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Golgi transport 1B

May be involved in fusion of ER-derived transport vesicles with the Golgi complex.

AlphaFold DB , UniProt , Accession A0A060XQ56, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110490186, Length 138 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
1M38.5Very low69.1Low234 Ų23491.9 Ų91.9100%1.15350%0.496SS*.  01090-62.6179.5178.400107.1S3M1-S3 PolarHBondContact O-N 3.29Å
2I42.8Very low70.3Confident124 Ų12489.8 Ų89.864%0.63648%0.482SS*.  trans-78.5101.1179.9-63.3170.9000106.5L4I2-L4 PolarHBondContact O-N 2.97Å
3S50.5Low71.7Confident109 Ų10985.4 Ų85.476%0.76247%0.471SS*.  trans-65.8115174.6-79.30000109.4M1 T5M1-S3 PolarHBondContact O-N 3.29Å; S3-T5 PolarHBondContact O-N 3.32Å
4L62.4Low73.1Confident43 Ų4382.1 Ų82.123%0.22545%0.452CS..  trans-64.6128163.6-67.8171.8000108.2I2 K9 M12I2-L4 PolarHBondContact O-N 2.97Å; L4-K9 HydrophobicContact CB-CG 4.41Å; L4-M12 HydrophobicContact CD1-CE 3.93Å
5T75.9Confident74.2Confident84 Ų8478.4 Ų78.452%0.51543%0.433SS..  trans-63.7146.5175.7-29.40000109.4S3 S7 Q8 K9S3-T5 PolarHBondContact O-N 3.32Å; T5-S7 PolarHBondContact O-N 3.34Å; T5-S7 VanDerWaalsContact O-N 3.14Å; T5-Q8 WeakPolarHBondContact O-CA 3.37Å; T5-Q8 WeakPolarHBondContact O-CB 3.07Å; T5-Q8 PolarHBondContact O-N 3.04Å; T5-K9 PolarHBondContact O-N 3.47Å
6D79.9Confident75.2Confident109 Ų10976.3 Ų76.358%0.58343%0.434SS*.Hα-helixtrans-57.8-32.3-179.2-62.5-56.7000112.6Q8 K9 I10D6-Q8 VanDerWaalsContact C-N 3.31Å; D6-Q8 PolarHBondContact O-N 3.32Å; D6-K9 PolarHBondContact O-N 3.38Å; D6-K9 IonicContact OD1-NZ 2.74Å; D6-I10 WeakPolarHBondContact O-CG1 3.46Å; D6-I10 PolarHBondContact O-N 3.46Å
7S76.6Confident76.1Confident57 Ų5779.2 Ų79.240%0.39944%0.441SS..Hα-helixtrans-58.7-37.8170.6-49.60000113.4T5 G11T5-S7 PolarHBondContact O-N 3.34Å; T5-S7 VanDerWaalsContact O-N 3.14Å; S7-G11 PolarHBondContact O-N 3.06Å
8Q79.3Confident77.1Confident36 Ų3674.8 Ų74.817%0.16842%0.417CS..Hα-helixtrans-72-35.8178.8-63.9-178.3-47.300111.4T5 D6 G11 M12 V49T5-Q8 WeakPolarHBondContact O-CA 3.37Å; T5-Q8 WeakPolarHBondContact O-CB 3.07Å; T5-Q8 PolarHBondContact O-N 3.04Å; D6-Q8 VanDerWaalsContact C-N 3.31Å; D6-Q8 PolarHBondContact O-N 3.32Å; Q8-G11 PolarHBondContact O-N 2.8Å; Q8-M12 VanDerWaalsContact O-CG 3.3Å; Q8-M12 WeakPolarHBondContact O-CG 3.31Å; Q8-M12 PolarHBondContact O-N 3.49Å; Q8-V49 PolarHBondContact NE2-O 3.12Å
9K81.8Confident77.8Confident113 Ų11374.9 Ų74.949%0.49142%0.419SS..Hα-helixtrans-64.2-46.1174-66.3176.6-175165.60111.3L4 T5 D6 G11 M12 G13L4-K9 HydrophobicContact CB-CG 4.41Å; T5-K9 PolarHBondContact O-N 3.47Å; D6-K9 PolarHBondContact O-N 3.38Å; D6-K9 IonicContact OD1-NZ 2.74Å; K9-G11 VanDerWaalsContact C-N 3.32Å; K9-M12 HydrophobicContact CB-CE 4.48Å; K9-M12 HydrophobicContact CG-CE 4.27Å; K9-M12 PolarHBondContact O-N 3.09Å; K9-G13 PolarHBondContact O-N 3.31Å; K9-G13 VanDerWaalsContact O-N 3.12Å
10I86.3Confident78.5Confident102 Ų10276.8 Ų76.852%0.52342%0.423SS..Hα-helixtrans-60.8-44.9174.7-67.6164.6000110.2D6 M12 G13 L14D6-I10 WeakPolarHBondContact O-CG1 3.46Å; D6-I10 PolarHBondContact O-N 3.46Å; I10-M12 PolarHBondContact O-N 3.06Å; I10-G13 PolarHBondContact O-N 3.37Å; I10-L14 HydrophobicContact CG2-CD1 3.64Å; I10-L14 PolarHBondContact O-N 2.85Å
11G86.2Confident79.2Confident0 Ų076.1 Ų76.10%042%0.416CS..Hα-helixtrans-58.6-44.5176.600000113.1S7 Q8 K9 G13 L14 T15 G45 F48S7-G11 PolarHBondContact O-N 3.06Å; Q8-G11 PolarHBondContact O-N 2.8Å; K9-G11 VanDerWaalsContact C-N 3.32Å; G11-G13 VanDerWaalsContact C-N 3.31Å; G11-G13 PolarHBondContact O-N 2.9Å; G11-L14 PolarHBondContact O-N 3.32Å; G11-T15 PolarHBondContact O-N 2.79Å; G11-T15 PolarHBondContact O-OG1 3.41Å; G11-G45 WeakPolarHBondContact O-CA 3.38Å; G11-F48 VanDerWaalsContact CA-CB 3.45Å
12M83.3Confident81.8Confident66 Ų6666.4 Ų66.433%0.32537%0.368SS..Hα-helixtrans-61.3-41.2176.2-74.1-174.7-63.900111.7L4 Q8 K9 I10 G16 V49 I112L4-M12 HydrophobicContact CD1-CE 3.93Å; Q8-M12 VanDerWaalsContact O-CG 3.3Å; Q8-M12 WeakPolarHBondContact O-CG 3.31Å; Q8-M12 PolarHBondContact O-N 3.49Å; K9-M12 HydrophobicContact CB-CE 4.48Å; K9-M12 HydrophobicContact CG-CE 4.27Å; K9-M12 PolarHBondContact O-N 3.09Å; I10-M12 PolarHBondContact O-N 3.06Å; M12-G16 PolarHBondContact O-N 3Å; M12-V49 HydrophobicContact CG-CG2 3.99Å; M12-I112 HydrophobicContact SD-CD1 3.47Å; M12-I112 WeakPolarHBondContact SD-CD1 3.41Å; M12-I112 HydrophobicContact SD-CG1 4.11Å
13G88.3Confident84.1Confident33 Ų3366.1 Ų66.134%0.3436%0.363SS..Hα-helixtrans-60.7-50.3173.800000112.1K9 I10 G11 T15 G16 F17K9-G13 PolarHBondContact O-N 3.31Å; K9-G13 VanDerWaalsContact O-N 3.12Å; I10-G13 PolarHBondContact O-N 3.37Å; G11-G13 VanDerWaalsContact C-N 3.31Å; G11-G13 PolarHBondContact O-N 2.9Å; G13-T15 PolarHBondContact O-N 3.41Å; G13-G16 PolarHBondContact O-N 3.32Å; G13-F17 WeakPolarHBondContact O-CD2 3.41Å; G13-F17 PolarHBondContact O-N 3.21Å
14L91.8Very high86.1Confident40 Ų4065 Ų6521%0.20934%0.344CS..Hα-helixtrans-59.3-45.3177.9-82.8153.5000112.7I10 G11 G16 F17 G18 L41 G45 F48I10-L14 HydrophobicContact CG2-CD1 3.64Å; I10-L14 PolarHBondContact O-N 2.85Å; G11-L14 PolarHBondContact O-N 3.32Å; L14-G16 VanDerWaalsContact C-N 3.34Å; L14-G16 PolarHBondContact O-N 3.21Å; L14-F17 PolarHBondContact O-N 2.94Å; L14-G18 PolarHBondContact O-N 3.47Å; L14-L41 HydrophobicContact CD2-CD2 3.59Å; L14-G45 VanDerWaalsContact CB-CA 3.45Å; L14-F48 HydrophobicContact CD1-CD2 3.81Å; L14-F48 HydrophobicContact CD1-CE2 4.23Å
15T88.9Confident87.5Confident26 Ų2663 Ų6316%0.1633%0.334CS..Hα-helixtrans-62.5-42.6176.4-62.70000111G11 G13 G18 V19 F42 G45 L46G11-T15 PolarHBondContact O-N 2.79Å; G11-T15 PolarHBondContact O-OG1 3.41Å; G13-T15 PolarHBondContact O-N 3.41Å; T15-G18 PolarHBondContact O-N 3.26Å; T15-V19 WeakPolarHBondContact O-CG2 3.14Å; T15-V19 PolarHBondContact O-N 2.94Å; T15-F42 HydrophobicContact CG2-CD2 3.84Å; T15-F42 HydrophobicContact CG2-CE2 3.75Å; T15-G45 VanDerWaalsContact OG1-CA 3.31Å; T15-G45 WeakPolarHBondContact OG1-CA 3.4Å; T15-L46 HydrophobicContact CG2-CD2 4.5Å; T15-L46 PolarHBondContact OG1-N 3.17Å
16G90.1Very high88.2Confident44 Ų4462.3 Ų62.345%0.45433%0.326SS..Hα-helixtrans-61.6-47176.200000112.7M12 G13 L14 G18 V19 F20M12-G16 PolarHBondContact O-N 3Å; G13-G16 PolarHBondContact O-N 3.32Å; L14-G16 VanDerWaalsContact C-N 3.34Å; L14-G16 PolarHBondContact O-N 3.21Å; G16-G18 VanDerWaalsContact C-N 3.34Å; G16-G18 PolarHBondContact O-N 3.42Å; G16-V19 PolarHBondContact O-N 2.85Å; G16-F20 WeakPolarHBondContact O-CB 3.43Å; G16-F20 PolarHBondContact O-N 3.19Å
17F91.7Very high88.8Confident127 Ų12761.8 Ų61.856%0.55732%0.322SS*.Hα-helixtrans-62.3-40.1174-82-66.1000112.2G13 L14 F20 F21 L41G13-F17 WeakPolarHBondContact O-CD2 3.41Å; G13-F17 PolarHBondContact O-N 3.21Å; L14-F17 PolarHBondContact O-N 2.94Å; F17-F20 WeakPolarHBondContact O-CB 3.26Å; F17-F20 PolarHBondContact O-N 3.32Å; F17-F21 HydrophobicContact CD1-CE2 4.35Å; F17-F21 WeakPolarHBondContact O-CD2 3.41Å; F17-F21 PolarHBondContact O-N 3.3Å; F17-L41 HydrophobicContact CB-CD1 4.38Å
18G92.9Very high89.6Confident0 Ų062.9 Ų62.90%032%0.323CS..Hα-helixtrans-58.8-49175.500000112.4L14 T15 G16 F20 F21 L22 G38L14-G18 PolarHBondContact O-N 3.47Å; T15-G18 PolarHBondContact O-N 3.26Å; G16-G18 VanDerWaalsContact C-N 3.34Å; G16-G18 PolarHBondContact O-N 3.42Å; G18-F20 VanDerWaalsContact C-N 3.32Å; G18-F20 PolarHBondContact O-N 2.94Å; G18-F21 PolarHBondContact O-N 2.94Å; G18-L22 WeakPolarHBondContact O-CB 3.36Å; G18-L22 VanDerWaalsContact O-CG 3.28Å; G18-L22 WeakPolarHBondContact O-CG 3.22Å; G18-L22 PolarHBondContact O-N 3.43Å; G18-G38 VanDerWaalsContact CA-O 3.28Å; G18-G38 WeakPolarHBondContact CA-O 3.29Å; G18-G38 WeakPolarHBondContact O-CA 3.39Å
19V90.6Very high90Very high76 Ų7670.6 Ų70.646%0.46136%0.356SS..Hα-helixtrans-61.7-41.1175.51740000111.4T15 G16 L22 F23 F42T15-V19 WeakPolarHBondContact O-CG2 3.14Å; T15-V19 PolarHBondContact O-N 2.94Å; G16-V19 PolarHBondContact O-N 2.85Å; V19-L22 PolarHBondContact O-N 3.09Å; V19-F23 WeakPolarHBondContact O-CB 3.42Å; V19-F23 PolarHBondContact O-N 3.21Å; V19-F42 HydrophobicContact CG2-CD2 3.84Å; V19-F42 HydrophobicContact CG2-CE2 3.72Å
20F93.1Very high90.2Very high112 Ų11268.3 Ų68.349%0.49135%0.346SS..Hα-helixtrans-59.5-50.3176.5172.7-97.1000111.8G16 F17 G18 L22 F23 F24G16-F20 WeakPolarHBondContact O-CB 3.43Å; G16-F20 PolarHBondContact O-N 3.19Å; F17-F20 WeakPolarHBondContact O-CB 3.26Å; F17-F20 PolarHBondContact O-N 3.32Å; G18-F20 VanDerWaalsContact C-N 3.32Å; G18-F20 PolarHBondContact O-N 2.94Å; F20-L22 VanDerWaalsContact C-N 3.35Å; F20-L22 PolarHBondContact O-N 3.07Å; F20-F23 PolarHBondContact O-N 3.31Å; F20-F24 VanDerWaalsContact O-CB 3.24Å; F20-F24 WeakPolarHBondContact O-CB 3.16Å; F20-F24 PolarHBondContact O-N 3.02Å
21F92.5Very high90.4Very high63 Ų6366.4 Ų66.428%0.27634%0.337SS..Hα-helixtrans-67.7-33.6179.2-78-65000112.9F17 G18 G25 I37 L41F17-F21 HydrophobicContact CD1-CE2 4.35Å; F17-F21 WeakPolarHBondContact O-CD2 3.41Å; F17-F21 PolarHBondContact O-N 3.3Å; G18-F21 PolarHBondContact O-N 2.94Å; F21-G25 PolarHBondContact O-N 2.99Å; F21-I37 HydrophobicContact CD2-CG2 4.31Å; F21-I37 HydrophobicContact CG-CG2 4.41Å; F21-L41 HydrophobicContact CD2-CD1 3.44Å; F21-L41 VanDerWaalsContact CD2-CD1 3.44Å; F21-L41 HydrophobicContact CE2-CD1 3.8Å; F21-L41 HydrophobicContact CG-CD1 4.48Å
22L92.1Very high90.5Very high30 Ų3071.6 Ų71.616%0.15736%0.36CS..Hα-helixtrans-62.8-48.5172.1-75.4170.1000111.5G18 V19 F20 G25 M26 L35 N39 F42G18-L22 WeakPolarHBondContact O-CB 3.36Å; G18-L22 VanDerWaalsContact O-CG 3.28Å; G18-L22 WeakPolarHBondContact O-CG 3.22Å; G18-L22 PolarHBondContact O-N 3.43Å; V19-L22 PolarHBondContact O-N 3.09Å; F20-L22 VanDerWaalsContact C-N 3.35Å; F20-L22 PolarHBondContact O-N 3.07Å; L22-G25 PolarHBondContact O-N 3.22Å; L22-M26 WeakPolarHBondContact O-CG 3.39Å; L22-M26 PolarHBondContact O-N 3.33Å; L22-L35 HydrophobicContact CD2-CD2 3.98Å; L22-L35 WeakPolarHBondContact CD2-O 3.46Å; L22-L35 WeakPolarHBondContact O-CD2 3.45Å; L22-N39 WeakPolarHBondContact CD2-OD1 3.36Å; L22-F42 HydrophobicContact CD1-CB 4.33Å; L22-F42 HydrophobicContact CD1-CG 4.43Å
23F92Very high90.9Very high118 Ų11871.1 Ų71.152%0.51837%0.366SS..Hα-helixtrans-63.6-45178-178.2-108.5000112.2V19 F20 G25 M26 I27V19-F23 WeakPolarHBondContact O-CB 3.42Å; V19-F23 PolarHBondContact O-N 3.21Å; F20-F23 PolarHBondContact O-N 3.31Å; F23-G25 VanDerWaalsContact C-N 3.34Å; F23-G25 PolarHBondContact O-N 3.49Å; F23-M26 HydrophobicContact CB-CE 4.45Å; F23-M26 HydrophobicContact CD2-CE 4.05Å; F23-M26 WeakPolarHBondContact O-CB 3.44Å; F23-M26 PolarHBondContact O-N 3.41Å; F23-I27 HydrophobicContact CD1-CD1 3.8Å; F23-I27 HydrophobicContact CE1-CD1 3.26Å; F23-I27 HydrophobicContact CE1-CG1 4.36Å; F23-I27 HydrophobicContact CE2-CD1 4.29Å; F23-I27 HydrophobicContact CZ-CD1 3.55Å; F23-I27 HydrophobicContact CZ-CG1 4.35Å; F23-I27 PolarHBondContact O-N 3.29Å
24F93.3Very high91.1Very high86 Ų8671.3 Ų71.338%0.37736%0.359SS..Hα-helixtrans-65.4-38.9178.3-163.8-121.6000111.7F20 M26 I27 L28 L34F20-F24 VanDerWaalsContact O-CB 3.24Å; F20-F24 WeakPolarHBondContact O-CB 3.16Å; F20-F24 PolarHBondContact O-N 3.02Å; F24-M26 VanDerWaalsContact C-N 3.34Å; F24-M26 PolarHBondContact O-N 3.27Å; F24-I27 PolarHBondContact O-N 3.41Å; F24-L28 HydrophobicContact CD1-CD1 4.09Å; F24-L28 HydrophobicContact CE1-CD1 3.59Å; F24-L28 HydrophobicContact CE1-CG 4.39Å; F24-L28 HydrophobicContact CZ-CD1 3.89Å; F24-L28 HydrophobicContact CZ-CG 4.35Å; F24-L28 PolarHBondContact O-N 3.19Å; F24-L34 HydrophobicContact CB-CD2 4.42Å; F24-L34 HydrophobicContact CD1-CD2 3.35Å; F24-L34 HydrophobicContact CE1-CD2 3.95Å; F24-L34 HydrophobicContact CG-CD2 4.23Å
25G91.8Very high91.1Very high0 Ų069.4 Ų69.40%035%0.349CS..Hα-helixtrans-61.6-38.3172.600000113.1F21 L22 F23 F30 D31F21-G25 PolarHBondContact O-N 2.99Å; L22-G25 PolarHBondContact O-N 3.22Å; F23-G25 VanDerWaalsContact C-N 3.34Å; F23-G25 PolarHBondContact O-N 3.49Å; G25-F30 CarbonylContact O-C 3.52Å; G25-F30 WeakPolarHBondContact O-CA 3.25Å; G25-F30 PolarHBondContact O-N 2.9Å; G25-D31 PolarHBondContact O-N 2.83Å
26M90.6Very high91.2Very high71 Ų7168.8 Ų68.835%0.3535%0.347SS..Hα-helixtrans-65.2-43.1173.4-70.8-171.9-66.800112.3L22 F23 F24 L28 F29 F30 L35 V87L22-M26 WeakPolarHBondContact O-CG 3.39Å; L22-M26 PolarHBondContact O-N 3.33Å; F23-M26 HydrophobicContact CB-CE 4.45Å; F23-M26 HydrophobicContact CD2-CE 4.05Å; F23-M26 WeakPolarHBondContact O-CB 3.44Å; F23-M26 PolarHBondContact O-N 3.41Å; F24-M26 VanDerWaalsContact C-N 3.34Å; F24-M26 PolarHBondContact O-N 3.27Å; M26-L28 VanDerWaalsContact C-N 3.34Å; M26-L28 PolarHBondContact O-N 3.4Å; M26-F29 PolarHBondContact O-N 3.11Å; M26-F30 HydrophobicContact CG-CD1 4.35Å; M26-F30 HydrophobicContact CG-CE1 4.08Å; M26-F30 PolarHBondContact O-N 3.31Å; M26-L35 HydrophobicContact CG-CD2 4.08Å; M26-V87 HydrophobicContact SD-CG1 3.94Å
27I92.8Very high91.3Very high97 Ų9770.8 Ų70.850%0.49735%0.346SS..Hα-helixtrans-64-39.8178.3-69.9172000111.4F23 F24 F29F23-I27 HydrophobicContact CD1-CD1 3.8Å; F23-I27 HydrophobicContact CE1-CD1 3.26Å; F23-I27 HydrophobicContact CE1-CG1 4.36Å; F23-I27 HydrophobicContact CE2-CD1 4.29Å; F23-I27 HydrophobicContact CZ-CD1 3.55Å; F23-I27 HydrophobicContact CZ-CG1 4.35Å; F23-I27 PolarHBondContact O-N 3.29Å; F24-I27 PolarHBondContact O-N 3.41Å; I27-F29 PolarHBondContact O-N 3.5Å
28L92Very high91.3Very high81 Ų8164.7 Ų64.742%0.42432%0.32SS..THydrogen-bonded Turntrans-78.742.4176.7-67.4-176.3000112.8F24 M26 F30 D31 L34F24-L28 HydrophobicContact CD1-CD1 4.09Å; F24-L28 HydrophobicContact CE1-CD1 3.59Å; F24-L28 HydrophobicContact CE1-CG 4.39Å; F24-L28 HydrophobicContact CZ-CD1 3.89Å; F24-L28 HydrophobicContact CZ-CG 4.35Å; F24-L28 PolarHBondContact O-N 3.19Å; M26-L28 VanDerWaalsContact C-N 3.34Å; M26-L28 PolarHBondContact O-N 3.4Å; L28-F30 PolarHBondContact O-N 3.12Å; L28-D31 HydrophobicContact CB-CB 4.32Å; L28-D31 PolarHBondContact O-N 3.3Å; L28-L34 HydrophobicContact CD1-CD2 3.87Å
29F88.3Confident91.3Very high198 Ų19864.9 Ų64.987%0.86832%0.32SS*.THydrogen-bonded Turntrans5742.6177.7-62.8-82.6000114.3M26 I27M26-F29 PolarHBondContact O-N 3.11Å; I27-F29 PolarHBondContact O-N 3.5Å
30F86.8Confident91.2Very high64 Ų6466.8 Ų66.828%0.28133%0.327SS..SBendtrans60.149.8-179.6-63.2-94.1000112.9G25 M26 L28 K32 L35 P83 I84 V87G25-F30 CarbonylContact O-C 3.52Å; G25-F30 WeakPolarHBondContact O-CA 3.25Å; G25-F30 PolarHBondContact O-N 2.9Å; M26-F30 HydrophobicContact CG-CD1 4.35Å; M26-F30 HydrophobicContact CG-CE1 4.08Å; M26-F30 PolarHBondContact O-N 3.31Å; L28-F30 PolarHBondContact O-N 3.12Å; F30-K32 PolarHBondContact O-N 3.07Å; F30-K32 VanDerWaalsContact O-N 3.16Å; F30-L35 HydrophobicContact CB-CD1 4.06Å; F30-L35 HydrophobicContact CD1-CD1 4.18Å; F30-P83 HydrophobicContact CB-CB 4Å; F30-P83 HydrophobicContact CB-CG 3.9Å; F30-P83 WeakPolarHBondContact O-CG 3.17Å; F30-I84 HydrophobicContact CB-CG1 4.37Å; F30-I84 HydrophobicContact CD1-CG1 4.14Å; F30-I84 HydrophobicContact CD2-CD1 4.47Å; F30-I84 HydrophobicContact CD2-CG1 3.89Å; F30-I84 HydrophobicContact CE1-CG1 4.41Å; F30-I84 HydrophobicContact CE2-CG1 4.18Å; F30-I84 HydrophobicContact CG-CG1 3.88Å; F30-I84 HydrophobicContact CZ-CG1 4.42Å; F30-V87 HydrophobicContact CD1-CG2 4.21Å; F30-V87 HydrophobicContact CE1-CB 4.29Å; F30-V87 HydrophobicContact CE1-CG1 4.33Å; F30-V87 HydrophobicContact CE1-CG2 4.33Å
31D90.6Very high91.2Very high62 Ų6263.4 Ų63.433%0.33231%0.314SS..  trans-57.9119.6175.3-175.9-75.7000110.6G25 L28 A33 L34 L35G25-D31 PolarHBondContact O-N 2.83Å; L28-D31 HydrophobicContact CB-CB 4.32Å; L28-D31 PolarHBondContact O-N 3.3Å; D31-A33 VanDerWaalsContact C-N 3.32Å; D31-A33 PolarHBondContact O-N 2.93Å; D31-A33 WeakPolarHBondContact OD1-CA 3.46Å; D31-A33 WeakPolarHBondContact OD1-CB 3.22Å; D31-A33 PolarHBondContact OD1-N 3.26Å; D31-L34 HydrophobicContact CB-CB 4.25Å; D31-L34 HydrophobicContact CB-CD1 4.36Å; D31-L34 PolarHBondContact O-N 3.2Å; D31-L34 WeakPolarHBondContact OD1-CD1 3.34Å; D31-L34 PolarHBondContact OD1-N 3.49Å; D31-L35 WeakPolarHBondContact O-CB 3.48Å; D31-L35 VanDerWaalsContact O-CG 3.22Å; D31-L35 WeakPolarHBondContact O-CG 3.39Å; D31-L35 PolarHBondContact O-N 3.12Å
32K88.1Confident91Very high110 Ų11061.2 Ų61.248%0.47830%0.304SS..Hα-helixtrans-65.2-36.2-172.7-62.7172.9-177.9-176.50112.2F30 A36 G81 P83F30-K32 PolarHBondContact O-N 3.07Å; F30-K32 VanDerWaalsContact O-N 3.16Å; K32-A36 WeakPolarHBondContact O-CB 3.27Å; K32-A36 PolarHBondContact O-N 2.99Å; K32-G81 WeakPolarHBondContact CE-O 3.32Å; K32-G81 PolarHBondContact NZ-O 3.1Å; K32-P83 HydrophobicContact CG-CB 4.31Å; K32-P83 HydrophobicContact CG-CG 3.97Å
33A89.9Confident90.7Very high55 Ų5562 Ų6246%0.45531%0.31SS..Hα-helixtrans-73.1-43.4-176.900000110.6D31 A36 I37D31-A33 VanDerWaalsContact C-N 3.32Å; D31-A33 PolarHBondContact O-N 2.93Å; D31-A33 WeakPolarHBondContact OD1-CA 3.46Å; D31-A33 WeakPolarHBondContact OD1-CB 3.22Å; D31-A33 PolarHBondContact OD1-N 3.26Å; A33-A36 PolarHBondContact O-N 2.94Å; A33-I37 WeakPolarHBondContact O-CB 3.49Å; A33-I37 VanDerWaalsContact O-CG1 3.29Å; A33-I37 WeakPolarHBondContact O-CG1 3.44Å; A33-I37 PolarHBondContact O-N 2.83Å
34L92.5Very high90.5Very high37 Ų3758 Ų5819%0.19430%0.299CS..Hα-helixtrans-65.8-43.2176.4-88.172.1000112F24 L28 D31 A36 I37 G38F24-L34 HydrophobicContact CB-CD2 4.42Å; F24-L34 HydrophobicContact CD1-CD2 3.35Å; F24-L34 HydrophobicContact CE1-CD2 3.95Å; F24-L34 HydrophobicContact CG-CD2 4.23Å; L28-L34 HydrophobicContact CD1-CD2 3.87Å; D31-L34 HydrophobicContact CB-CB 4.25Å; D31-L34 HydrophobicContact CB-CD1 4.36Å; D31-L34 PolarHBondContact O-N 3.2Å; D31-L34 WeakPolarHBondContact OD1-CD1 3.34Å; D31-L34 PolarHBondContact OD1-N 3.49Å; L34-A36 VanDerWaalsContact C-N 3.34Å; L34-I37 PolarHBondContact O-N 3.06Å; L34-G38 PolarHBondContact O-N 3.42Å
35L92.4Very high90.1Very high0 Ų054 Ų540%028%0.281CS..Hα-helixtrans-62.7-42.6175.7-69.2170.8000111L22 M26 F30 D31 G38 N39 V78 P83 V87L22-L35 HydrophobicContact CD2-CD2 3.98Å; L22-L35 WeakPolarHBondContact CD2-O 3.46Å; L22-L35 WeakPolarHBondContact O-CD2 3.45Å; M26-L35 HydrophobicContact CG-CD2 4.08Å; F30-L35 HydrophobicContact CB-CD1 4.06Å; F30-L35 HydrophobicContact CD1-CD1 4.18Å; D31-L35 WeakPolarHBondContact O-CB 3.48Å; D31-L35 VanDerWaalsContact O-CG 3.22Å; D31-L35 WeakPolarHBondContact O-CG 3.39Å; D31-L35 PolarHBondContact O-N 3.12Å; L35-G38 PolarHBondContact O-N 3.49Å; L35-N39 WeakPolarHBondContact O-CB 3.13Å; L35-N39 PolarHBondContact O-N 3.37Å; L35-N39 PolarHBondContact O-ND2 3.01Å; L35-N39 VanDerWaalsContact O-ND2 3.1Å; L35-V78 HydrophobicContact CB-CG1 3.66Å; L35-V78 HydrophobicContact CD1-CG1 4.33Å; L35-P83 HydrophobicContact CD1-CB 3.62Å; L35-V87 HydrophobicContact CD1-CG2 3.98Å; L35-V87 HydrophobicContact CD2-CG2 3.97Å
36A90.3Very high89.7Confident14 Ų1454.7 Ų54.712%0.11629%0.285CS..Hα-helixtrans-60.6-49176.100000112.5K32 A33 L34 G38 N39 I40 L79K32-A36 WeakPolarHBondContact O-CB 3.27Å; K32-A36 PolarHBondContact O-N 2.99Å; A33-A36 PolarHBondContact O-N 2.94Å; L34-A36 VanDerWaalsContact C-N 3.34Å; A36-G38 VanDerWaalsContact C-N 3.33Å; A36-G38 PolarHBondContact O-N 3.39Å; A36-N39 PolarHBondContact O-N 3.47Å; A36-I40 WeakPolarHBondContact O-CG1 3.47Å; A36-I40 PolarHBondContact O-N 2.9Å; A36-L79 HydrophobicContact CB-CD2 3.49Å; A36-L79 VanDerWaalsContact CB-CD2 3.49Å
37I92.5Very high89.3Confident85 Ų8552.1 Ų52.144%0.43627%0.274SS..Hα-helixtrans-62.3-43.9177.6-70.7165.4000110.2F21 A33 L34 N39 I40 L41F21-I37 HydrophobicContact CD2-CG2 4.31Å; F21-I37 HydrophobicContact CG-CG2 4.41Å; A33-I37 WeakPolarHBondContact O-CB 3.49Å; A33-I37 VanDerWaalsContact O-CG1 3.29Å; A33-I37 WeakPolarHBondContact O-CG1 3.44Å; A33-I37 PolarHBondContact O-N 2.83Å; L34-I37 PolarHBondContact O-N 3.06Å; I37-N39 VanDerWaalsContact C-N 3.34Å; I37-N39 PolarHBondContact O-N 3.01Å; I37-I40 PolarHBondContact O-N 3.04Å; I37-L41 HydrophobicContact CG2-CD1 3.61Å; I37-L41 HydrophobicContact CG2-CG 4.29Å; I37-L41 WeakPolarHBondContact O-CB 3.07Å; I37-L41 VanDerWaalsContact O-CG 3.29Å; I37-L41 WeakPolarHBondContact O-CG 3.49Å; I37-L41 PolarHBondContact O-N 2.98Å
38G93.1Very high88.8Confident0 Ų051.7 Ų51.70%027%0.268CS..Hα-helixtrans-57.2-46.2175.900000112.3G18 L34 L35 A36 L41 F42G18-G38 VanDerWaalsContact CA-O 3.28Å; G18-G38 WeakPolarHBondContact CA-O 3.29Å; G18-G38 WeakPolarHBondContact O-CA 3.39Å; L34-G38 PolarHBondContact O-N 3.42Å; L35-G38 PolarHBondContact O-N 3.49Å; A36-G38 VanDerWaalsContact C-N 3.33Å; A36-G38 PolarHBondContact O-N 3.39Å; G38-L41 PolarHBondContact O-N 3.44Å; G38-F42 WeakPolarHBondContact O-CB 3.4Å; G38-F42 PolarHBondContact O-N 2.94Å
39N91.3Very high88Confident3 Ų349.1 Ų49.12%0.01626%0.256CS..Hα-helixtrans-63.2-43.9177.1-79.7-38.7000113.3L22 L35 A36 I37 F42 V43 V75 E90L22-N39 WeakPolarHBondContact CD2-OD1 3.36Å; L35-N39 WeakPolarHBondContact O-CB 3.13Å; L35-N39 PolarHBondContact O-N 3.37Å; L35-N39 PolarHBondContact O-ND2 3.01Å; L35-N39 VanDerWaalsContact O-ND2 3.1Å; A36-N39 PolarHBondContact O-N 3.47Å; I37-N39 VanDerWaalsContact C-N 3.34Å; I37-N39 PolarHBondContact O-N 3.01Å; N39-F42 PolarHBondContact O-N 3.21Å; N39-V43 WeakPolarHBondContact O-CG2 3.1Å; N39-V43 PolarHBondContact O-N 3.37Å; N39-V75 HydrophobicContact CB-CG1 4.19Å; N39-V75 HydrophobicContact CB-CG2 4.31Å; N39-E90 PolarHBondContact ND2-OE1 3Å; N39-E90 PolarHBondContact ND2-OE2 3.35Å; N39-E90 PolarHBondContact OD1-OE1 2.97Å
40I90.5Very high87.3Confident116 Ų11640.8 Ų40.860%0.59522%0.22SC*.Hα-helixtrans-62.1-49.1177.5-67.5167000110.4A36 I37 F42 V43 A44A36-I40 WeakPolarHBondContact O-CG1 3.47Å; A36-I40 PolarHBondContact O-N 2.9Å; I37-I40 PolarHBondContact O-N 3.04Å; I40-F42 VanDerWaalsContact C-N 3.29Å; I40-F42 PolarHBondContact O-N 2.87Å; I40-V43 PolarHBondContact O-N 2.65Å; I40-A44 VanDerWaalsContact O-CB 3.25Å; I40-A44 WeakPolarHBondContact O-CB 3.35Å; I40-A44 PolarHBondContact O-N 2.99Å
41L91.3Very high86.5Confident42 Ų4239.1 Ų39.122%0.2222%0.221CC..Hα-helixtrans-61.7-39.9178.6-72.2167.8000111.6L14 F17 F21 I37 G38 G45L14-L41 HydrophobicContact CD2-CD2 3.59Å; F17-L41 HydrophobicContact CB-CD1 4.38Å; F21-L41 HydrophobicContact CD2-CD1 3.44Å; F21-L41 VanDerWaalsContact CD2-CD1 3.44Å; F21-L41 HydrophobicContact CE2-CD1 3.8Å; F21-L41 HydrophobicContact CG-CD1 4.48Å; I37-L41 HydrophobicContact CG2-CD1 3.61Å; I37-L41 HydrophobicContact CG2-CG 4.29Å; I37-L41 WeakPolarHBondContact O-CB 3.07Å; I37-L41 VanDerWaalsContact O-CG 3.29Å; I37-L41 WeakPolarHBondContact O-CG 3.49Å; I37-L41 PolarHBondContact O-N 2.98Å; G38-L41 PolarHBondContact O-N 3.44Å; L41-G45 PolarHBondContact O-N 3.4Å
42F89.4Confident85.4Confident17 Ų1740.9 Ų40.98%0.07523%0.23CC..Hα-helixtrans-65-49179.8-176.2-112.3000112.4T15 V19 L22 G38 N39 I40 G45 L46 F71 F94T15-F42 HydrophobicContact CG2-CD2 3.84Å; T15-F42 HydrophobicContact CG2-CE2 3.75Å; V19-F42 HydrophobicContact CG2-CD2 3.84Å; V19-F42 HydrophobicContact CG2-CE2 3.72Å; L22-F42 HydrophobicContact CD1-CB 4.33Å; L22-F42 HydrophobicContact CD1-CG 4.43Å; G38-F42 WeakPolarHBondContact O-CB 3.4Å; G38-F42 PolarHBondContact O-N 2.94Å; N39-F42 PolarHBondContact O-N 3.21Å; I40-F42 VanDerWaalsContact C-N 3.29Å; I40-F42 PolarHBondContact O-N 2.87Å; F42-G45 PolarHBondContact O-N 2.75Å; F42-L46 HydrophobicContact CD1-CD1 3.86Å; F42-L46 HydrophobicContact CE1-CD1 3.48Å; F42-L46 VanDerWaalsContact CE1-CD1 3.48Å; F42-L46 HydrophobicContact CE1-CG 4.48Å; F42-L46 HydrophobicContact CE2-CD1 4.28Å; F42-L46 HydrophobicContact CE2-CG 4.49Å; F42-L46 HydrophobicContact CG-CD1 4.43Å; F42-L46 HydrophobicContact CZ-CD1 3.74Å; F42-L46 HydrophobicContact CZ-CG 4.39Å; F42-L46 WeakPolarHBondContact O-CB 3.02Å; F42-L46 WeakPolarHBondContact O-CG 3.45Å; F42-L46 PolarHBondContact O-N 3Å; F42-F71 HydrophobicContact CD1-CE2 4.43Å; F42-F71 HydrophobicContact CD1-CZ 4.03Å; F42-F71 HydrophobicContact CE1-CE2 4.22Å; F42-F71 HydrophobicContact CE1-CZ 4.14Å; F42-F94 AromaticContact CE1-CD2 3.55Å; F42-F94 HydrophobicContact CE1-CD2 3.55Å; F42-F94 AromaticContact CE1-CE2 3.3Å; F42-F94 HydrophobicContact CE1-CE2 3.3Å; F42-F94 HydrophobicContact CE1-CZ 4.15Å; F42-F94 HydrophobicContact CE2-CE2 4.41Å; F42-F94 AromaticContact CZ-CD2 3.81Å; F42-F94 HydrophobicContact CZ-CD2 3.81Å; F42-F94 HydrophobicContact CZ-CE1 4.43Å; F42-F94 AromaticContact CZ-CE2 3.13Å; F42-F94 HydrophobicContact CZ-CE2 3.13Å; F42-F94 AromaticContact CZ-CZ 3.52Å; F42-F94 HydrophobicContact CZ-CZ 3.52Å
43V86.1Confident84Confident47 Ų4742 Ų4229%0.28524%0.237SC..Hα-helixtrans-65.7-42.1178.2174.70000111.4N39 I40 S47 F71N39-V43 WeakPolarHBondContact O-CG2 3.1Å; N39-V43 PolarHBondContact O-N 3.37Å; I40-V43 PolarHBondContact O-N 2.65Å; V43-S47 WeakPolarHBondContact O-CB 3.22Å; V43-S47 PolarHBondContact O-N 2.76Å; V43-S47 PolarHBondContact O-OG 2.63Å; V43-F71 HydrophobicContact CG2-CE1 3.6Å; V43-F71 HydrophobicContact CG2-CZ 3.78Å
44A86.5Confident82.8Confident34 Ų3448.6 Ų48.628%0.28125%0.25SS..Hα-helixtrans-62.1-45.517500000111.3I40 S47 F48I40-A44 VanDerWaalsContact O-CB 3.25Å; I40-A44 WeakPolarHBondContact O-CB 3.35Å; I40-A44 PolarHBondContact O-N 2.99Å; A44-S47 WeakPolarHBondContact O-CB 3.41Å; A44-S47 PolarHBondContact O-N 3.38Å; A44-F48 VanDerWaalsContact O-CD2 3.24Å; A44-F48 WeakPolarHBondContact O-CD2 3.42Å; A44-F48 PolarHBondContact O-N 3.04Å
45G86.4Confident81.5Confident0 Ų047.2 Ų47.20%024%0.243CC..Hα-helixtrans-60.8-47.9177.700000112.5G11 L14 T15 L41 F42 S47 F48 V49G11-G45 WeakPolarHBondContact O-CA 3.38Å; L14-G45 VanDerWaalsContact CB-CA 3.45Å; T15-G45 VanDerWaalsContact OG1-CA 3.31Å; T15-G45 WeakPolarHBondContact OG1-CA 3.4Å; L41-G45 PolarHBondContact O-N 3.4Å; F42-G45 PolarHBondContact O-N 2.75Å; G45-S47 VanDerWaalsContact C-N 3.26Å; G45-S47 PolarHBondContact O-N 3.27Å; G45-F48 PolarHBondContact O-N 3.1Å; G45-V49 WeakPolarHBondContact O-CG2 3.46Å; G45-V49 PolarHBondContact O-N 3.44Å
46L82.8Confident80.2Confident15 Ų1553.4 Ų53.48%0.07927%0.27CS..Hα-helixtrans-57.8-41.5175.8-76.2172.1000112T15 F42 F48 V49 I50 F94 F98T15-L46 HydrophobicContact CG2-CD2 4.5Å; T15-L46 PolarHBondContact OG1-N 3.17Å; F42-L46 HydrophobicContact CD1-CD1 3.86Å; F42-L46 HydrophobicContact CE1-CD1 3.48Å; F42-L46 VanDerWaalsContact CE1-CD1 3.48Å; F42-L46 HydrophobicContact CE1-CG 4.48Å; F42-L46 HydrophobicContact CE2-CD1 4.28Å; F42-L46 HydrophobicContact CE2-CG 4.49Å; F42-L46 HydrophobicContact CG-CD1 4.43Å; F42-L46 HydrophobicContact CZ-CD1 3.74Å; F42-L46 HydrophobicContact CZ-CG 4.39Å; F42-L46 WeakPolarHBondContact O-CB 3.02Å; F42-L46 WeakPolarHBondContact O-CG 3.45Å; F42-L46 PolarHBondContact O-N 3Å; L46-F48 VanDerWaalsContact C-N 3.29Å; L46-F48 PolarHBondContact O-N 3.47Å; L46-V49 PolarHBondContact O-N 3.39Å; L46-I50 HydrophobicContact CD2-CD1 4.49Å; L46-I50 WeakPolarHBondContact O-CB 3.39Å; L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.16Å; L46-F94 HydrophobicContact CD1-CE2 4.13Å; L46-F98 HydrophobicContact CD1-CE2 4.12Å; L46-F98 HydrophobicContact CD1-CZ 3.74Å; L46-F98 HydrophobicContact CD2-CE1 4.09Å; L46-F98 HydrophobicContact CD2-CZ 3.67Å; L46-F98 HydrophobicContact CG-CZ 4.32Å
47S82.8Confident79Confident17 Ų1760.9 Ų60.912%0.11930%0.296CS..Hα-helixtrans-61.4-37.8176.9-580000112.3V43 A44 G45 G51 L52V43-S47 WeakPolarHBondContact O-CB 3.22Å; V43-S47 PolarHBondContact O-N 2.76Å; V43-S47 PolarHBondContact O-OG 2.63Å; A44-S47 WeakPolarHBondContact O-CB 3.41Å; A44-S47 PolarHBondContact O-N 3.38Å; G45-S47 VanDerWaalsContact C-N 3.26Å; G45-S47 PolarHBondContact O-N 3.27Å; S47-G51 CarbonylContact O-C 3.04Å; S47-G51 WeakPolarHBondContact O-CA 3.44Å; S47-G51 PolarHBondContact O-N 2.85Å; S47-L52 PolarHBondContact O-N 3.32Å; S47-L52 VanDerWaalsContact O-N 3.17Å
48F81.1Confident77.8Confident88 Ų8857.9 Ų57.939%0.38628%0.279SS..Hα-helixtrans-77.6-32.9176.7-82.3-64.8000114G11 L14 A44 G45 L46G11-F48 VanDerWaalsContact CA-CB 3.45Å; L14-F48 HydrophobicContact CD1-CD2 3.81Å; L14-F48 HydrophobicContact CD1-CE2 4.23Å; A44-F48 VanDerWaalsContact O-CD2 3.24Å; A44-F48 WeakPolarHBondContact O-CD2 3.42Å; A44-F48 PolarHBondContact O-N 3.04Å; G45-F48 PolarHBondContact O-N 3.1Å; L46-F48 VanDerWaalsContact C-N 3.29Å; L46-F48 PolarHBondContact O-N 3.47Å
49V76.3Confident76.5Confident28 Ų2858.6 Ų58.617%0.1728%0.283CS..Hα-helixtrans-69.7-47.3176.3173.30000111.2Q8 M12 G45 L46Q8-V49 PolarHBondContact NE2-O 3.12Å; M12-V49 HydrophobicContact CG-CG2 3.99Å; G45-V49 WeakPolarHBondContact O-CG2 3.46Å; G45-V49 PolarHBondContact O-N 3.44Å; L46-V49 PolarHBondContact O-N 3.39Å
50I73.4Confident75.1Confident22 Ų2264.3 Ų64.311%0.11331%0.308CS..Hα-helixtrans-84-29.3-175.3-61.9171.9000111.4L46 R54 T55 F101L46-I50 HydrophobicContact CD2-CD1 4.49Å; L46-I50 WeakPolarHBondContact O-CB 3.39Å; L46-I50 WeakPolarHBondContact O-CG1 3.33Å; L46-I50 PolarHBondContact O-N 3.16Å; I50-R54 HydrophobicContact CG2-CB 3.89Å; I50-T55 WeakPolarHBondContact CB-OG1 3.5Å; I50-T55 WeakPolarHBondContact CG2-OG1 3.44Å; I50-F101 HydrophobicContact CB-CZ 4.45Å; I50-F101 HydrophobicContact CD1-CD1 4.17Å; I50-F101 HydrophobicContact CD1-CE1 3.54Å; I50-F101 HydrophobicContact CD1-CZ 3.91Å; I50-F101 HydrophobicContact CG1-CE1 3.69Å; I50-F101 HydrophobicContact CG1-CZ 3.98Å; I50-F101 HydrophobicContact CG2-CE1 4.31Å; I50-F101 HydrophobicContact CG2-CZ 3.69Å
51G70.4Confident73.9Confident29 Ų2964 Ų6430%0.29930%0.303SS..  trans97.3133-170.200000111S47 E53 R54 T55S47-G51 CarbonylContact O-C 3.04Å; S47-G51 WeakPolarHBondContact O-CA 3.44Å; S47-G51 PolarHBondContact O-N 2.85Å; G51-E53 VanDerWaalsContact C-N 3.31Å; G51-E53 PolarHBondContact O-N 3.02Å; G51-R54 PolarHBondContact O-N 3.4Å; G51-T55 WeakPolarHBondContact O-CB 3.37Å; G51-T55 PolarHBondContact O-N 3.37Å; G51-T55 PolarHBondContact O-OG1 3.38Å
52L65.9Low72.4Confident99 Ų9971.5 Ų71.552%0.51834%0.335SS..Hα-helixtrans-52.3-46.1-174.8-89.9158.1000112.9S47 T55 F56S47-L52 PolarHBondContact O-N 3.32Å; S47-L52 VanDerWaalsContact O-N 3.17Å; L52-T55 PolarHBondContact O-N 3.21Å; L52-F56 PolarHBondContact O-N 3Å
53E59.1Low71.2Confident135 Ų13579 Ų7963%0.63137%0.37SS*.Hα-helixtrans-68.7-38.7-176.7-156.1-172.5162.900112.6G51 R57G51-E53 VanDerWaalsContact C-N 3.31Å; G51-E53 PolarHBondContact O-N 3.02Å; E53-R57 WeakPolarHBondContact O-CG 3.5Å; E53-R57 PolarHBondContact O-N 3.17Å; E53-R57 VanDerWaalsContact O-N 3.14Å; E53-R57 IonicContact OE1-CZ 3.14Å; E53-R57 IonicContact OE1-NE 3.7Å; E53-R57 IonicContact OE1-NH2 3.96Å; E53-R57 PolarHBondContact OE1-NH2 2.95Å
54R64.1Low70.2Confident193 Ų19378.9 Ų78.973%0.72837%0.365SS*.Hα-helixtrans-73.4-35.9176.2-69.4-174.1-176.8-158.60.6111.5I50 G51 R57 F58I50-R54 HydrophobicContact CG2-CB 3.89Å; G51-R54 PolarHBondContact O-N 3.4Å; R54-R57 PolarHBondContact O-N 3.06Å; R54-F58 WeakPolarHBondContact O-CB 3.46Å; R54-F58 PolarHBondContact O-N 2.87Å
55T66.4Low69.5Low7 Ų780.9 Ų80.94%0.04337%0.37CS..Hα-helixtrans-65.9-44.4176.8-52.10000110.7I50 G51 L52 F58 F59I50-T55 WeakPolarHBondContact CB-OG1 3.5Å; I50-T55 WeakPolarHBondContact CG2-OG1 3.44Å; G51-T55 WeakPolarHBondContact O-CB 3.37Å; G51-T55 PolarHBondContact O-N 3.37Å; G51-T55 PolarHBondContact O-OG1 3.38Å; L52-T55 PolarHBondContact O-N 3.21Å; T55-F58 PolarHBondContact O-N 3.37Å; T55-F59 HydrophobicContact CG2-CD2 3.8Å; T55-F59 HydrophobicContact CG2-CE2 4Å; T55-F59 WeakPolarHBondContact O-CB 3.34Å; T55-F59 WeakPolarHBondContact O-CD2 3.4Å; T55-F59 PolarHBondContact O-N 3.35Å
56F64.3Low69.1Low130 Ų13088.9 Ų88.957%0.5740%0.404SS*.Hα-helixtrans-61.9-47.1174.8-102.2-85.5000112L52 F58 F59 F60L52-F56 PolarHBondContact O-N 3Å; F56-F58 VanDerWaalsContact C-N 3.28Å; F56-F58 PolarHBondContact O-N 2.87Å; F56-F59 PolarHBondContact O-N 2.94Å; F56-F60 HydrophobicContact CD1-CD2 4.03Å; F56-F60 HydrophobicContact CD1-CE2 4.19Å; F56-F60 HydrophobicContact CE1-CD2 4.44Å; F56-F60 HydrophobicContact CE1-CE2 4.15Å; F56-F60 WeakPolarHBondContact O-CB 3.19Å; F56-F60 PolarHBondContact O-N 3.34Å
57R66.4Low69Low172 Ų17288.3 Ų88.365%0.64940%0.402SS*.Hα-helixtrans-64.3-32.6175.8-69.8-173.5-157-171.97.6112.8E53 R54 Q61E53-R57 WeakPolarHBondContact O-CG 3.5Å; E53-R57 PolarHBondContact O-N 3.17Å; E53-R57 VanDerWaalsContact O-N 3.14Å; E53-R57 IonicContact OE1-CZ 3.14Å; E53-R57 IonicContact OE1-NE 3.7Å; E53-R57 IonicContact OE1-NH2 3.96Å; E53-R57 PolarHBondContact OE1-NH2 2.95Å; R54-R57 PolarHBondContact O-N 3.06Å; R57-Q61 WeakPolarHBondContact O-CB 3.36Å; R57-Q61 PolarHBondContact O-N 2.89Å
58F65.8Low68.9Low21 Ų2187.9 Ų87.99%0.09240%0.399CS..Hα-helixtrans-73.2-43.8178.1-173.1-102.9000112.3R54 T55 F56 L97 F101R54-F58 WeakPolarHBondContact O-CB 3.46Å; R54-F58 PolarHBondContact O-N 2.87Å; T55-F58 PolarHBondContact O-N 3.37Å; F56-F58 VanDerWaalsContact C-N 3.28Å; F56-F58 PolarHBondContact O-N 2.87Å; F58-L97 HydrophobicContact CD1-CD2 4.11Å; F58-L97 HydrophobicContact CE1-CD2 3.78Å; F58-L97 VanDerWaalsContact CZ-O 3.27Å; F58-L97 WeakPolarHBondContact CZ-O 3.36Å; F58-F101 HydrophobicContact CD1-CD2 4.31Å; F58-F101 AromaticContact CD2-CD2 3.54Å; F58-F101 HydrophobicContact CD2-CD2 3.54Å; F58-F101 AromaticContact CD2-CE2 3.77Å; F58-F101 HydrophobicContact CD2-CE2 3.77Å; F58-F101 HydrophobicContact CE1-CB 4.16Å; F58-F101 HydrophobicContact CE1-CD2 4.02Å; F58-F101 HydrophobicContact CE1-CG 4.2Å; F58-F101 HydrophobicContact CE2-CB 4.08Å; F58-F101 AromaticContact CE2-CD2 3.21Å; F58-F101 HydrophobicContact CE2-CD2 3.21Å; F58-F101 AromaticContact CE2-CE2 3.95Å; F58-F101 HydrophobicContact CE2-CE2 3.95Å; F58-F101 HydrophobicContact CE2-CG 4.01Å; F58-F101 HydrophobicContact CG-CD2 4.1Å; F58-F101 HydrophobicContact CG-CE2 4.13Å; F58-F101 HydrophobicContact CZ-CB 3.56Å; F58-F101 AromaticContact CZ-CD2 3.49Å; F58-F101 HydrophobicContact CZ-CD2 3.49Å; F58-F101 VanDerWaalsContact CZ-CD2 3.49Å; F58-F101 HydrophobicContact CZ-CE2 4.43Å; F58-F101 AromaticContact CZ-CG 3.81Å; F58-F101 HydrophobicContact CZ-CG 3.81Å
59F66Low69Low16 Ų1687.7 Ų87.77%0.0741%0.408CS..Hα-helixtrans-69.5-36.4176.1-93.3-111.3000112.1T55 F56 T68 F71 L72 L97T55-F59 HydrophobicContact CG2-CD2 3.8Å; T55-F59 HydrophobicContact CG2-CE2 4Å; T55-F59 WeakPolarHBondContact O-CB 3.34Å; T55-F59 WeakPolarHBondContact O-CD2 3.4Å; T55-F59 PolarHBondContact O-N 3.35Å; F56-F59 PolarHBondContact O-N 2.94Å; F59-T68 HydrophobicContact CB-CG2 4.23Å; F59-T68 HydrophobicContact CD1-CG2 3.55Å; F59-T68 HydrophobicContact CE1-CG2 4.33Å; F59-T68 HydrophobicContact CG-CG2 4.31Å; F59-T68 WeakPolarHBondContact O-CB 3.43Å; F59-T68 PolarHBondContact O-OG1 2.8Å; F59-F71 AromaticContact CE1-CD1 3.8Å; F59-F71 HydrophobicContact CE1-CD1 3.8Å; F59-F71 HydrophobicContact CE1-CE1 4.11Å; F59-F71 HydrophobicContact CZ-CD1 4.18Å; F59-F71 HydrophobicContact CZ-CE1 4.18Å; F59-L72 HydrophobicContact CD1-CD1 4.27Å; F59-L72 HydrophobicContact CE1-CD1 4.16Å; F59-L97 HydrophobicContact CD1-CD1 4.45Å; F59-L97 HydrophobicContact CD2-CD2 4.22Å; F59-L97 HydrophobicContact CE1-CD1 3.84Å; F59-L97 HydrophobicContact CE2-CD2 4.21Å; F59-L97 HydrophobicContact CG-CD2 4.38Å; F59-L97 HydrophobicContact CZ-CD1 3.9Å; F59-L97 HydrophobicContact CZ-CD2 4.34Å
60F62.9Low69.4Low123 Ų12390.6 Ų90.654%0.53942%0.418SS..THydrogen-bonded Turntrans-98.814.5-177.2-81.2-92.3000115F56 K62 M65F56-F60 HydrophobicContact CD1-CD2 4.03Å; F56-F60 HydrophobicContact CD1-CE2 4.19Å; F56-F60 HydrophobicContact CE1-CD2 4.44Å; F56-F60 HydrophobicContact CE1-CE2 4.15Å; F56-F60 WeakPolarHBondContact O-CB 3.19Å; F56-F60 PolarHBondContact O-N 3.34Å; F60-K62 PolarHBondContact O-N 3.17Å; F60-M65 HydrophobicContact CB-SD 4.36Å; F60-M65 HydrophobicContact CD1-CE 4.04Å; F60-M65 HydrophobicContact CD1-SD 3.88Å; F60-M65 HydrophobicContact CE1-CE 4.23Å; F60-M65 HydrophobicContact CG-SD 4.36Å
61Q65.6Low70.1Confident108 Ų10889.8 Ų89.851%0.50541%0.414SS..  trans-68.9129174.6-147.7171.210.600109.8R57 H63 K64 M65R57-Q61 WeakPolarHBondContact O-CB 3.36Å; R57-Q61 PolarHBondContact O-N 2.89Å; Q61-H63 PolarHBondContact O-N 2.92Å; Q61-K64 HydrophobicContact CB-CB 4.31Å; Q61-K64 HydrophobicContact CB-CG 4.35Å; Q61-K64 CarbonylContact O-C 3.6Å; Q61-K64 WeakPolarHBondContact O-CA 3.24Å; Q61-K64 PolarHBondContact O-N 3.19Å; Q61-M65 WeakPolarHBondContact O-CG 3.35Å; Q61-M65 PolarHBondContact O-N 3.19Å
62K59.5Low70.8Confident201 Ų20192.5 Ų92.587%0.87442%0.421SS*.THydrogen-bonded Turntrans-50.4-34.5-176-68-171178.3-177.30113.9F60 K64F60-K62 PolarHBondContact O-N 3.17Å; K62-K64 VanDerWaalsContact C-N 3.33Å
63H62.5Low71.9Confident175 Ų17589 Ų8981%0.8141%0.409SS*.THydrogen-bonded Turntrans-77.6-15.4179-157.9-63.7000113.9Q61Q61-H63 PolarHBondContact O-N 2.92Å
64K66.4Low73.3Confident43 Ų4382.5 Ų82.519%0.18738%0.379CS..THydrogen-bonded Turntrans-111.6-7.7-178.5-61.5-65-174.3174.80113.5Q61 K62 K66 A67 T68Q61-K64 HydrophobicContact CB-CB 4.31Å; Q61-K64 HydrophobicContact CB-CG 4.35Å; Q61-K64 CarbonylContact O-C 3.6Å; Q61-K64 WeakPolarHBondContact O-CA 3.24Å; Q61-K64 PolarHBondContact O-N 3.19Å; K62-K64 VanDerWaalsContact C-N 3.33Å; K64-K66 PolarHBondContact O-N 3.14Å; K64-K66 VanDerWaalsContact O-N 3.12Å; K64-A67 WeakPolarHBondContact O-CB 3.48Å; K64-A67 PolarHBondContact O-N 3.41Å; K64-T68 PolarHBondContact O-N 3.49Å; K64-T68 PolarHBondContact O-OG1 2.91Å
65M70.8Confident74.4Confident77 Ų7774.5 Ų74.538%0.37935%0.351SS..Hα-helixtrans-51.4-37.1178.8-71.9-61.3-67.600114.2F60 Q61 T68 S69F60-M65 HydrophobicContact CB-SD 4.36Å; F60-M65 HydrophobicContact CD1-CE 4.04Å; F60-M65 HydrophobicContact CD1-SD 3.88Å; F60-M65 HydrophobicContact CE1-CE 4.23Å; F60-M65 HydrophobicContact CG-SD 4.36Å; Q61-M65 WeakPolarHBondContact O-CG 3.35Å; Q61-M65 PolarHBondContact O-N 3.19Å; M65-T68 PolarHBondContact O-N 3.23Å; M65-S69 WeakPolarHBondContact O-CB 3.49Å; M65-S69 PolarHBondContact O-N 2.94Å
66K77.6Confident75.4Confident167 Ų16778.7 Ų78.773%0.72637%0.373SS*.Hα-helixtrans-62-44.9176.3-68-175.4178.8-178.10111.4K64 S69 F70K64-K66 PolarHBondContact O-N 3.14Å; K64-K66 VanDerWaalsContact O-N 3.12Å; K66-S69 PolarHBondContact O-N 2.83Å; K66-F70 WeakPolarHBondContact O-CD2 3.42Å; K66-F70 PolarHBondContact O-N 3.32Å; K66-F70 VanDerWaalsContact O-N 3.17Å
67A80.5Confident76.6Confident3 Ų374.9 Ų74.93%0.02536%0.358CS..Hα-helixtrans-65.9-44.3178.200000111.7K64 S69 F70 F71 L96 L97K64-A67 WeakPolarHBondContact O-CB 3.48Å; K64-A67 PolarHBondContact O-N 3.41Å; A67-S69 VanDerWaalsContact C-N 3.32Å; A67-S69 PolarHBondContact O-N 2.83Å; A67-F70 PolarHBondContact O-N 3.4Å; A67-F71 PolarHBondContact O-N 2.93Å; A67-L96 HydrophobicContact CB-CB 3.7Å; A67-L96 HydrophobicContact CB-CD2 3.95Å; A67-L96 HydrophobicContact CB-CG 4.05Å; A67-L97 HydrophobicContact CB-CB 4.3Å; A67-L97 HydrophobicContact CB-CG 3.88Å
68T81.1Confident77.6Confident9 Ų966.8 Ų66.86%0.05533%0.327CS..Hα-helixtrans-58.7-43.1175.3-58.70000112.2F59 K64 M65 F70 F71 L72F59-T68 HydrophobicContact CB-CG2 4.23Å; F59-T68 HydrophobicContact CD1-CG2 3.55Å; F59-T68 HydrophobicContact CE1-CG2 4.33Å; F59-T68 HydrophobicContact CG-CG2 4.31Å; F59-T68 WeakPolarHBondContact O-CB 3.43Å; F59-T68 PolarHBondContact O-OG1 2.8Å; K64-T68 PolarHBondContact O-N 3.49Å; K64-T68 PolarHBondContact O-OG1 2.91Å; M65-T68 PolarHBondContact O-N 3.23Å; T68-F70 VanDerWaalsContact C-N 3.34Å; T68-F70 PolarHBondContact O-N 3.4Å; T68-F71 PolarHBondContact O-N 3.48Å; T68-L72 HydrophobicContact CG2-CD1 4.3Å; T68-L72 WeakPolarHBondContact O-CB 3.4Å; T68-L72 PolarHBondContact O-N 3.06Å
69S83.1Confident78.4Confident83 Ų8370.6 Ų70.658%0.5835%0.348SS*.Hα-helixtrans-64.8-36.3177.7-169.70000112.7M65 K66 A67 G73M65-S69 WeakPolarHBondContact O-CB 3.49Å; M65-S69 PolarHBondContact O-N 2.94Å; K66-S69 PolarHBondContact O-N 2.83Å; A67-S69 VanDerWaalsContact C-N 3.32Å; A67-S69 PolarHBondContact O-N 2.83Å; S69-G73 VanDerWaalsContact O-CA 3.25Å; S69-G73 WeakPolarHBondContact O-CA 3.28Å; S69-G73 PolarHBondContact O-N 3.32Å
70F86.2Confident79.4Confident89 Ų8976.2 Ų76.239%0.3938%0.378SS..Hα-helixtrans-70.1-39.1175.5-79.2-64.4000112K66 A67 T68 G74 L89 Y92K66-F70 WeakPolarHBondContact O-CD2 3.42Å; K66-F70 PolarHBondContact O-N 3.32Å; K66-F70 VanDerWaalsContact O-N 3.17Å; A67-F70 PolarHBondContact O-N 3.4Å; T68-F70 VanDerWaalsContact C-N 3.34Å; T68-F70 PolarHBondContact O-N 3.4Å; F70-G74 PolarHBondContact O-N 3.36Å; F70-L89 HydrophobicContact CD1-CD2 4.1Å; F70-L89 HydrophobicContact CE1-CD2 4.49Å; F70-Y92 HydrophobicContact CB-CD1 4.44Å; F70-Y92 HydrophobicContact CD2-CD1 4.39Å; F70-Y92 HydrophobicContact CD2-CE1 4.14Å; F70-Y92 HydrophobicContact CE2-CE1 4.33Å; F70-Y92 HydrophobicContact CG-CD1 4.21Å; F70-Y92 HydrophobicContact CG-CE1 4.4Å
71F86.6Confident80.3Confident5 Ų571.1 Ų71.12%0.02236%0.36CS..Hα-helixtrans-69.2-55.1177.6178.7-100.2000111.9F42 V43 F59 A67 T68 G73 G74 V75 F94 L97F42-F71 HydrophobicContact CD1-CE2 4.43Å; F42-F71 HydrophobicContact CD1-CZ 4.03Å; F42-F71 HydrophobicContact CE1-CE2 4.22Å; F42-F71 HydrophobicContact CE1-CZ 4.14Å; V43-F71 HydrophobicContact CG2-CE1 3.6Å; V43-F71 HydrophobicContact CG2-CZ 3.78Å; F59-F71 AromaticContact CE1-CD1 3.8Å; F59-F71 HydrophobicContact CE1-CD1 3.8Å; F59-F71 HydrophobicContact CE1-CE1 4.11Å; F59-F71 HydrophobicContact CZ-CD1 4.18Å; F59-F71 HydrophobicContact CZ-CE1 4.18Å; A67-F71 PolarHBondContact O-N 2.93Å; T68-F71 PolarHBondContact O-N 3.48Å; F71-G73 VanDerWaalsContact C-N 3.3Å; F71-G73 PolarHBondContact O-N 2.82Å; F71-G74 PolarHBondContact O-N 3.43Å; F71-V75 HydrophobicContact CE1-CG2 4.37Å; F71-V75 HydrophobicContact CZ-CG2 4.43Å; F71-V75 WeakPolarHBondContact O-CG2 3.46Å; F71-V75 PolarHBondContact O-N 3.38Å; F71-F94 HydrophobicContact CD2-CB 3.86Å; F71-F94 HydrophobicContact CD2-CD2 4.35Å; F71-F94 HydrophobicContact CE2-CB 4.16Å; F71-F94 HydrophobicContact CE2-CD2 4.02Å; F71-L97 HydrophobicContact CB-CD1 3.66Å; F71-L97 HydrophobicContact CD1-CD1 4.2Å; F71-L97 HydrophobicContact CG-CD1 3.98Å
72L86.6Confident81.4Confident87 Ų8774.5 Ų74.546%0.45537%0.368SS..Hα-helixtrans-62.5-38.8176.1-11287.2000111.7F59 T68 G74 V75 L76F59-L72 HydrophobicContact CD1-CD1 4.27Å; F59-L72 HydrophobicContact CE1-CD1 4.16Å; T68-L72 HydrophobicContact CG2-CD1 4.3Å; T68-L72 WeakPolarHBondContact O-CB 3.4Å; T68-L72 PolarHBondContact O-N 3.06Å; L72-G74 VanDerWaalsContact C-N 3.33Å; L72-V75 PolarHBondContact O-N 2.96Å; L72-L76 WeakPolarHBondContact O-CG 3.44Å; L72-L76 PolarHBondContact O-N 2.88Å
73G89.2Confident82.6Confident24 Ų2465.7 Ų65.725%0.24733%0.331CS..Hα-helixtrans-62.4-41175.600000111.9S69 F71 L76 I77S69-G73 VanDerWaalsContact O-CA 3.25Å; S69-G73 WeakPolarHBondContact O-CA 3.28Å; S69-G73 PolarHBondContact O-N 3.32Å; F71-G73 VanDerWaalsContact C-N 3.3Å; F71-G73 PolarHBondContact O-N 2.82Å; G73-L76 PolarHBondContact O-N 3.44Å; G73-I77 WeakPolarHBondContact O-CD1 3.47Å; G73-I77 VanDerWaalsContact O-CG1 3.22Å; G73-I77 WeakPolarHBondContact O-CG1 3.33Å; G73-I77 PolarHBondContact O-N 3.31Å
74G87.8Confident83.9Confident0 Ų062.3 Ų62.30%032%0.318CS..Hα-helixtrans-59.5-48172.700000112.2F70 F71 L72 L76 I77 V78 G86 E90F70-G74 PolarHBondContact O-N 3.36Å; F71-G74 PolarHBondContact O-N 3.43Å; L72-G74 VanDerWaalsContact C-N 3.33Å; G74-L76 VanDerWaalsContact C-N 3.32Å; G74-L76 PolarHBondContact O-N 2.93Å; G74-I77 PolarHBondContact O-N 2.89Å; G74-I77 VanDerWaalsContact O-N 3.09Å; G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 2.8Å; G74-G86 WeakPolarHBondContact O-CA 3.37Å; G74-E90 VanDerWaalsContact C-CG 3.47Å
75V87.1Confident85Confident24 Ų2463.5 Ų63.515%0.14533%0.329CS..Hα-helixtrans-55.8-46.9174.8177.60000110.9N39 F71 L72 I77 V78 L79 E90N39-V75 HydrophobicContact CB-CG1 4.19Å; N39-V75 HydrophobicContact CB-CG2 4.31Å; F71-V75 HydrophobicContact CE1-CG2 4.37Å; F71-V75 HydrophobicContact CZ-CG2 4.43Å; F71-V75 WeakPolarHBondContact O-CG2 3.46Å; F71-V75 PolarHBondContact O-N 3.38Å; L72-V75 PolarHBondContact O-N 2.96Å; V75-I77 VanDerWaalsContact C-N 3.33Å; V75-I77 PolarHBondContact O-N 2.84Å; V75-V78 WeakPolarHBondContact O-CB 3.41Å; V75-V78 PolarHBondContact O-N 3.45Å; V75-L79 HydrophobicContact CG1-CD1 4.25Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 2.84Å; V75-E90 WeakPolarHBondContact CA-OE1 3.47Å; V75-E90 HydrophobicContact CG2-CG 4.31Å; V75-E90 WeakPolarHBondContact CG2-OE1 3.46Å; V75-E90 PolarHBondContact N-OE1 3.3Å
76L88.1Confident86Confident96 Ų9659.8 Ų59.850%0.50331%0.31SS..Hα-helixtrans-62.7-38.8178.1-70.2175000112.1L72 G73 G74 L79 I80L72-L76 WeakPolarHBondContact O-CG 3.44Å; L72-L76 PolarHBondContact O-N 2.88Å; G73-L76 PolarHBondContact O-N 3.44Å; G74-L76 VanDerWaalsContact C-N 3.32Å; G74-L76 PolarHBondContact O-N 2.93Å; L76-L79 WeakPolarHBondContact O-CB 3.29Å; L76-L79 PolarHBondContact O-N 3.02Å; L76-I80 WeakPolarHBondContact O-CB 3.12Å; L76-I80 WeakPolarHBondContact O-CD1 3.34Å; L76-I80 VanDerWaalsContact O-CG1 3.22Å; L76-I80 WeakPolarHBondContact O-CG1 3.46Å; L76-I80 PolarHBondContact O-N 2.93Å
77I89.6Confident86.6Confident50 Ų5052.6 Ų52.626%0.25628%0.28SS..Hα-helixtrans-68.1-37.3178.3-70.8164.9000111.4G73 G74 V75 L79 I80 G81 W82 V85 L89G73-I77 WeakPolarHBondContact O-CD1 3.47Å; G73-I77 VanDerWaalsContact O-CG1 3.22Å; G73-I77 WeakPolarHBondContact O-CG1 3.33Å; G73-I77 PolarHBondContact O-N 3.31Å; G74-I77 PolarHBondContact O-N 2.89Å; G74-I77 VanDerWaalsContact O-N 3.09Å; V75-I77 VanDerWaalsContact C-N 3.33Å; V75-I77 PolarHBondContact O-N 2.84Å; I77-L79 VanDerWaalsContact C-N 3.31Å; I77-L79 PolarHBondContact O-N 3.38Å; I77-I80 PolarHBondContact O-N 3.24Å; I77-G81 PolarHBondContact O-N 2.88Å; I77-W82 HydrophobicContact CG2-CB 3.76Å; I77-W82 WeakPolarHBondContact CG2-O 3.36Å; I77-W82 PolarHBondContact O-N 3.33Å; I77-W82 VanDerWaalsContact O-N 3.07Å; I77-V85 HydrophobicContact CG2-CB 4.24Å; I77-V85 HydrophobicContact CG2-CG1 4.32Å; I77-L89 HydrophobicContact CD1-CD1 3.3Å
78V86.7Confident87.1Confident1 Ų157 Ų571%0.00631%0.307CS..Hα-helixtrans-58.3-46.2170.2174.90000110.2L35 G74 V75 G81 P83 V87 E90L35-V78 HydrophobicContact CB-CG1 3.66Å; L35-V78 HydrophobicContact CD1-CG1 4.33Å; G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 2.8Å; V75-V78 WeakPolarHBondContact O-CB 3.41Å; V75-V78 PolarHBondContact O-N 3.45Å; V78-G81 PolarHBondContact O-N 3.01Å; V78-P83 HydrophobicContact CG1-CB 4.4Å; V78-V87 HydrophobicContact CG2-CG2 4.31Å; V78-E90 WeakPolarHBondContact CG2-OE2 3.46Å
79L83.3Confident87.6Confident101 Ų10158.8 Ų58.853%0.52932%0.316SS..Hα-helixtrans-67-36.7179.9-66.7173.6000113.4A36 V75 L76 I77 G81A36-L79 HydrophobicContact CB-CD2 3.49Å; A36-L79 VanDerWaalsContact CB-CD2 3.49Å; V75-L79 HydrophobicContact CG1-CD1 4.25Å; V75-L79 WeakPolarHBondContact O-CG 3.42Å; V75-L79 PolarHBondContact O-N 2.84Å; L76-L79 WeakPolarHBondContact O-CB 3.29Å; L76-L79 PolarHBondContact O-N 3.02Å; I77-L79 VanDerWaalsContact C-N 3.31Å; I77-L79 PolarHBondContact O-N 3.38Å; L79-G81 PolarHBondContact O-N 3.34Å
80I85.4Confident87.9Confident135 Ų13555.3 Ų55.369%0.69229%0.29SS*.Hα-helixtrans-69.2-18.6176.8-69.9163.4000111.5L76 I77L76-I80 WeakPolarHBondContact O-CB 3.12Å; L76-I80 WeakPolarHBondContact O-CD1 3.34Å; L76-I80 VanDerWaalsContact O-CG1 3.22Å; L76-I80 WeakPolarHBondContact O-CG1 3.46Å; L76-I80 PolarHBondContact O-N 2.93Å; I77-I80 PolarHBondContact O-N 3.24Å
81G82.5Confident87.9Confident16 Ų1655.5 Ų55.517%0.16530%0.298CS..THydrogen-bonded Turntrans109.419.5170.400000115K32 I77 V78 L79 P83K32-G81 WeakPolarHBondContact CE-O 3.32Å; K32-G81 PolarHBondContact NZ-O 3.1Å; I77-G81 PolarHBondContact O-N 2.88Å; V78-G81 PolarHBondContact O-N 3.01Å; L79-G81 PolarHBondContact O-N 3.34Å; G81-P83 WeakPolarHBondContact O-CD 3.34Å
82W88.3Confident88Confident179 Ų17961.1 Ų61.168%0.67832%0.32SS*.  trans-110.465.2169.8-75.158.4000110.2I77 I84 V85 G86I77-W82 HydrophobicContact CG2-CB 3.76Å; I77-W82 WeakPolarHBondContact CG2-O 3.36Å; I77-W82 PolarHBondContact O-N 3.33Å; I77-W82 VanDerWaalsContact O-N 3.07Å; W82-I84 VanDerWaalsContact C-N 3.31Å; W82-I84 PolarHBondContact O-N 3.35Å; W82-V85 HydrophobicContact CE3-CG2 3.96Å; W82-V85 PolarHBondContact O-N 2.97Å; W82-G86 PolarHBondContact O-N 3.32Å
83P86.3Confident88Confident16 Ų1657 Ų5710%0.10430%0.299CS..Hα-helixtrans-64.5-32.7-167.527.5-37.1000113.4F30 K32 L35 V78 G81 G86 V87F30-P83 HydrophobicContact CB-CB 4Å; F30-P83 HydrophobicContact CB-CG 3.9Å; F30-P83 WeakPolarHBondContact O-CG 3.17Å; K32-P83 HydrophobicContact CG-CB 4.31Å; K32-P83 HydrophobicContact CG-CG 3.97Å; L35-P83 HydrophobicContact CD1-CB 3.62Å; V78-P83 HydrophobicContact CG1-CB 4.4Å; G81-P83 WeakPolarHBondContact O-CD 3.34Å; P83-G86 PolarHBondContact O-N 2.81Å; P83-V87 WeakPolarHBondContact O-CB 3.49Å; P83-V87 VanDerWaalsContact O-CG2 3.26Å; P83-V87 WeakPolarHBondContact O-CG2 3.35Å; P83-V87 PolarHBondContact O-N 3.39Å
84I88.4Confident87.8Confident104 Ų10458.8 Ų58.853%0.53330%0.3SS..Hα-helixtrans-63.4-50.5178.3-59.3174.1000110.8F30 W82 G86 V88F30-I84 HydrophobicContact CB-CG1 4.37Å; F30-I84 HydrophobicContact CD1-CG1 4.14Å; F30-I84 HydrophobicContact CD2-CD1 4.47Å; F30-I84 HydrophobicContact CD2-CG1 3.89Å; F30-I84 HydrophobicContact CE1-CG1 4.41Å; F30-I84 HydrophobicContact CE2-CG1 4.18Å; F30-I84 HydrophobicContact CG-CG1 3.88Å; F30-I84 HydrophobicContact CZ-CG1 4.42Å; W82-I84 VanDerWaalsContact C-N 3.31Å; W82-I84 PolarHBondContact O-N 3.35Å; I84-G86 VanDerWaalsContact C-N 3.33Å; I84-V88 WeakPolarHBondContact O-CG2 3.27Å; I84-V88 PolarHBondContact O-N 3.18Å
85V90.9Very high87.6Confident67 Ų6765.4 Ų65.441%0.40633%0.329SS..Hα-helixtrans-66.6-40.2178.7179.40000110.4I77 W82 V88 L89I77-V85 HydrophobicContact CG2-CB 4.24Å; I77-V85 HydrophobicContact CG2-CG1 4.32Å; W82-V85 HydrophobicContact CE3-CG2 3.96Å; W82-V85 PolarHBondContact O-N 2.97Å; V85-V88 PolarHBondContact O-N 2.9Å; V85-L89 HydrophobicContact CG1-CD1 4.03Å; V85-L89 WeakPolarHBondContact O-CG 3.47Å; V85-L89 PolarHBondContact O-N 2.89Å
86G90.5Very high87.3Confident0 Ų066.7 Ų66.70%034%0.335CS..Hα-helixtrans-56.6-54176.100000111.9G74 W82 P83 I84 V88 L89 E90G74-G86 WeakPolarHBondContact O-CA 3.37Å; W82-G86 PolarHBondContact O-N 3.32Å; P83-G86 PolarHBondContact O-N 2.81Å; I84-G86 VanDerWaalsContact C-N 3.33Å; G86-V88 VanDerWaalsContact C-N 3.32Å; G86-V88 PolarHBondContact O-N 3.28Å; G86-L89 CarbonylContact O-C 3.53Å; G86-L89 PolarHBondContact O-N 3.14Å; G86-L89 VanDerWaalsContact O-N 3.09Å; G86-E90 VanDerWaalsContact O-CG 3.29Å; G86-E90 WeakPolarHBondContact O-CG 3.45Å; G86-E90 PolarHBondContact O-N 3.49Å
87V90.2Very high86.8Confident15 Ų1562.1 Ų62.19%0.09131%0.311CS..Hα-helixtrans-59.2-40.2179.7168.80000112.1M26 F30 L35 V78 P83 L89 E90 V91M26-V87 HydrophobicContact SD-CG1 3.94Å; F30-V87 HydrophobicContact CD1-CG2 4.21Å; F30-V87 HydrophobicContact CE1-CB 4.29Å; F30-V87 HydrophobicContact CE1-CG1 4.33Å; F30-V87 HydrophobicContact CE1-CG2 4.33Å; L35-V87 HydrophobicContact CD1-CG2 3.98Å; L35-V87 HydrophobicContact CD2-CG2 3.97Å; V78-V87 HydrophobicContact CG2-CG2 4.31Å; P83-V87 WeakPolarHBondContact O-CB 3.49Å; P83-V87 VanDerWaalsContact O-CG2 3.26Å; P83-V87 WeakPolarHBondContact O-CG2 3.35Å; P83-V87 PolarHBondContact O-N 3.39Å; V87-L89 PolarHBondContact O-N 3.17Å; V87-E90 PolarHBondContact O-N 3.23Å; V87-V91 HydrophobicContact CG1-CG2 4.34Å; V87-V91 VanDerWaalsContact O-CG2 3.31Å; V87-V91 WeakPolarHBondContact O-CG2 3.34Å; V87-V91 PolarHBondContact O-N 2.91Å
88V91.4Very high85.9Confident97 Ų9760.6 Ų60.659%0.58830%0.302SS*.Hα-helixtrans-62.3-44.8176.6172.80000111.2I84 V85 G86 Y92I84-V88 WeakPolarHBondContact O-CG2 3.27Å; I84-V88 PolarHBondContact O-N 3.18Å; V85-V88 PolarHBondContact O-N 2.9Å; G86-V88 VanDerWaalsContact C-N 3.32Å; G86-V88 PolarHBondContact O-N 3.28Å; V88-Y92 WeakPolarHBondContact O-CB 3.31Å; V88-Y92 PolarHBondContact O-N 3.26Å
89L91.2Very high85.1Confident45 Ų4569.6 Ų69.624%0.23634%0.336CS..Hα-helixtrans-67.6-36.5176.9-69.6172.8000112.2F70 I77 V85 G86 V87 Y92 G93F70-L89 HydrophobicContact CD1-CD2 4.1Å; F70-L89 HydrophobicContact CE1-CD2 4.49Å; I77-L89 HydrophobicContact CD1-CD1 3.3Å; V85-L89 HydrophobicContact CG1-CD1 4.03Å; V85-L89 WeakPolarHBondContact O-CG 3.47Å; V85-L89 PolarHBondContact O-N 2.89Å; G86-L89 CarbonylContact O-C 3.53Å; G86-L89 PolarHBondContact O-N 3.14Å; G86-L89 VanDerWaalsContact O-N 3.09Å; V87-L89 PolarHBondContact O-N 3.17Å; L89-Y92 PolarHBondContact O-N 2.94Å; L89-G93 PolarHBondContact O-N 2.83Å
90E89.3Confident84.2Confident11 Ų1166.9 Ų66.95%0.05133%0.333CS..Hα-helixtrans-62.5-51.4175.1-74.4179135.800111.4N39 G74 V75 V78 G86 V87 Y92 G93 F94N39-E90 PolarHBondContact ND2-OE1 3Å; N39-E90 PolarHBondContact ND2-OE2 3.35Å; N39-E90 PolarHBondContact OD1-OE1 2.97Å; G74-E90 VanDerWaalsContact C-CG 3.47Å; V75-E90 WeakPolarHBondContact CA-OE1 3.47Å; V75-E90 HydrophobicContact CG2-CG 4.31Å; V75-E90 WeakPolarHBondContact CG2-OE1 3.46Å; V75-E90 PolarHBondContact N-OE1 3.3Å; V78-E90 WeakPolarHBondContact CG2-OE2 3.46Å; G86-E90 VanDerWaalsContact O-CG 3.29Å; G86-E90 WeakPolarHBondContact O-CG 3.45Å; G86-E90 PolarHBondContact O-N 3.49Å; V87-E90 PolarHBondContact O-N 3.23Å; E90-Y92 VanDerWaalsContact C-N 3.29Å; E90-Y92 PolarHBondContact O-N 3.38Å; E90-G93 PolarHBondContact O-N 2.96Å; E90-F94 WeakPolarHBondContact O-CA 3.45Å; E90-F94 WeakPolarHBondContact O-CB 3.28Å; E90-F94 PolarHBondContact O-N 3.32Å
91V87.3Confident83.1Confident92 Ų9262.2 Ų62.256%0.55831%0.307SS*.Hα-helixtrans-60-43.3178.7172.80000110.1V87 F95V87-V91 HydrophobicContact CG1-CG2 4.34Å; V87-V91 VanDerWaalsContact O-CG2 3.31Å; V87-V91 WeakPolarHBondContact O-CG2 3.34Å; V87-V91 PolarHBondContact O-N 2.91Å; V91-F95 WeakPolarHBondContact O-CB 3.48Å; V91-F95 PolarHBondContact O-N 3.44Å
92Y88.8Confident82Confident124 Ų12466.6 Ų66.649%0.48632%0.322SS..Hα-helixtrans-63-50.8176.8-177.7-105.5000112.4F70 V88 L89 E90 F94 F95 L96F70-Y92 HydrophobicContact CB-CD1 4.44Å; F70-Y92 HydrophobicContact CD2-CD1 4.39Å; F70-Y92 HydrophobicContact CD2-CE1 4.14Å; F70-Y92 HydrophobicContact CE2-CE1 4.33Å; F70-Y92 HydrophobicContact CG-CD1 4.21Å; F70-Y92 HydrophobicContact CG-CE1 4.4Å; V88-Y92 WeakPolarHBondContact O-CB 3.31Å; V88-Y92 PolarHBondContact O-N 3.26Å; L89-Y92 PolarHBondContact O-N 2.94Å; E90-Y92 VanDerWaalsContact C-N 3.29Å; E90-Y92 PolarHBondContact O-N 3.38Å; Y92-F94 VanDerWaalsContact C-N 3.35Å; Y92-F94 PolarHBondContact O-N 3.48Å; Y92-F95 PolarHBondContact O-N 3.4Å; Y92-L96 HydrophobicContact CE1-CD2 4.38Å; Y92-L96 WeakPolarHBondContact O-CB 3.42Å; Y92-L96 PolarHBondContact O-N 2.92Å
93G86Confident80.5Confident0 Ų060.5 Ų60.50%031%0.306CS..Hα-helixtrans-63-41179.400000112.4L89 E90 L96 L97L89-G93 PolarHBondContact O-N 2.83Å; E90-G93 PolarHBondContact O-N 2.96Å; G93-L96 PolarHBondContact O-N 3.46Å; G93-L97 WeakPolarHBondContact O-CB 3.36Å; G93-L97 PolarHBondContact O-N 3.35Å
94F84.3Confident79.1Confident62 Ų6261.8 Ų61.827%0.27232%0.317SS..Hα-helixtrans-60.6-50.3175.5-176.8-100.3000111.1F42 L46 F71 E90 Y92 L96 L97 F98F42-F94 AromaticContact CE1-CD2 3.55Å; F42-F94 HydrophobicContact CE1-CD2 3.55Å; F42-F94 AromaticContact CE1-CE2 3.3Å; F42-F94 HydrophobicContact CE1-CE2 3.3Å; F42-F94 HydrophobicContact CE1-CZ 4.15Å; F42-F94 HydrophobicContact CE2-CE2 4.41Å; F42-F94 AromaticContact CZ-CD2 3.81Å; F42-F94 HydrophobicContact CZ-CD2 3.81Å; F42-F94 HydrophobicContact CZ-CE1 4.43Å; F42-F94 AromaticContact CZ-CE2 3.13Å; F42-F94 HydrophobicContact CZ-CE2 3.13Å; F42-F94 AromaticContact CZ-CZ 3.52Å; F42-F94 HydrophobicContact CZ-CZ 3.52Å; L46-F94 HydrophobicContact CD1-CE2 4.13Å; F71-F94 HydrophobicContact CD2-CB 3.86Å; F71-F94 HydrophobicContact CD2-CD2 4.35Å; F71-F94 HydrophobicContact CE2-CB 4.16Å; F71-F94 HydrophobicContact CE2-CD2 4.02Å; E90-F94 WeakPolarHBondContact O-CA 3.45Å; E90-F94 WeakPolarHBondContact O-CB 3.28Å; E90-F94 PolarHBondContact O-N 3.32Å; Y92-F94 VanDerWaalsContact C-N 3.35Å; Y92-F94 PolarHBondContact O-N 3.48Å; F94-L96 VanDerWaalsContact C-N 3.27Å; F94-L96 PolarHBondContact O-N 2.98Å; F94-L97 WeakPolarHBondContact O-CB 3.39Å; F94-L97 PolarHBondContact O-N 3.41Å; F94-F98 HydrophobicContact CD1-CD2 4.35Å; F94-F98 AromaticContact CD2-CD2 3.54Å; F94-F98 HydrophobicContact CD2-CD2 3.54Å; F94-F98 AromaticContact CD2-CE2 3.5Å; F94-F98 HydrophobicContact CD2-CE2 3.5Å; F94-F98 VanDerWaalsContact CD2-CE2 3.5Å; F94-F98 HydrophobicContact CE1-CD2 4.08Å; F94-F98 HydrophobicContact CE1-CG 4.35Å; F94-F98 AromaticContact CE2-CD2 3.18Å; F94-F98 HydrophobicContact CE2-CD2 3.18Å; F94-F98 HydrophobicContact CE2-CE1 4.41Å; F94-F98 AromaticContact CE2-CE2 2.96Å; F94-F98 HydrophobicContact CE2-CE2 2.96Å; F94-F98 HydrophobicContact CE2-CG 4.05Å; F94-F98 AromaticContact CE2-CZ 3.65Å; F94-F98 HydrophobicContact CE2-CZ 3.65Å; F94-F98 HydrophobicContact CG-CD2 4.1Å; F94-F98 HydrophobicContact CG-CE2 4.48Å; F94-F98 HydrophobicContact CZ-CD1 4.33Å; F94-F98 AromaticContact CZ-CD2 3.48Å; F94-F98 HydrophobicContact CZ-CD2 3.48Å; F94-F98 VanDerWaalsContact CZ-CD2 3.48Å; F94-F98 HydrophobicContact CZ-CE1 4.42Å; F94-F98 AromaticContact CZ-CE2 3.62Å; F94-F98 HydrophobicContact CZ-CE2 3.62Å; F94-F98 AromaticContact CZ-CG 3.88Å; F94-F98 HydrophobicContact CZ-CG 3.88Å; F94-F98 HydrophobicContact CZ-CZ 4.08Å; F94-F98 WeakPolarHBondContact O-CD2 3.17Å; F94-F98 PolarHBondContact O-N 3.36Å
95F83.4Confident77.6Confident138 Ų13858 Ų5861%0.60530%0.302SS*.Hα-helixtrans-60.3-40.2178.6-149.6-92.2000111.6V91 Y92 R99V91-F95 WeakPolarHBondContact O-CB 3.48Å; V91-F95 PolarHBondContact O-N 3.44Å; Y92-F95 PolarHBondContact O-N 3.4Å; F95-R99 WeakPolarHBondContact O-CB 3.29Å; F95-R99 PolarHBondContact O-N 2.95Å
96L82Confident76Confident52 Ų5256.1 Ų56.127%0.27229%0.29SS..Hα-helixtrans-69.6-35.2179.3-145.275.8000112.7A67 Y92 G93 F94A67-L96 HydrophobicContact CB-CB 3.7Å; A67-L96 HydrophobicContact CB-CD2 3.95Å; A67-L96 HydrophobicContact CB-CG 4.05Å; Y92-L96 HydrophobicContact CE1-CD2 4.38Å; Y92-L96 WeakPolarHBondContact O-CB 3.42Å; Y92-L96 PolarHBondContact O-N 2.92Å; G93-L96 PolarHBondContact O-N 3.46Å; F94-L96 VanDerWaalsContact C-N 3.27Å; F94-L96 PolarHBondContact O-N 2.98Å
97L76.2Confident74.5Confident0 Ų057.6 Ų57.60%031%0.306CS..Hα-helixtrans-64.9-53.4173.9-105.6156.2000110F58 F59 A67 F71 G93 F94 R99F58-L97 HydrophobicContact CD1-CD2 4.11Å; F58-L97 HydrophobicContact CE1-CD2 3.78Å; F58-L97 VanDerWaalsContact CZ-O 3.27Å; F58-L97 WeakPolarHBondContact CZ-O 3.36Å; F59-L97 HydrophobicContact CD1-CD1 4.45Å; F59-L97 HydrophobicContact CD2-CD2 4.22Å; F59-L97 HydrophobicContact CE1-CD1 3.84Å; F59-L97 HydrophobicContact CE2-CD2 4.21Å; F59-L97 HydrophobicContact CG-CD2 4.38Å; F59-L97 HydrophobicContact CZ-CD1 3.9Å; F59-L97 HydrophobicContact CZ-CD2 4.34Å; A67-L97 HydrophobicContact CB-CB 4.3Å; A67-L97 HydrophobicContact CB-CG 3.88Å; F71-L97 HydrophobicContact CB-CD1 3.66Å; F71-L97 HydrophobicContact CD1-CD1 4.2Å; F71-L97 HydrophobicContact CG-CD1 3.98Å; G93-L97 WeakPolarHBondContact O-CB 3.36Å; G93-L97 PolarHBondContact O-N 3.35Å; F94-L97 WeakPolarHBondContact O-CB 3.39Å; F94-L97 PolarHBondContact O-N 3.41Å; L97-R99 VanDerWaalsContact C-N 3.35Å; L97-R99 PolarHBondContact O-N 3.49Å
98F71.1Confident72.9Confident18 Ų1859.7 Ų59.78%0.07931%0.314CS..Hα-helixtrans-79-12.1-172.2-79.3-93.9000114.5L46 F94 G100 F101 F102L46-F98 HydrophobicContact CD1-CE2 4.12Å; L46-F98 HydrophobicContact CD1-CZ 3.74Å; L46-F98 HydrophobicContact CD2-CE1 4.09Å; L46-F98 HydrophobicContact CD2-CZ 3.67Å; L46-F98 HydrophobicContact CG-CZ 4.32Å; F94-F98 HydrophobicContact CD1-CD2 4.35Å; F94-F98 AromaticContact CD2-CD2 3.54Å; F94-F98 HydrophobicContact CD2-CD2 3.54Å; F94-F98 AromaticContact CD2-CE2 3.5Å; F94-F98 HydrophobicContact CD2-CE2 3.5Å; F94-F98 VanDerWaalsContact CD2-CE2 3.5Å; F94-F98 HydrophobicContact CE1-CD2 4.08Å; F94-F98 HydrophobicContact CE1-CG 4.35Å; F94-F98 AromaticContact CE2-CD2 3.18Å; F94-F98 HydrophobicContact CE2-CD2 3.18Å; F94-F98 HydrophobicContact CE2-CE1 4.41Å; F94-F98 AromaticContact CE2-CE2 2.96Å; F94-F98 HydrophobicContact CE2-CE2 2.96Å; F94-F98 HydrophobicContact CE2-CG 4.05Å; F94-F98 AromaticContact CE2-CZ 3.65Å; F94-F98 HydrophobicContact CE2-CZ 3.65Å; F94-F98 HydrophobicContact CG-CD2 4.1Å; F94-F98 HydrophobicContact CG-CE2 4.48Å; F94-F98 HydrophobicContact CZ-CD1 4.33Å; F94-F98 AromaticContact CZ-CD2 3.48Å; F94-F98 HydrophobicContact CZ-CD2 3.48Å; F94-F98 VanDerWaalsContact CZ-CD2 3.48Å; F94-F98 HydrophobicContact CZ-CE1 4.42Å; F94-F98 AromaticContact CZ-CE2 3.62Å; F94-F98 HydrophobicContact CZ-CE2 3.62Å; F94-F98 AromaticContact CZ-CG 3.88Å; F94-F98 HydrophobicContact CZ-CG 3.88Å; F94-F98 HydrophobicContact CZ-CZ 4.08Å; F94-F98 WeakPolarHBondContact O-CD2 3.17Å; F94-F98 PolarHBondContact O-N 3.36Å; F98-G100 PolarHBondContact O-N 2.85Å; F98-F101 HydrophobicContact CD1-CB 4.05Å; F98-F101 HydrophobicContact CD1-CD1 4.41Å; F98-F101 HydrophobicContact CE1-CD1 4.25Å; F98-F101 CarbonylContact O-C 3.58Å; F98-F101 WeakPolarHBondContact O-CA 3.49Å; F98-F101 PolarHBondContact O-N 2.82Å; F98-F102 WeakPolarHBondContact O-CD2 3.12Å; F98-F102 PolarHBondContact O-N 3.44Å
99R70.7Confident71.2Confident190 Ų19058 Ų5872%0.71730%0.3SS*.THydrogen-bonded Turntrans-53.9-30.2175.3-172.7173.7167.6-179.4-2.8114F95 L97F95-R99 WeakPolarHBondContact O-CB 3.29Å; F95-R99 PolarHBondContact O-N 2.95Å; L97-R99 VanDerWaalsContact C-N 3.35Å; L97-R99 PolarHBondContact O-N 3.49Å
100G64.2Low69.5Low44 Ų4461.5 Ų61.545%0.45431%0.311SS..THydrogen-bonded Turntrans-92.2-11.917400000114.8F98F98-G100 PolarHBondContact O-N 2.85Å
101F61.9Low67.9Low36 Ų3667.3 Ų67.316%0.15833%0.332CS..THydrogen-bonded Turntrans-103.6-8.7-177.4-141.3-107.9000113I50 F58 F98 P103 A104 A105I50-F101 HydrophobicContact CB-CZ 4.45Å; I50-F101 HydrophobicContact CD1-CD1 4.17Å; I50-F101 HydrophobicContact CD1-CE1 3.54Å; I50-F101 HydrophobicContact CD1-CZ 3.91Å; I50-F101 HydrophobicContact CG1-CE1 3.69Å; I50-F101 HydrophobicContact CG1-CZ 3.98Å; I50-F101 HydrophobicContact CG2-CE1 4.31Å; I50-F101 HydrophobicContact CG2-CZ 3.69Å; F58-F101 HydrophobicContact CD1-CD2 4.31Å; F58-F101 AromaticContact CD2-CD2 3.54Å; F58-F101 HydrophobicContact CD2-CD2 3.54Å; F58-F101 AromaticContact CD2-CE2 3.77Å; F58-F101 HydrophobicContact CD2-CE2 3.77Å; F58-F101 HydrophobicContact CE1-CB 4.16Å; F58-F101 HydrophobicContact CE1-CD2 4.02Å; F58-F101 HydrophobicContact CE1-CG 4.2Å; F58-F101 HydrophobicContact CE2-CB 4.08Å; F58-F101 AromaticContact CE2-CD2 3.21Å; F58-F101 HydrophobicContact CE2-CD2 3.21Å; F58-F101 AromaticContact CE2-CE2 3.95Å; F58-F101 HydrophobicContact CE2-CE2 3.95Å; F58-F101 HydrophobicContact CE2-CG 4.01Å; F58-F101 HydrophobicContact CG-CD2 4.1Å; F58-F101 HydrophobicContact CG-CE2 4.13Å; F58-F101 HydrophobicContact CZ-CB 3.56Å; F58-F101 AromaticContact CZ-CD2 3.49Å; F58-F101 HydrophobicContact CZ-CD2 3.49Å; F58-F101 VanDerWaalsContact CZ-CD2 3.49Å; F58-F101 HydrophobicContact CZ-CE2 4.43Å; F58-F101 AromaticContact CZ-CG 3.81Å; F58-F101 HydrophobicContact CZ-CG 3.81Å; F98-F101 HydrophobicContact CD1-CB 4.05Å; F98-F101 HydrophobicContact CD1-CD1 4.41Å; F98-F101 HydrophobicContact CE1-CD1 4.25Å; F98-F101 CarbonylContact O-C 3.58Å; F98-F101 WeakPolarHBondContact O-CA 3.49Å; F98-F101 PolarHBondContact O-N 2.82Å; F101-P103 VanDerWaalsContact C-CD 3.48Å; F101-A104 HydrophobicContact CD1-CB 4.22Å; F101-A104 HydrophobicContact CE1-CB 4.17Å; F101-A104 HydrophobicContact CG-CB 4.4Å; F101-A104 HydrophobicContact CZ-CB 4.35Å; F101-A104 CarbonylContact O-C 3.52Å; F101-A104 WeakPolarHBondContact O-CB 3.41Å; F101-A104 PolarHBondContact O-N 3.37Å; F101-A105 WeakPolarHBondContact O-CB 3.4Å; F101-A105 PolarHBondContact O-N 3.31Å
102F59.2Low66.4Low108 Ų10864.9 Ų64.947%0.47432%0.316SS..Hα-helixtrans-50.6-45.1178.8-115.8-91.9000113.5F98 A104 A105 V106F98-F102 WeakPolarHBondContact O-CD2 3.12Å; F98-F102 PolarHBondContact O-N 3.44Å; F102-A104 VanDerWaalsContact C-N 3.34Å; F102-A104 PolarHBondContact O-N 3.46Å; F102-A105 PolarHBondContact O-N 3.19Å; F102-V106 HydrophobicContact CD1-CG2 4.23Å; F102-V106 WeakPolarHBondContact O-CB 3.39Å; F102-V106 WeakPolarHBondContact O-CG2 3.44Å; F102-V106 PolarHBondContact O-N 2.74Å
103P57Low64.4Low52 Ų5264.7 Ų64.734%0.33833%0.33SS..Hα-helixtrans-62.6-39.6177-21.632.7000112.8F101 G107F101-P103 VanDerWaalsContact C-CD 3.48Å; P103-G107 PolarHBondContact O-N 2.84Å
104A56.6Low62.9Low42 Ų4272.9 Ų72.935%0.34737%0.366SS..Hα-helixtrans-69.6-43.2176.400000111.5F101 F102 G107 F108F101-A104 HydrophobicContact CD1-CB 4.22Å; F101-A104 HydrophobicContact CE1-CB 4.17Å; F101-A104 HydrophobicContact CG-CB 4.4Å; F101-A104 HydrophobicContact CZ-CB 4.35Å; F101-A104 CarbonylContact O-C 3.52Å; F101-A104 WeakPolarHBondContact O-CB 3.41Å; F101-A104 PolarHBondContact O-N 3.37Å; F102-A104 VanDerWaalsContact C-N 3.34Å; F102-A104 PolarHBondContact O-N 3.46Å; A104-G107 PolarHBondContact O-N 3.03Å; A104-F108 WeakPolarHBondContact O-CD2 3.45Å; A104-F108 PolarHBondContact O-N 3.24Å
105A57Low61.3Low26 Ų2673.8 Ų73.822%0.21537%0.373CS..Hα-helixtrans-62.8-43.7176.900000111.8F101 F102 F108 I109F101-A105 WeakPolarHBondContact O-CB 3.4Å; F101-A105 PolarHBondContact O-N 3.31Å; F102-A105 PolarHBondContact O-N 3.19Å; A105-F108 WeakPolarHBondContact O-CB 3.4Å; A105-F108 PolarHBondContact O-N 2.95Å; A105-I109 WeakPolarHBondContact O-CB 3.25Å; A105-I109 VanDerWaalsContact O-CG1 3.27Å; A105-I109 WeakPolarHBondContact O-CG1 3.42Å; A105-I109 PolarHBondContact O-N 2.92Å
106V56.8Low59.7Low26 Ų2668 Ų6816%0.15835%0.352CS..Hα-helixtrans-65.3-39.9174.8173.10000111.1F102 F108 I109 R110 V128F102-V106 HydrophobicContact CD1-CG2 4.23Å; F102-V106 WeakPolarHBondContact O-CB 3.39Å; F102-V106 WeakPolarHBondContact O-CG2 3.44Å; F102-V106 PolarHBondContact O-N 2.74Å; V106-F108 VanDerWaalsContact C-N 3.27Å; V106-F108 PolarHBondContact O-N 3.14Å; V106-I109 PolarHBondContact O-N 2.79Å; V106-R110 HydrophobicContact CG1-CG 4.49Å; V106-R110 WeakPolarHBondContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CG 3.32Å; V106-R110 PolarHBondContact O-N 2.79Å; V106-V128 HydrophobicContact CG1-CG1 3.59Å; V106-V128 HydrophobicContact CG1-CG2 4.48Å
107G59.4Low58.4Low31 Ų3169.8 Ų69.832%0.3237%0.369SS..Hα-helixtrans-62.1-32172.200000113.6P103 A104 R111P103-G107 PolarHBondContact O-N 2.84Å; A104-G107 PolarHBondContact O-N 3.03Å; G107-R111 WeakPolarHBondContact O-CD 3.3Å; G107-R111 VanDerWaalsContact O-CG 3.29Å; G107-R111 WeakPolarHBondContact O-CG 3.37Å; G107-R111 PolarHBondContact O-NE 3.39Å
108F56.8Low57.2Low60 Ų6074.4 Ų74.426%0.26339%0.393SS..Hα-helixtrans-76.4-42.5172.4-95.5-79.8000112.7A104 A105 V106 R110 R111A104-F108 WeakPolarHBondContact O-CD2 3.45Å; A104-F108 PolarHBondContact O-N 3.24Å; A105-F108 WeakPolarHBondContact O-CB 3.4Å; A105-F108 PolarHBondContact O-N 2.95Å; V106-F108 VanDerWaalsContact C-N 3.27Å; V106-F108 PolarHBondContact O-N 3.14Å; F108-R110 PolarHBondContact O-N 3.05Å; F108-R111 VanDerWaalsContact O-CB 3.32Å; F108-R111 WeakPolarHBondContact O-CB 3.47Å; F108-R111 PolarHBondContact O-N 3.16Å
109I56.3Low56.2Low60 Ų6075.1 Ų75.131%0.30840%0.397SS..Hα-helixtrans-66.3-38.8179.4-70.1164.3000111A105 V106 R111 I112 L115 L119A105-I109 WeakPolarHBondContact O-CB 3.25Å; A105-I109 VanDerWaalsContact O-CG1 3.27Å; A105-I109 WeakPolarHBondContact O-CG1 3.42Å; A105-I109 PolarHBondContact O-N 2.92Å; V106-I109 PolarHBondContact O-N 2.79Å; I109-R111 PolarHBondContact O-N 3.15Å; I109-R111 VanDerWaalsContact O-N 3.16Å; I109-I112 PolarHBondContact O-N 3.04Å; I109-L115 HydrophobicContact CG2-CB 3.71Å; I109-L115 HydrophobicContact CG2-CD1 4.46Å; I109-L119 HydrophobicContact CB-CD1 4.1Å; I109-L119 HydrophobicContact CG2-CD1 3.15Å
110R55.2Low55.3Low120 Ų12072.2 Ų72.245%0.45340%0.396SS..THydrogen-bonded Turntrans-60.6-19.2171.6-80-179.9169.1179.4-9113.2V106 F108 D129V106-R110 HydrophobicContact CG1-CG 4.49Å; V106-R110 WeakPolarHBondContact O-CB 3.29Å; V106-R110 WeakPolarHBondContact O-CG 3.32Å; V106-R110 PolarHBondContact O-N 2.79Å; F108-R110 PolarHBondContact O-N 3.05Å; R110-D129 IonicContact NH2-OD1 3.74Å; R110-D129 PolarHBondContact NH2-OD1 2.74Å; R110-D129 VanDerWaalsContact NH2-OD1 3.14Å
111R54.7Low55Low132 Ų13274.4 Ų74.450%0.49840%0.397SS..THydrogen-bonded Turntrans-84.6-9.5175.9-66.3167.9-173.4-153.3-2.4113.4G107 F108 I109G107-R111 WeakPolarHBondContact O-CD 3.3Å; G107-R111 VanDerWaalsContact O-CG 3.29Å; G107-R111 WeakPolarHBondContact O-CG 3.37Å; G107-R111 PolarHBondContact O-NE 3.39Å; F108-R111 VanDerWaalsContact O-CB 3.32Å; F108-R111 WeakPolarHBondContact O-CB 3.47Å; F108-R111 PolarHBondContact O-N 3.16Å; I109-R111 PolarHBondContact O-N 3.15Å; I109-R111 VanDerWaalsContact O-N 3.16Å
112I56.9Low54.5Low42 Ų4278.2 Ų78.222%0.21543%0.426CS..SBendtrans-93.9112.5175.9-57.6168.2000107.3M12 I109 F114 L115 G116M12-I112 HydrophobicContact SD-CD1 3.47Å; M12-I112 WeakPolarHBondContact SD-CD1 3.41Å; M12-I112 HydrophobicContact SD-CG1 4.11Å; I109-I112 PolarHBondContact O-N 3.04Å; I112-F114 PolarHBondContact O-N 3.03Å; I112-L115 HydrophobicContact CB-CB 4.28Å; I112-L115 HydrophobicContact CB-CD1 4.33Å; I112-L115 HydrophobicContact CD1-CD1 3.79Å; I112-L115 HydrophobicContact CG2-CB 4.36Å; I112-L115 HydrophobicContact CG2-CD1 4.13Å; I112-L115 HydrophobicContact CG2-CG 4.46Å; I112-L115 PolarHBondContact O-N 3.5Å; I112-L115 VanDerWaalsContact O-N 3.15Å; I112-G116 PolarHBondContact O-N 3.34Å
113P46.5Very low54.3Low120 Ų12082.1 Ų82.178%0.77944%0.442SS*.Hα-helixtrans-59.4-25.6-170.419.7-31000114.1
114F53.8Low54.1Low172 Ų17282.7 Ų82.775%0.75444%0.442SS*.Hα-helixtrans-81.9-39.4178.2-149.7-95000113.6I112I112-F114 PolarHBondContact O-N 3.03Å
115L50.9Low53.9Low80 Ų8082.1 Ų82.142%0.41944%0.436SS..Hα-helixtrans-83.3-27.4177.1-73.5158.7000112.4I109 I112 S117 L118 L119I109-L115 HydrophobicContact CG2-CB 3.71Å; I109-L115 HydrophobicContact CG2-CD1 4.46Å; I112-L115 HydrophobicContact CB-CB 4.28Å; I112-L115 HydrophobicContact CB-CD1 4.33Å; I112-L115 HydrophobicContact CD1-CD1 3.79Å; I112-L115 HydrophobicContact CG2-CB 4.36Å; I112-L115 HydrophobicContact CG2-CD1 4.13Å; I112-L115 HydrophobicContact CG2-CG 4.46Å; I112-L115 PolarHBondContact O-N 3.5Å; I112-L115 VanDerWaalsContact O-N 3.15Å; L115-S117 VanDerWaalsContact C-N 3.34Å; L115-L118 PolarHBondContact O-N 2.88Å; L115-L119 PolarHBondContact O-N 3.45Å; L115-L119 VanDerWaalsContact O-N 3.1Å
116G50.5Low54Low16 Ų1683.2 Ų83.217%0.16545%0.45CS..Hα-helixtrans-63.9-36.7174.400000112.6I112 L119 N120I112-G116 PolarHBondContact O-N 3.34Å; G116-L119 PolarHBondContact O-N 2.85Å; G116-N120 WeakPolarHBondContact O-CB 3.2Å; G116-N120 PolarHBondContact O-N 3.28Å
117S53.7Low54.1Low90 Ų9089.8 Ų89.863%0.62948%0.476SS*.Hα-helixtrans-67.9-36.1176-155.10000112.4L115 N120L115-S117 VanDerWaalsContact C-N 3.34Å; S117-N120 PolarHBondContact O-N 3.43Å
118L52.1Low54.1Low98 Ų9889.2 Ų89.251%0.51347%0.466SS..Hα-helixtrans-66.4-36.9173.1-103.5150.8000112.6L115 N120 L121L115-L118 PolarHBondContact O-N 2.88Å; L118-N120 VanDerWaalsContact C-N 3.35Å; L118-L121 HydrophobicContact CD2-CD1 4.24Å; L118-L121 WeakPolarHBondContact O-CD1 3.12Å
119L50.7Low54.3Low32 Ų3290.2 Ų90.217%0.16848%0.475CS..Hα-helixtrans-78.5-15.4175.7-93146.8000114.2I109 L115 G116 L121 I124 V128I109-L119 HydrophobicContact CB-CD1 4.1Å; I109-L119 HydrophobicContact CG2-CD1 3.15Å; L115-L119 PolarHBondContact O-N 3.45Å; L115-L119 VanDerWaalsContact O-N 3.1Å; G116-L119 PolarHBondContact O-N 2.85Å; L119-L121 VanDerWaalsContact C-N 3.32Å; L119-I124 HydrophobicContact CD2-CG2 3.59Å; L119-I124 HydrophobicContact CG-CG2 4.41Å; L119-V128 HydrophobicContact CD2-CG2 3.75Å
120N51.7Low54.4Low130 Ų13094.7 Ų94.770%0.69549%0.492SS*.THydrogen-bonded Turntrans-938.7176.7-141.78.2000112.6G116 S117 L118G116-N120 WeakPolarHBondContact O-CB 3.2Å; G116-N120 PolarHBondContact O-N 3.28Å; S117-N120 PolarHBondContact O-N 3.43Å; L118-N120 VanDerWaalsContact C-N 3.35Å
121L57.6Low54.6Low89 Ų8992.5 Ų92.547%0.46649%0.491SS..SBendtrans-65.8137167.4-79.7162.1000109.1L118 L119 F123 I124 S125L118-L121 HydrophobicContact CD2-CD1 4.24Å; L118-L121 WeakPolarHBondContact O-CD1 3.12Å; L119-L121 VanDerWaalsContact C-N 3.32Å; L121-F123 PolarHBondContact O-N 2.9Å; L121-I124 PolarHBondContact O-N 3.48Å; L121-S125 PolarHBondContact O-N 3.39Å
122P51.4Low54.5Low117 Ų11788 Ų8876%0.7649%0.487SS*.THydrogen-bonded Turntrans-59.5-13.3-171.421.9-33.2000114.5S125P122-S125 PolarHBondContact O-OG 3.42Å
123F53.8Low54.3Low189 Ų18992.6 Ų92.683%0.82951%0.507SS*.THydrogen-bonded Turntrans-83-26.7176.8-165.2-102.7000113.8L121L121-F123 PolarHBondContact O-N 2.9Å
124I53.3Low54.4Low64 Ų6491 Ų9133%0.32850%0.499SS..THydrogen-bonded Turntrans-103-25.3-174.1-62169.7000111.6L119 L121 G126 F127 V128L119-I124 HydrophobicContact CD2-CG2 3.59Å; L119-I124 HydrophobicContact CG-CG2 4.41Å; L121-I124 PolarHBondContact O-N 3.48Å; I124-G126 VanDerWaalsContact C-N 3.34Å; I124-G126 PolarHBondContact O-N 2.88Å; I124-F127 PolarHBondContact O-N 3.32Å; I124-V128 HydrophobicContact CG2-CG2 3.97Å; I124-V128 WeakPolarHBondContact O-CG2 3.24Å; I124-V128 PolarHBondContact O-N 2.89Å
125S52.9Low54.1Low31 Ų3187.8 Ų87.822%0.21749%0.49CS..Hα-helixtrans-55.6-44.5178.251.10000112.7L121 P122 F127 V128 D129L121-S125 PolarHBondContact O-N 3.39Å; P122-S125 PolarHBondContact O-OG 3.42Å; S125-F127 VanDerWaalsContact C-N 3.35Å; S125-F127 PolarHBondContact O-N 3.17Å; S125-V128 PolarHBondContact O-N 3.18Å; S125-D129 WeakPolarHBondContact O-CB 3.34Å; S125-D129 PolarHBondContact O-N 3.12Å
126G58.3Low53.8Low49 Ų4989.3 Ų89.351%0.50550%0.503SS..Hα-helixtrans-63.8-32.8-17900000114.9I124 K130I124-G126 VanDerWaalsContact C-N 3.34Å; I124-G126 PolarHBondContact O-N 2.88Å; G126-K130 WeakPolarHBondContact O-CB 3.37Å; G126-K130 PolarHBondContact O-N 3.06Å
127F58.9Low53.3Low163 Ų16396.7 Ų96.772%0.71554%0.535SS*.Hα-helixtrans-76.3-36.7175.1-99.2-88.5000112I124 S125 V131I124-F127 PolarHBondContact O-N 3.32Å; S125-F127 VanDerWaalsContact C-N 3.35Å; S125-F127 PolarHBondContact O-N 3.17Å; F127-V131 WeakPolarHBondContact O-CG2 3.47Å; F127-V131 PolarHBondContact O-N 3.28Å
128V59.3Low52.6Low19 Ų19102 Ų10212%0.11556%0.563CS.*Hα-helixtrans-71.3-39179.4-179.90000111.3V106 L119 I124 S125 K130 V131 G132V106-V128 HydrophobicContact CG1-CG1 3.59Å; V106-V128 HydrophobicContact CG1-CG2 4.48Å; L119-V128 HydrophobicContact CD2-CG2 3.75Å; I124-V128 HydrophobicContact CG2-CG2 3.97Å; I124-V128 WeakPolarHBondContact O-CG2 3.24Å; I124-V128 PolarHBondContact O-N 2.89Å; S125-V128 PolarHBondContact O-N 3.18Å; V128-K130 VanDerWaalsContact C-N 3.34Å; V128-K130 PolarHBondContact O-N 3.01Å; V128-V131 PolarHBondContact O-N 3.38Å; V128-G132 PolarHBondContact O-N 3.25Å
129D61.2Low52.6Low82 Ų82102.3 Ų102.344%0.43957%0.566SS.*Hα-helixtrans-69.7-34.9-179.2-65.3-19.8000111.4R110 S125 V131 G132 E133R110-D129 IonicContact NH2-OD1 3.74Å; R110-D129 PolarHBondContact NH2-OD1 2.74Å; R110-D129 VanDerWaalsContact NH2-OD1 3.14Å; S125-D129 WeakPolarHBondContact O-CB 3.34Å; S125-D129 PolarHBondContact O-N 3.12Å; D129-V131 VanDerWaalsContact C-N 3.33Å; D129-V131 PolarHBondContact O-N 2.83Å; D129-G132 PolarHBondContact O-N 2.9Å; D129-E133 PolarHBondContact O-N 3.06Å
130K59Low52.8Low154 Ų154105.9 Ų105.967%0.6759%0.587SS**Hα-helixtrans-66.7-31.2174.2-160.3168-174.7167.70113.7G126 V128 S134G126-K130 WeakPolarHBondContact O-CB 3.37Å; G126-K130 PolarHBondContact O-N 3.06Å; V128-K130 VanDerWaalsContact C-N 3.34Å; V128-K130 PolarHBondContact O-N 3.01Å; K130-S134 PolarHBondContact O-OG 3.24Å; K130-S134 VanDerWaalsContact O-OG 3.11Å
131V58.6Low52.8Low73 Ų73104.6 Ų104.644%0.44258%0.581SS.*Hα-helixtrans-80.2-29.2174.3174.40000111.5F127 V128 D129 N135F127-V131 WeakPolarHBondContact O-CG2 3.47Å; F127-V131 PolarHBondContact O-N 3.28Å; V128-V131 PolarHBondContact O-N 3.38Å; D129-V131 VanDerWaalsContact C-N 3.33Å; D129-V131 PolarHBondContact O-N 2.83Å; V131-N135 PolarHBondContact O-ND2 3.37Å; V131-N135 VanDerWaalsContact O-ND2 3.12Å
132G54.2Low52.5Low39 Ų39105.5 Ų105.540%0.40259%0.587SS.*Hα-helixtrans-69.5-48.6173.700000113V128 D129 S134 N135V128-G132 PolarHBondContact O-N 3.25Å; D129-G132 PolarHBondContact O-N 2.9Å; G132-S134 VanDerWaalsContact C-N 3.26Å; G132-S134 PolarHBondContact O-N 3.17Å; G132-N135 PolarHBondContact O-N 3.22Å; G132-N135 VanDerWaalsContact O-N 3.12Å
133E52.9Low52.6Low137 Ų137104.8 Ų104.864%0.6458%0.577SS**Hα-helixtrans-62.5-30.7-179.9-96.3-174.1143.200113.5D129 N135 T136D129-E133 PolarHBondContact O-N 3.06Å; E133-N135 PolarHBondContact O-N 3.46Å; E133-T136 PolarHBondContact O-N 3.14Å; E133-T136 PolarHBondContact O-OG1 2.83Å
134S48.3Very low52.5Low87 Ų8799.2 Ų99.261%0.60856%0.56SS**THydrogen-bonded Turntrans-68.7-12.3178.1-63.80000113.4K130 G132K130-S134 PolarHBondContact O-OG 3.24Å; K130-S134 VanDerWaalsContact O-OG 3.11Å; G132-S134 VanDerWaalsContact C-N 3.26Å; G132-S134 PolarHBondContact O-N 3.17Å
135N46.3Very low52.5Low105 Ų105101.7 Ų101.756%0.56158%0.576SS**THydrogen-bonded Turntrans-96.9-2.6175.9-77-76.4000113.7V131 G132 E133V131-N135 PolarHBondContact O-ND2 3.37Å; V131-N135 VanDerWaalsContact O-ND2 3.12Å; G132-N135 PolarHBondContact O-N 3.22Å; G132-N135 VanDerWaalsContact O-N 3.12Å; E133-N135 PolarHBondContact O-N 3.46Å
136T44.9Very low52.4Low112 Ų112107.2 Ų107.269%0.68760%0.604SS**SBendtrans-106-0.7-179.234.10000114.4E133E133-T136 PolarHBondContact O-N 3.14Å; E133-T136 PolarHBondContact O-OG1 2.83Å
137M41Very low51.9Low170 Ų170112 Ų11284%0.83761%0.612SS**  trans-112.130.9178.9-67.8-150.6-69.300114.4
138V38.6Very low51.3Low203 Ų203107.4 Ų107.4100%1.2360%0.603SS**  trans-130.60165.9-172.30000110

Retrieved 138 of 138 residues in 505.2 ms (Link to these results)