3.3Å; C152-K154 VanDerWaalsContact C-N 3.34Å; C152-C155 PolarHBondContact O-N 3.21Å; C152-R156 WeakPolarHBondContact O-CG 3.49Å; C152-R156 PolarHBondContact O-N 3.15Å; C152-R156 VanDerWaalsContact O-N 3.15Å
153R81.3Confident79.8Confident22 Ų2266.5 Ų66.58%0.08337%0.366CS..Hα-helixtrans-61.3-43.2175.1-74.5-169.772.9178.56111.7Y149 V150 G151 C155 R156 G157 E158 T160 V161Y149-R153 VanDerWaalsContact CE1-CD 3.43Å; Y149-R153 HydrophobicContact CE1-CG 4.13Å; Y149-R153 PolarHBondContact O-N 3.46Å; V150-R153 PolarHBondContact O-N 3.4Å; G151-R153 PolarHBondContact O-N 3.39Å; R153-C155 PolarHBondContact O-N 3.17Å; R153-R156 CarbonylContact O-C 3.57Å; R153-R156 WeakPolarHBondContact O-CA 3.29Å; R153-R156 WeakPolarHBondContact O-CB 3.06Å; R153-R156 PolarHBondContact O-N 3.1Å; R153-G157 PolarHBondContact O-N 3.2Å; R153-E158 HydrophobicContact CB-CB 4.42Å; R153-E158 IonicContact CZ-OE2 3.2Å; R153-E158 IonicContact NE-OE2 2.68Å; R153-E158 PolarHBondContact NE-OE2 3.07Å; R153-E158 IonicContact NH2-OE2 2.88Å; R153-E158 PolarHBondContact NH2-OE2 2.96Å; R153-E158 PolarHBondContact O-N 3.2Å; R153-T160 PolarHBondContact NH1-O 2.92Å; R153-T160 VanDerWaalsContact NH1-O 3.09Å; R153-T160 PolarHBondContact NH2-O 3.01Å; R153-V161 PolarHBondContact NH1-O 3.24Å
154K79.3Confident79.1Confident90 Ų9069.9 Ų69.939%0.39139%0.385SS..Hα-helixtrans-62.5-41.3176.9-167.5173.8-1761790112.2L84 L88 V150 G151 C152 R156 G157L84-K154 HydrophobicContact CD2-CB 3.94Å; L84-K154 HydrophobicContact CD2-CD 4.27Å; L84-K154 HydrophobicContact CD2-CG 4.29Å; L88-K154 HydrophobicContact CD2-CD 4.3Å; V150-K154 WeakPolarHBondContact O-CB 3.45Å; V150-K154 PolarHBondContact O-N 3.19Å; G151-K154 PolarHBondContact O-N 2.91Å; C152-K154 VanDerWaalsContact C-N 3.34Å; K154-R156 PolarHBondContact O-N 3.09Å; K154-G157 PolarHBondContact O-N 2.03Å
155C79.6Confident78.3Confident119 Ų11969.3 Ų69.380%0.80438%0.383SS*.Hα-helixtrans-63.4-25.2174.2-68.30000113G151 C152 R153 G157G151-C155 PolarHBondContact O-N 3.44Å; G151-C155 PolarHBondContact O-SG 3.34Å; C152-C155 PolarHBondContact O-N 3.21Å; R153-C155 PolarHBondContact O-N 3.17Å; C155-G157 VanDerWaalsContact C-N 3.33Å
156R81.8Confident77.4Confident198 Ų19869.5 Ų69.575%0.74738%0.382SS*.THydrogen-bonded Turntrans-84.9-2.6174.1-68.9177.3-178.3-174.20.1113.8C152 R153 K154C152-R156 WeakPolarHBondContact O-CG 3.49Å; C152-R156 PolarHBondContact O-N 3.15Å; C152-R156 VanDerWaalsContact O-N 3.15Å; R153-R156 CarbonylContact O-C 3.57Å; R153-R156 WeakPolarHBondContact O-CA 3.29Å; R153-R156 WeakPolarHBondContact O-CB 3.06Å; R153-R156 PolarHBondContact O-N 3.1Å; K154-R156 PolarHBondContact O-N 3.09Å
157G70.4Confident76.4Confident58 Ų5873.9 Ų73.960%0.59841%0.406SS*.THydrogen-bonded Turntrans80.911.6179.100000114.8R153 K154 C155R153-G157 PolarHBondContact O-N 3.2Å; K154-G157 PolarHBondContact O-N 2.03Å; C155-G157 VanDerWaalsContact C-N 3.33Å
158E71Confident75.5Confident79 Ų7977.8 Ų77.837%0.36943%0.426SS..  trans-76.9132.5175.8-64.5177.3-159.900110.4R153R153-E158 HydrophobicContact CB-CB 4.42Å; R153-E158 IonicContact CZ-OE2 3.2Å; R153-E158 IonicContact NE-OE2 2.68Å; R153-E158 PolarHBondContact NE-OE2 3.07Å; R153-E158 IonicContact NH2-OE2 2.88Å; R153-E158 PolarHBondContact NH2-OE2 2.96Å; R153-E158 PolarHBondContact O-N 3.2Å
159Q61.8Low74.4Confident140 Ų14076.7 Ų76.765%0.65442%0.416SS*.  trans-106.8-14-175.9-70.4-175.8-22.700114.1
160T59.2Low73.4Confident87 Ų8776.2 Ų76.253%0.53442%0.423SS..  trans-98.7146.7-174.558.30000112.3R153 V162R153-T160 PolarHBondContact NH1-O 2.92Å; R153-T160 VanDerWaalsContact NH1-O 3.09Å; R153-T160 PolarHBondContact NH2-O 3.01Å; T160-V162 WeakPolarHBondContact CB-O 3.43Å; T160-V162 PolarHBondContact OG1-O 3.46Å
161V57.1Low72.3Confident13 Ų1382.3 Ų82.38%0.07946%0.456CS..  trans-80.6-24.3175.3-174.70000111.3F14 L19 T67 R153F14-V161 HydrophobicContact CE2-CG1 4.27Å; L19-V161 HydrophobicContact CB-CG1 4.4Å; L19-V161 HydrophobicContact CD1-CG1 3.67Å; T67-V161 HydrophobicContact CG2-CB 4.43Å; T67-V161 HydrophobicContact CG2-CG1 3.98Å; R153-V161 PolarHBondContact NH1-O 3.24Å
162V56.3Low71.2Confident97 Ų9788.2 Ų88.259%0.58848%0.482SS*.  trans-90.50169.3-173.10000110.1T160T160-V162 WeakPolarHBondContact CB-O 3.43Å; T160-V162 PolarHBondContact OG1-O 3.46Å

Retrieved 162 of 162 residues in 134.3 ms (Link to these results)

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