A0A060WER1_ONCMY Loading...

14-3-3 protein theta

AlphaFold DB , UniProt , Accession A0A060WER1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 250 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
1M75.1Confident94.5Very high121 Ų12166.5 Ų66.560%0.59633%0.333SS*.  0156.40178.5174.7-70.700107.5D5 L6 E28 Q32M1-D5 HydrophobicContact CG-CB 3.51Å; M1-D5 HydrophobicContact SD-CB 3.91Å; M1-L6 HydrophobicContact CB-CD1 4.32Å; M1-L6 HydrophobicContact CB-CD2 3.9Å; M1-L6 HydrophobicContact CB-CG 3.85Å; M1-L6 HydrophobicContact CG-CD2 4.15Å; M1-L6 HydrophobicContact CG-CG 3.98Å; M1-L6 HydrophobicContact SD-CD2 3.83Å; M1-L6 HydrophobicContact SD-CG 4.16Å; M1-E28 PolarHBondContact N-OE1 2.68Å; M1-Q32 PolarHBondContact O-NE2 2.85Å
2D92.9Very high94.8Very high101 Ų10168.9 Ų68.954%0.5435%0.347SS..  trans-64.4150.1177.8-175.430.9000110.5T4 D5 L6D2-T4 PolarHBondContact O-N 2.93Å; D2-D5 PolarHBondContact O-N 3.1Å; D2-D5 VanDerWaalsContact O-N 3.16Å; D2-L6 PolarHBondContact O-N 3.25Å
3K94Very high95.1Very high49 Ų4964.3 Ų64.321%0.21333%0.326CS..Hα-helixtrans-55.7-42.5-177.5-179.6171.7172.9178.10111L6 I7 V29 E40K3-L6 PolarHBondContact O-N 3.41Å; K3-I7 HydrophobicContact CG-CD1 3.88Å; K3-I7 VanDerWaalsContact O-CG1 3.31Å; K3-I7 WeakPolarHBondContact O-CG1 3.37Å; K3-I7 PolarHBondContact O-N 3.16Å; K3-V29 HydrophobicContact CD-CG1 4.35Å; K3-V29 HydrophobicContact CG-CG1 4.14Å; K3-E40 WeakPolarHBondContact CE-OE1 3.41Å; K3-E40 WeakPolarHBondContact CE-OE2 3.47Å; K3-E40 VanDerWaalsContact NZ-CD 3.33Å; K3-E40 IonicContact NZ-OE1 3.99Å; K3-E40 PolarHBondContact NZ-OE1 3.5Å; K3-E40 IonicContact NZ-OE2 2.98Å; K3-E40 PolarHBondContact NZ-OE2 3.15Å
4T95Very high95.3Very high96 Ų9664.6 Ų64.659%0.58933%0.326SS*.Hα-helixtrans-65.3-40.8-179.7-56.80000112.4D2 L6 I7 Q8D2-T4 PolarHBondContact O-N 2.93Å; T4-L6 VanDerWaalsContact C-N 3.34Å; T4-L6 PolarHBondContact O-N 2.91Å; T4-I7 PolarHBondContact O-N 3.46Å; T4-Q8 WeakPolarHBondContact O-CB 3.36Å; T4-Q8 PolarHBondContact O-N 3.06Å
5D96.5Very high95.5Very high94 Ų9470.9 Ų70.950%0.50335%0.353SS..Hα-helixtrans-64.2-40.4176.6-72.1-21000111.4M1 D2 Q8 K9M1-D5 HydrophobicContact CG-CB 3.51Å; M1-D5 HydrophobicContact SD-CB 3.91Å; D2-D5 PolarHBondContact O-N 3.1Å; D2-D5 VanDerWaalsContact O-N 3.16Å; D5-Q8 PolarHBondContact O-N 3.47Å; D5-K9 WeakPolarHBondContact O-CB 3.45Å; D5-K9 PolarHBondContact O-N 3.19Å
6L97.2Very high95.6Very high1 Ų170.2 Ų70.21%0.00536%0.362CS..Hα-helixtrans-65.6-42176.9-71.2165.9000112.4M1 D2 K3 T4 Q8 K9 A10 E28 V29M1-L6 HydrophobicContact CB-CD1 4.32Å; M1-L6 HydrophobicContact CB-CD2 3.9Å; M1-L6 HydrophobicContact CB-CG 3.85Å; M1-L6 HydrophobicContact CG-CD2 4.15Å; M1-L6 HydrophobicContact CG-CG 3.98Å; M1-L6 HydrophobicContact SD-CD2 3.83Å; M1-L6 HydrophobicContact SD-CG 4.16Å; D2-L6 PolarHBondContact O-N 3.25Å; K3-L6 PolarHBondContact O-N 3.41Å; T4-L6 VanDerWaalsContact C-N 3.34Å; T4-L6 PolarHBondContact O-N 2.91Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; L6-K9 PolarHBondContact O-N 3.05Å; L6-A10 WeakPolarHBondContact O-CB 3.38Å; L6-A10 PolarHBondContact O-N 3.06Å; L6-E28 HydrophobicContact CD1-CB 3.86Å; L6-E28 HydrophobicContact CD1-CG 3.6Å; L6-E28 HydrophobicContact CD2-CB 4.2Å; L6-E28 HydrophobicContact CD2-CG 4.31Å; L6-E28 WeakPolarHBondContact CD2-OE2 3.35Å; L6-V29 HydrophobicContact CB-CG2 3.43Å; L6-V29 VanDerWaalsContact CB-CG2 3.43Å; L6-V29 HydrophobicContact CD1-CG2 3.99Å; L6-V29 HydrophobicContact CG-CG2 4.35Å
7I97.3Very high95.7Very high19 Ų1974.6 Ų74.610%0.09738%0.381CS..Hα-helixtrans-63.1-43.6175.5-68.3164.6000110.2K3 T4 K9 A10 K11 V29 E40 L43K3-I7 HydrophobicContact CG-CD1 3.88Å; K3-I7 VanDerWaalsContact O-CG1 3.31Å; K3-I7 WeakPolarHBondContact O-CG1 3.37Å; K3-I7 PolarHBondContact O-N 3.16Å; T4-I7 PolarHBondContact O-N 3.46Å; I7-K9 VanDerWaalsContact C-N 3.31Å; I7-K9 PolarHBondContact O-N 3.09Å; I7-A10 WeakPolarHBondContact O-CB 3.43Å; I7-A10 PolarHBondContact O-N 3.19Å; I7-K11 HydrophobicContact CG2-CD 4.38Å; I7-K11 WeakPolarHBondContact O-CG 3.31Å; I7-K11 PolarHBondContact O-N 3.45Å; I7-V29 HydrophobicContact CG1-CG1 4.48Å; I7-V29 HydrophobicContact CG1-CG2 4.04Å; I7-E40 HydrophobicContact CD1-CG 3.76Å; I7-E40 WeakPolarHBondContact CD1-OE1 3.44Å; I7-E40 HydrophobicContact CG1-CG 4.31Å; I7-L43 HydrophobicContact CG2-CD1 4.09Å
8Q97.7Very high95.8Very high102 Ų10278.3 Ų78.348%0.47739%0.389SS..Hα-helixtrans-62.7-40.7177-173.860.420.300111.4T4 D5 L6 K11 L12T4-Q8 WeakPolarHBondContact O-CB 3.36Å; T4-Q8 PolarHBondContact O-N 3.06Å; D5-Q8 PolarHBondContact O-N 3.47Å; L6-Q8 VanDerWaalsContact C-N 3.34Å; Q8-K11 PolarHBondContact O-N 3.45Å; Q8-L12 WeakPolarHBondContact O-CG 3.48Å; Q8-L12 PolarHBondContact O-N 3.43Å
9K97.8Very high96Very high98 Ų9877.2 Ų77.243%0.42638%0.381SS..Hα-helixtrans-63.5-41.1174.4-171.7-178.6175.7-1680112D5 L6 I7 L12 A13D5-K9 WeakPolarHBondContact O-CB 3.45Å; D5-K9 PolarHBondContact O-N 3.19Å; L6-K9 PolarHBondContact O-N 3.05Å; I7-K9 VanDerWaalsContact C-N 3.31Å; I7-K9 PolarHBondContact O-N 3.09Å; K9-L12 PolarHBondContact O-N 3.19Å; K9-A13 WeakPolarHBondContact O-CB 3.43Å; K9-A13 PolarHBondContact O-N 3.05Å
10A98.2Very high96Very high0 Ų077.5 Ų77.50%038%0.384CS..Hα-helixtrans-61.1-43.6175.700000111.6L6 I7 L12 A13 E14 M22 M26L6-A10 WeakPolarHBondContact O-CB 3.38Å; L6-A10 PolarHBondContact O-N 3.06Å; I7-A10 WeakPolarHBondContact O-CB 3.43Å; I7-A10 PolarHBondContact O-N 3.19Å; A10-L12 PolarHBondContact O-N 3.49Å; A10-A13 WeakPolarHBondContact O-CB 3.42Å; A10-A13 PolarHBondContact O-N 3.08Å; A10-E14 PolarHBondContact O-N 3.32Å; A10-M22 HydrophobicContact CB-CG 4.12Å; A10-M26 HydrophobicContact CB-CG 3.88Å; A10-M26 HydrophobicContact CB-SD 3.66Å
11K98.1Very high96.1Very high50 Ų5076.1 Ų76.122%0.21738%0.378CS..Hα-helixtrans-62.9-40.3175.4-70.1175.3176.2-175.80112.8I7 Q8 E14 Q15 E39 L43I7-K11 HydrophobicContact CG2-CD 4.38Å; I7-K11 WeakPolarHBondContact O-CG 3.31Å; I7-K11 PolarHBondContact O-N 3.45Å; Q8-K11 PolarHBondContact O-N 3.45Å; K11-E14 PolarHBondContact O-N 2.95Å; K11-Q15 WeakPolarHBondContact O-CG 3.49Å; K11-Q15 PolarHBondContact O-N 2.85Å; K11-Q15 VanDerWaalsContact O-N 3.12Å; K11-E39 WeakPolarHBondContact CE-OE1 3.49Å; K11-E39 IonicContact NZ-OE1 3.64Å; K11-E39 PolarHBondContact NZ-OE1 2.9Å; K11-E39 IonicContact NZ-OE2 3.91Å; K11-L43 HydrophobicContact CG-CD1 4.18Å; K11-L43 HydrophobicContact CG-CD2 4.2Å
12L98.3Very high97.2Very high96 Ų9670.4 Ų70.450%0.50335%0.35SS..Hα-helixtrans-65.2-40.6174-70.1171.1000111.5Q8 K9 A10 Q15 A16Q8-L12 WeakPolarHBondContact O-CG 3.48Å; Q8-L12 PolarHBondContact O-N 3.43Å; K9-L12 PolarHBondContact O-N 3.19Å; A10-L12 PolarHBondContact O-N 3.49Å; L12-Q15 PolarHBondContact O-N 3.16Å; L12-A16 WeakPolarHBondContact O-CB 3.35Å; L12-A16 PolarHBondContact O-N 3.38Å; L12-A16 VanDerWaalsContact O-N 3.07Å
13A98.3Very high97.5Very high9 Ų965.9 Ų65.97%0.07433%0.326CS..Hα-helixtrans-65.5-38.6176.900000112K9 A10 A16 E17 R18 D21 M22K9-A13 WeakPolarHBondContact O-CB 3.43Å; K9-A13 PolarHBondContact O-N 3.05Å; A10-A13 WeakPolarHBondContact O-CB 3.42Å; A10-A13 PolarHBondContact O-N 3.08Å; A13-A16 CarbonylContact O-C 3.48Å; A13-A16 PolarHBondContact O-N 3.09Å; A13-E17 PolarHBondContact O-N 3.41Å; A13-R18 PolarHBondContact O-N 3.2Å; A13-D21 HydrophobicContact CB-CB 4.09Å; A13-M22 HydrophobicContact CB-CB 3.83Å
14E97.9Very high97.7Very high68 Ų6866.4 Ų66.432%0.31834%0.34SS..Hα-helixtrans-59-49.9172.7-175.4178.5-148.200111.5A10 K11 A16 E17 M22A10-E14 PolarHBondContact O-N 3.32Å; K11-E14 PolarHBondContact O-N 2.95Å; E14-A16 PolarHBondContact O-N 3.25Å; E14-E17 PolarHBondContact O-N 3.07Å; E14-M22 HydrophobicContact CB-CE 3.85Å; E14-M22 HydrophobicContact CB-SD 3.79Å; E14-M22 HydrophobicContact CG-CE 4.06Å; E14-M22 HydrophobicContact CG-SD 4.21Å
15Q97.5Very high97.8Very high159 Ų15961.9 Ų61.974%0.74331%0.312SS*.Hα-helixtrans-63.3-27.5178.2-69.7175.522.800113.3K11 L12 E17K11-Q15 WeakPolarHBondContact O-CG 3.49Å; K11-Q15 PolarHBondContact O-N 2.85Å; K11-Q15 VanDerWaalsContact O-N 3.12Å; L12-Q15 PolarHBondContact O-N 3.16Å; Q15-E17 VanDerWaalsContact C-N 3.34Å
16A97.8Very high97.9Very high60 Ų6057.4 Ų57.450%0.49629%0.289SS..THydrogen-bonded Turntrans-90.93.6176.100000113.2L12 A13 E14 R18L12-A16 WeakPolarHBondContact O-CB 3.35Å; L12-A16 PolarHBondContact O-N 3.38Å; L12-A16 VanDerWaalsContact O-N 3.07Å; A13-A16 CarbonylContact O-C 3.48Å; A13-A16 PolarHBondContact O-N 3.09Å; E14-A16 PolarHBondContact O-N 3.25Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 WeakPolarHBondContact O-CG 3.24Å; A16-R18 PolarHBondContact O-N 2.86Å; A16-R18 VanDerWaalsContact O-N 3.09Å
17E97.3Very high98Very high145 Ų14560 Ų6068%0.67830%0.3SS*.THydrogen-bonded Turntrans53.925.6-174.9-57.3-176.1178.600113.7A13 E14 Q15 Y19A13-E17 PolarHBondContact O-N 3.41Å; E14-E17 PolarHBondContact O-N 3.07Å; Q15-E17 VanDerWaalsContact C-N 3.34Å; E17-Y19 VanDerWaalsContact C-N 3.33Å; E17-Y19 HydrophobicContact CB-CE2 3.88Å; E17-Y19 HydrophobicContact CG-CE2 4.44Å; E17-Y19 VanDerWaalsContact O-CD2 3.31Å; E17-Y19 WeakPolarHBondContact O-CD2 3.37Å; E17-Y19 PolarHBondContact O-N 3.28Å
18R98.3Very high98Very high141 Ų14162.7 Ų62.753%0.53231%0.312SS..  trans-91.666.7177.3-63.8-162.468.8-138.2-17110.1A13 A16 D20 D21 M22A13-R18 PolarHBondContact O-N 3.2Å; A16-R18 HydrophobicContact CB-CG 4.12Å; A16-R18 WeakPolarHBondContact O-CG 3.24Å; A16-R18 PolarHBondContact O-N 2.86Å; A16-R18 VanDerWaalsContact O-N 3.09Å; R18-D20 VanDerWaalsContact C-N 3.29Å; R18-D20 PolarHBondContact O-N 3.44Å; R18-D21 HydrophobicContact CB-CB 4.26Å; R18-D21 VanDerWaalsContact CZ-CG 3.5Å; R18-D21 IonicContact CZ-OD1 3.59Å; R18-D21 IonicContact CZ-OD2 2.9Å; R18-D21 IonicContact NE-OD2 3.56Å; R18-D21 IonicContact NH1-OD2 2.68Å; R18-D21 PolarHBondContact NH1-OD2 3.39Å; R18-D21 IonicContact NH2-OD1 2.85Å; R18-D21 PolarHBondContact NH2-OD1 3.32Å; R18-D21 IonicContact NH2-OD2 2.93Å; R18-D21 PolarHBondContact NH2-OD2 2.94Å; R18-D21 WeakPolarHBondContact O-CB 3.38Å; R18-D21 PolarHBondContact O-N 2.98Å; R18-M22 PolarHBondContact O-N 3.31Å
19Y98.1Very high98Very high58 Ų5857.9 Ų57.923%0.22729%0.289CS..Hα-helixtrans-63.8-27.6-171.5-57.9-72.8000114.6E17 M22 A23 N50 V51E17-Y19 VanDerWaalsContact C-N 3.33Å; E17-Y19 HydrophobicContact CB-CE2 3.88Å; E17-Y19 HydrophobicContact CG-CE2 4.44Å; E17-Y19 VanDerWaalsContact O-CD2 3.31Å; E17-Y19 WeakPolarHBondContact O-CD2 3.37Å; E17-Y19 PolarHBondContact O-N 3.28Å; Y19-M22 HydrophobicContact CD1-SD 4.08Å; Y19-M22 WeakPolarHBondContact O-CB 3.49Å; Y19-M22 PolarHBondContact O-N 3.38Å; Y19-A23 WeakPolarHBondContact O-CB 3.49Å; Y19-A23 PolarHBondContact O-N 2.69Å; Y19-N50 HydrophobicContact CD1-CB 3.56Å; Y19-N50 HydrophobicContact CD2-CB 3.59Å; Y19-N50 HydrophobicContact CE1-CB 3.95Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.41Å; Y19-N50 HydrophobicContact CE2-CB 3.98Å; Y19-N50 HydrophobicContact CG-CB 3.34Å; Y19-V51 VanDerWaalsContact C-CG2 3.41Å; Y19-V51 VanDerWaalsContact O-CG2 3.31Å; Y19-V51 WeakPolarHBondContact O-CG2 3.49Å
20D97.6Very high97.9Very high82 Ų8253.3 Ų53.344%0.43927%0.27SS..Hα-helixtrans-64.7-40.7173.2-60.2-61.7000111.1R18 A23 A24 V51 R55R18-D20 VanDerWaalsContact C-N 3.29Å; R18-D20 PolarHBondContact O-N 3.44Å; D20-A23 PolarHBondContact O-N 3.2Å; D20-A24 PolarHBondContact O-N 3.08Å; D20-V51 WeakPolarHBondContact OD1-CG1 3.43Å; D20-R55 IonicContact OD1-CZ 3.43Å; D20-R55 IonicContact OD1-NH1 2.63Å; D20-R55 PolarHBondContact OD1-NH1 3.43Å; D20-R55 IonicContact OD1-NH2 3.87Å; D20-R55 PolarHBondContact OD1-NH2 3.26Å; D20-R55 IonicContact OD2-NH1 3.7Å; D20-R55 IonicContact OD2-NH2 3.73Å
21D98.1Very high97.8Very high50 Ų5057 Ų5727%0.26729%0.287SS..Hα-helixtrans-68.9-36.7175.4-72.917000111.5A13 R18 S25A13-D21 HydrophobicContact CB-CB 4.09Å; R18-D21 HydrophobicContact CB-CB 4.26Å; R18-D21 VanDerWaalsContact CZ-CG 3.5Å; R18-D21 IonicContact CZ-OD1 3.59Å; R18-D21 IonicContact CZ-OD2 2.9Å; R18-D21 IonicContact NE-OD2 3.56Å; R18-D21 IonicContact NH1-OD2 2.68Å; R18-D21 PolarHBondContact NH1-OD2 3.39Å; R18-D21 IonicContact NH2-OD1 2.85Å; R18-D21 PolarHBondContact NH2-OD1 3.32Å; R18-D21 IonicContact NH2-OD2 2.93Å; R18-D21 PolarHBondContact NH2-OD2 2.94Å; R18-D21 WeakPolarHBondContact O-CB 3.38Å; R18-D21 PolarHBondContact O-N 2.98Å; D21-S25 PolarHBondContact O-N 3.39Å; D21-S25 PolarHBondContact O-OG 3.16Å
22M98.3Very high97.6Very high0 Ų059 Ų590%030%0.297CS..Hα-helixtrans-62.4-46.8174.8-169-170.6-179.200110.5A10 A13 E14 R18 Y19 S25 M26 L43 V46 A47A10-M22 HydrophobicContact CB-CG 4.12Å; A13-M22 HydrophobicContact CB-CB 3.83Å; E14-M22 HydrophobicContact CB-CE 3.85Å; E14-M22 HydrophobicContact CB-SD 3.79Å; E14-M22 HydrophobicContact CG-CE 4.06Å; E14-M22 HydrophobicContact CG-SD 4.21Å; R18-M22 PolarHBondContact O-N 3.31Å; Y19-M22 HydrophobicContact CD1-SD 4.08Å; Y19-M22 WeakPolarHBondContact O-CB 3.49Å; Y19-M22 PolarHBondContact O-N 3.38Å; M22-S25 PolarHBondContact O-N 2.79Å; M22-M26 WeakPolarHBondContact O-CG 3.48Å; M22-M26 PolarHBondContact O-N 3.06Å; M22-L43 HydrophobicContact CE-CB 4.02Å; M22-L43 HydrophobicContact CE-CD2 3.51Å; M22-L43 HydrophobicContact CE-CG 4.39Å; M22-L43 VanDerWaalsContact CE-O 3.31Å; M22-L43 WeakPolarHBondContact CE-O 3.39Å; M22-V46 HydrophobicContact CE-CB 4.29Å; M22-V46 HydrophobicContact CE-CG1 4.19Å; M22-V46 HydrophobicContact SD-CG1 4.43Å; M22-A47 HydrophobicContact CB-CB 4Å; M22-A47 HydrophobicContact CE-CB 4.22Å; M22-A47 HydrophobicContact CG-CB 3.62Å; M22-A47 HydrophobicContact SD-CB 3.63Å
23A98.1Very high97.2Very high6 Ų655.7 Ų55.75%0.0529%0.286CS..Hα-helixtrans-63.5-44.4178.700000111.2Y19 D20 S25 M26 K27 A47 Y48 V51Y19-A23 WeakPolarHBondContact O-CB 3.49Å; Y19-A23 PolarHBondContact O-N 2.69Å; D20-A23 PolarHBondContact O-N 3.2Å; A23-S25 VanDerWaalsContact C-N 3.31Å; A23-S25 PolarHBondContact O-N 3.28Å; A23-M26 PolarHBondContact O-N 2.99Å; A23-K27 VanDerWaalsContact O-CB 3.29Å; A23-K27 WeakPolarHBondContact O-CB 3.39Å; A23-K27 PolarHBondContact O-N 3.38Å; A23-A47 HydrophobicContact CB-CB 4.11Å; A23-Y48 HydrophobicContact CB-CD1 4.21Å; A23-Y48 HydrophobicContact CB-CD2 4.34Å; A23-Y48 HydrophobicContact CB-CE1 4.12Å; A23-Y48 HydrophobicContact CB-CE2 4.2Å; A23-Y48 HydrophobicContact CB-CG 4.34Å; A23-V51 HydrophobicContact CB-CG2 4.09Å
24A98.2Very high96.7Very high60 Ų6057.5 Ų57.550%0.49631%0.305SS..Hα-helixtrans-59.5-40.8175.700000112.6D20 E28D20-A24 PolarHBondContact O-N 3.08Å; A24-E28 PolarHBondContact O-N 2.89Å
25S98.3Very high96.4Very high2 Ų257.9 Ų57.91%0.01431%0.307CS..Hα-helixtrans-69-43.7178.4-53.60000111.4D21 M22 A23 K27 E28 V29D21-S25 PolarHBondContact O-N 3.39Å; D21-S25 PolarHBondContact O-OG 3.16Å; M22-S25 PolarHBondContact O-N 2.79Å; A23-S25 VanDerWaalsContact C-N 3.31Å; A23-S25 PolarHBondContact O-N 3.28Å; S25-K27 VanDerWaalsContact C-N 3.33Å; S25-E28 PolarHBondContact O-N 3.39Å; S25-V29 WeakPolarHBondContact O-CG2 3.31Å; S25-V29 PolarHBondContact O-N 3.49Å; S25-V29 VanDerWaalsContact O-N 3.07Å
26M98.3Very high96.3Very high0 Ų050.7 Ų50.70%027%0.274CS..Hα-helixtrans-71.2-27.8178.7-69.3-52.9-53.100113.3A10 M22 A23 V29 T30 E40 L43 L44A10-M26 HydrophobicContact CB-CG 3.88Å; A10-M26 HydrophobicContact CB-SD 3.66Å; M22-M26 WeakPolarHBondContact O-CG 3.48Å; M22-M26 PolarHBondContact O-N 3.06Å; A23-M26 PolarHBondContact O-N 2.99Å; M26-V29 HydrophobicContact CE-CB 4.37Å; M26-V29 HydrophobicContact CE-CG1 4.25Å; M26-V29 PolarHBondContact O-N 2.85Å; M26-T30 WeakPolarHBondContact O-CB 3.36Å; M26-T30 PolarHBondContact O-N 3.33Å; M26-T30 PolarHBondContact O-OG1 2.63Å; M26-E40 HydrophobicContact CE-CB 4.31Å; M26-E40 WeakPolarHBondContact CE-O 3.49Å; M26-L43 HydrophobicContact CE-CB 4.01Å; M26-L43 HydrophobicContact CG-CB 4.23Å; M26-L43 HydrophobicContact SD-CB 3.81Å; M26-L43 HydrophobicContact SD-CD1 4.32Å; M26-L44 HydrophobicContact CB-CB 4.38Å; M26-L44 HydrophobicContact CB-CD1 3.73Å; M26-L44 HydrophobicContact CE-CB 4.14Å
27K98.1Very high96.1Very high56 Ų5650.2 Ų50.224%0.24327%0.267CS..Hα-helixtrans-60.6-52.5168.4177.1169.11791750110.8A23 S25 V29 T30 E31 D96 L100A23-K27 VanDerWaalsContact O-CB 3.29Å; A23-K27 WeakPolarHBondContact O-CB 3.39Å; A23-K27 PolarHBondContact O-N 3.38Å; S25-K27 VanDerWaalsContact C-N 3.33Å; K27-V29 VanDerWaalsContact C-N 3.28Å; K27-V29 PolarHBondContact O-N 3.29Å; K27-T30 WeakPolarHBondContact O-CB 3.41Å; K27-T30 PolarHBondContact O-N 2.84Å; K27-E31 WeakPolarHBondContact CE-OE1 3.29Å; K27-E31 HydrophobicContact CG-CG 4.34Å; K27-E31 IonicContact NZ-OE1 3.87Å; K27-E31 WeakPolarHBondContact O-CG 3.5Å; K27-E31 PolarHBondContact O-N 3.05Å; K27-D96 WeakPolarHBondContact CD-OD1 3.45Å; K27-D96 WeakPolarHBondContact CE-OD1 3.38Å; K27-D96 IonicContact NZ-OD1 3.47Å; K27-D96 PolarHBondContact NZ-OD1 2.97Å; K27-D96 IonicContact NZ-OD2 3.73Å; K27-L100 HydrophobicContact CB-CD1 4.24Å; K27-L100 HydrophobicContact CG-CD1 4.08Å; K27-L100 HydrophobicContact CG-CD2 4.17Å
28E97.7Very high95.8Very high75 Ų7547.4 Ų47.435%0.3526%0.257SS..Hα-helixtrans-60.4-39.3178.6-169.2-179.3156.300111.3M1 L6 A24 S25 T30 E31 Q32M1-E28 PolarHBondContact N-OE1 2.68Å; L6-E28 HydrophobicContact CD1-CB 3.86Å; L6-E28 HydrophobicContact CD1-CG 3.6Å; L6-E28 HydrophobicContact CD2-CB 4.2Å; L6-E28 HydrophobicContact CD2-CG 4.31Å; L6-E28 WeakPolarHBondContact CD2-OE2 3.35Å; A24-E28 PolarHBondContact O-N 2.89Å; S25-E28 PolarHBondContact O-N 3.39Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.28Å; E28-E31 PolarHBondContact O-N 3.37Å; E28-Q32 WeakPolarHBondContact O-CG 3.23Å; E28-Q32 PolarHBondContact O-N 3.19Å; E28-Q32 VanDerWaalsContact O-N 3.14Å
29V97.3Very high95.6Very high0 Ų045.7 Ų45.70%026%0.255CS..Hα-helixtrans-58.8-42.5173.2170.50000111.9K3 L6 I7 S25 M26 K27 L36K3-V29 HydrophobicContact CD-CG1 4.35Å; K3-V29 HydrophobicContact CG-CG1 4.14Å; L6-V29 HydrophobicContact CB-CG2 3.43Å; L6-V29 VanDerWaalsContact CB-CG2 3.43Å; L6-V29 HydrophobicContact CD1-CG2 3.99Å; L6-V29 HydrophobicContact CG-CG2 4.35Å; I7-V29 HydrophobicContact CG1-CG1 4.48Å; I7-V29 HydrophobicContact CG1-CG2 4.04Å; S25-V29 WeakPolarHBondContact O-CG2 3.31Å; S25-V29 PolarHBondContact O-N 3.49Å; S25-V29 VanDerWaalsContact O-N 3.07Å; M26-V29 HydrophobicContact CE-CB 4.37Å; M26-V29 HydrophobicContact CE-CG1 4.25Å; M26-V29 PolarHBondContact O-N 2.85Å; K27-V29 VanDerWaalsContact C-N 3.28Å; K27-V29 PolarHBondContact O-N 3.29Å; V29-L36 HydrophobicContact CG1-CD2 3.97Å
30T96.8Very high95.5Very high2 Ų244.1 Ų44.11%0.01225%0.249CC..Hα-helixtrans-70.4-40.5-178.8-57.40000111.6M26 K27 E28 Q32 G33 L100 Y104 L105M26-T30 WeakPolarHBondContact O-CB 3.36Å; M26-T30 PolarHBondContact O-N 3.33Å; M26-T30 PolarHBondContact O-OG1 2.63Å; K27-T30 WeakPolarHBondContact O-CB 3.41Å; K27-T30 PolarHBondContact O-N 2.84Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 3.28Å; T30-Q32 VanDerWaalsContact C-N 3.29Å; T30-Q32 PolarHBondContact O-N 3.37Å; T30-G33 PolarHBondContact O-N 2.95Å; T30-G33 VanDerWaalsContact O-N 3.09Å; T30-L100 HydrophobicContact CG2-CB 4.22Å; T30-L100 HydrophobicContact CG2-CD2 3.99Å; T30-Y104 HydrophobicContact CG2-CD2 4.45Å; T30-Y104 HydrophobicContact CG2-CG 4.36Å; T30-L105 HydrophobicContact CG2-CD1 4.05Å; T30-L105 HydrophobicContact CG2-CD2 3.72Å; T30-L105 HydrophobicContact CG2-CG 3.82Å
31E96.3Very high95.4Very high79 Ų7940.5 Ų40.537%0.36923%0.229SC..Hα-helixtrans-71.5-20.7-179.3-69.6178.8151.400113.6K27 E28 G33 L100 Y104K27-E31 WeakPolarHBondContact CE-OE1 3.29Å; K27-E31 HydrophobicContact CG-CG 4.34Å; K27-E31 IonicContact NZ-OE1 3.87Å; K27-E31 WeakPolarHBondContact O-CG 3.5Å; K27-E31 PolarHBondContact O-N 3.05Å; E28-E31 PolarHBondContact O-N 3.37Å; E31-G33 PolarHBondContact O-N 3.01Å; E31-L100 HydrophobicContact CG-CD2 3.78Å; E31-Y104 HydrophobicContact CG-CE2 3.87Å
32Q94.2Very high95.2Very high91 Ų9142 Ų4243%0.42524%0.238SC..THydrogen-bonded Turntrans-65.3-16.1169.5-74179.527.500112.9M1 E28 T30M1-Q32 PolarHBondContact O-NE2 2.85Å; E28-Q32 WeakPolarHBondContact O-CG 3.23Å; E28-Q32 PolarHBondContact O-N 3.19Å; E28-Q32 VanDerWaalsContact O-N 3.14Å; T30-Q32 VanDerWaalsContact C-N 3.29Å; T30-Q32 PolarHBondContact O-N 3.37Å
33G88.3Confident95.2Very high27 Ų2742.6 Ų42.628%0.27824%0.241SC..  trans81.6175.717700000114.2T30 E31T30-G33 PolarHBondContact O-N 2.95Å; T30-G33 VanDerWaalsContact O-N 3.09Å; E31-G33 PolarHBondContact O-N 3.01Å
34G88.4Confident95.2Very high46 Ų4642.4 Ų42.447%0.47424%0.239SC..SBendtrans88.1165.8-171.900000113.1
35E91.8Very high95.1Very high76 Ų7641.1 Ų41.136%0.35523%0.226SC..PPolyproline II helixtrans-75.1133.2179.2-167.3163.7-155.700110T110 N111E35-T110 PolarHBondContact OE1-N 3.37Å; E35-T110 VanDerWaalsContact OE1-N 3.09Å; E35-T110 PolarHBondContact OE1-OG1 2.99Å; E35-T110 VanDerWaalsContact OE1-OG1 3.07Å; E35-T110 PolarHBondContact OE2-OG1 3.48Å; E35-N111 PolarHBondContact OE1-ND2 3.21Å
36L94.7Very high95Very high8 Ų843 Ų434%0.04224%0.238CC..PPolyproline II helixtrans-75.8139.8174.3-60.9-174.3000110.2V29 E40 R41 L44 L105V29-L36 HydrophobicContact CG1-CD2 3.97Å; L36-E40 WeakPolarHBondContact CA-OE2 3.33Å; L36-E40 HydrophobicContact CB-CB 3.95Å; L36-E40 HydrophobicContact CD2-CB 4.25Å; L36-R41 HydrophobicContact CB-CB 4.43Å; L36-L44 HydrophobicContact CD1-CD2 3.99Å; L36-L105 HydrophobicContact CD1-CD2 3.63Å; L36-L105 HydrophobicContact CG-CD2 3.81Å
37S94Very high95Very high51 Ų5143 Ų4336%0.35724%0.238SC..PPolyproline II helixtrans-66.9165.3168.976.50000111.3E39 E40 R41S37-E39 PolarHBondContact O-N 2.86Å; S37-E40 PolarHBondContact N-OE2 2.85Å; S37-E40 PolarHBondContact O-N 3.22Å; S37-E40 VanDerWaalsContact OG-CG 3.3Å; S37-E40 WeakPolarHBondContact OG-CG 3.41Å; S37-E40 PolarHBondContact OG-N 3.3Å; S37-R41 VanDerWaalsContact O-CB 3.28Å; S37-R41 WeakPolarHBondContact O-CB 3.41Å; S37-R41 PolarHBondContact O-N 2.88Å
38N90.8Very high95Very high86 Ų8640.6 Ų40.646%0.4623%0.227SC..Hα-helixtrans-56.8-38.4176-76.4-6.9000112.4R41 N42N38-R41 PolarHBondContact OD1-NH2 3.03Å; N38-N42 WeakPolarHBondContact O-CB 3.38Å; N38-N42 PolarHBondContact O-N 2.98Å; N38-N42 PolarHBondContact O-ND2 3.44Å
39E93.7Very high95Very high105 Ų10542.5 Ų42.549%0.49123%0.234SC..Hα-helixtrans-66.7-47.1176.5-173.7-179-164.900111.4K11 S37 R41 N42 L43K11-E39 WeakPolarHBondContact CE-OE1 3.49Å; K11-E39 IonicContact NZ-OE1 3.64Å; K11-E39 PolarHBondContact NZ-OE1 2.9Å; K11-E39 IonicContact NZ-OE2 3.91Å; S37-E39 PolarHBondContact O-N 2.86Å; E39-R41 VanDerWaalsContact C-N 3.35Å; E39-R41 PolarHBondContact O-N 3.34Å; E39-N42 PolarHBondContact O-N 3.07Å; E39-L43 HydrophobicContact CG-CD1 4.42Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.43Å
40E96.3Very high95Very high24 Ų2444.8 Ų44.811%0.11225%0.247CC..Hα-helixtrans-62.3-42.4178.7-70164.5-176.400111.7K3 I7 M26 L36 S37 N42 L43 L44K3-E40 WeakPolarHBondContact CE-OE1 3.41Å; K3-E40 WeakPolarHBondContact CE-OE2 3.47Å; K3-E40 VanDerWaalsContact NZ-CD 3.33Å; K3-E40 IonicContact NZ-OE1 3.99Å; K3-E40 PolarHBondContact NZ-OE1 3.5Å; K3-E40 IonicContact NZ-OE2 2.98Å; K3-E40 PolarHBondContact NZ-OE2 3.15Å; I7-E40 HydrophobicContact CD1-CG 3.76Å; I7-E40 WeakPolarHBondContact CD1-OE1 3.44Å; I7-E40 HydrophobicContact CG1-CG 4.31Å; M26-E40 HydrophobicContact CE-CB 4.31Å; M26-E40 WeakPolarHBondContact CE-O 3.49Å; L36-E40 WeakPolarHBondContact CA-OE2 3.33Å; L36-E40 HydrophobicContact CB-CB 3.95Å; L36-E40 HydrophobicContact CD2-CB 4.25Å; S37-E40 PolarHBondContact N-OE2 2.85Å; S37-E40 PolarHBondContact O-N 3.22Å; S37-E40 VanDerWaalsContact OG-CG 3.3Å; S37-E40 WeakPolarHBondContact OG-CG 3.41Å; S37-E40 PolarHBondContact OG-N 3.3Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.46Å; E40-L43 PolarHBondContact O-N 3.37Å; E40-L44 PolarHBondContact O-N 2.89Å
41R95.8Very high95Very high6 Ų645 Ų452%0.02325%0.248CC..Hα-helixtrans-61.2-41.9175.4-177.9179.970.8-178.54.1111.7L36 S37 N38 E39 S45 E113 S114 F117 Y118L36-R41 HydrophobicContact CB-CB 4.43Å; S37-R41 VanDerWaalsContact O-CB 3.28Å; S37-R41 WeakPolarHBondContact O-CB 3.41Å; S37-R41 PolarHBondContact O-N 2.88Å; N38-R41 PolarHBondContact OD1-NH2 3.03Å; E39-R41 VanDerWaalsContact C-N 3.35Å; E39-R41 PolarHBondContact O-N 3.34Å; R41-S45 WeakPolarHBondContact O-CB 3.39Å; R41-S45 PolarHBondContact O-N 3.25Å; R41-E113 IonicContact CZ-OE1 3.49Å; R41-E113 IonicContact NH1-OE1 3.88Å; R41-E113 PolarHBondContact NH1-OE1 3.22Å; R41-E113 IonicContact NH2-OE1 3.16Å; R41-E113 PolarHBondContact NH2-OE1 3.26Å; R41-S114 VanDerWaalsContact NH1-CA 3.3Å; R41-S114 PolarHBondContact NH1-OG 3.48Å; R41-F117 VanDerWaalsContact CD-CD1 3.47Å; R41-F117 HydrophobicContact CG-CD1 3.53Å; R41-F117 HydrophobicContact CG-CE1 3.33Å; R41-F117 HydrophobicContact CG-CE2 4.4Å; R41-F117 HydrophobicContact CG-CG 4.17Å; R41-F117 HydrophobicContact CG-CZ 3.79Å; R41-Y118 HydrophobicContact CG-CE1 3.76Å
42N94.2Very high95.1Very high83 Ų8341.3 Ų41.344%0.44423%0.231SC..Hα-helixtrans-65.7-44.4175.8-73.7-11000111.5N38 E39 E40 L44 S45 V46N38-N42 WeakPolarHBondContact O-CB 3.38Å; N38-N42 PolarHBondContact O-N 2.98Å; N38-N42 PolarHBondContact O-ND2 3.44Å; E39-N42 PolarHBondContact O-N 3.07Å; E40-N42 VanDerWaalsContact C-N 3.33Å; E40-N42 PolarHBondContact O-N 3.46Å; N42-L44 PolarHBondContact O-N 2.9Å; N42-S45 PolarHBondContact O-N 2.99Å; N42-V46 WeakPolarHBondContact O-CB 3.43Å; N42-V46 VanDerWaalsContact O-CG2 3.32Å; N42-V46 WeakPolarHBondContact O-CG2 3.36Å; N42-V46 PolarHBondContact O-N 2.94Å
43L97.6Very high95.2Very high11 Ų1138.1 Ų38.16%0.05822%0.222CC..Hα-helixtrans-58.5-46.7175.6-71.3169.6000111.6I7 K11 M22 M26 E39 E40 S45 V46 A47I7-L43 HydrophobicContact CG2-CD1 4.09Å; K11-L43 HydrophobicContact CG-CD1 4.18Å; K11-L43 HydrophobicContact CG-CD2 4.2Å; M22-L43 HydrophobicContact CE-CB 4.02Å; M22-L43 HydrophobicContact CE-CD2 3.51Å; M22-L43 HydrophobicContact CE-CG 4.39Å; M22-L43 VanDerWaalsContact CE-O 3.31Å; M22-L43 WeakPolarHBondContact CE-O 3.39Å; M26-L43 HydrophobicContact CE-CB 4.01Å; M26-L43 HydrophobicContact CG-CB 4.23Å; M26-L43 HydrophobicContact SD-CB 3.81Å; M26-L43 HydrophobicContact SD-CD1 4.32Å; E39-L43 HydrophobicContact CG-CD1 4.42Å; E39-L43 WeakPolarHBondContact O-CG 3.49Å; E39-L43 PolarHBondContact O-N 3.43Å; E40-L43 PolarHBondContact O-N 3.37Å; L43-S45 VanDerWaalsContact C-N 3.33Å; L43-S45 PolarHBondContact O-N 3.49Å; L43-V46 PolarHBondContact O-N 2.9Å; L43-A47 VanDerWaalsContact O-CB 3.31Å; L43-A47 WeakPolarHBondContact O-CB 3.26Å; L43-A47 PolarHBondContact O-N 3.42Å
44L97.8Very high95.6Very high2 Ų239.4 Ų39.41%0.0123%0.23CC..Hα-helixtrans-57.7-46.9176.4-179.272.2000111.3M26 L36 E40 N42 A47 Y48 L105M26-L44 HydrophobicContact CB-CB 4.38Å; M26-L44 HydrophobicContact CB-CD1 3.73Å; M26-L44 HydrophobicContact CE-CB 4.14Å; L36-L44 HydrophobicContact CD1-CD2 3.99Å; E40-L44 PolarHBondContact O-N 2.89Å; N42-L44 PolarHBondContact O-N 2.9Å; L44-A47 PolarHBondContact O-N 3.44Å; L44-Y48 HydrophobicContact CD1-CD2 3.69Å; L44-Y48 HydrophobicContact CD1-CE2 3.53Å; L44-Y48 HydrophobicContact CG-CD2 4.28Å; L44-Y48 PolarHBondContact O-N 3.21Å; L44-L105 HydrophobicContact CD2-CD1 3.6Å
45S96.3Very high96.1Very high34 Ų3440 Ų4024%0.23822%0.218CC..Hα-helixtrans-64.2-45.8-179.9-171.40000112.3R41 N42 L43 A47 K49R41-S45 WeakPolarHBondContact O-CB 3.39Å; R41-S45 PolarHBondContact O-N 3.25Å; N42-S45 PolarHBondContact O-N 2.99Å; L43-S45 VanDerWaalsContact C-N 3.33Å; L43-S45 PolarHBondContact O-N 3.49Å; S45-A47 PolarHBondContact O-N 2.98Å; S45-K49 WeakPolarHBondContact O-CB 3.33Å; S45-K49 PolarHBondContact O-N 3.48Å
46V96.9Very high96.3Very high41 Ų4137.7 Ų37.725%0.24821%0.206CC..Hα-helixtrans-61.8-44.6177.8169.70000111.1M22 N42 L43 N50M22-V46 HydrophobicContact CE-CB 4.29Å; M22-V46 HydrophobicContact CE-CG1 4.19Å; M22-V46 HydrophobicContact SD-CG1 4.43Å; N42-V46 WeakPolarHBondContact O-CB 3.43Å; N42-V46 VanDerWaalsContact O-CG2 3.32Å; N42-V46 WeakPolarHBondContact O-CG2 3.36Å; N42-V46 PolarHBondContact O-N 2.94Å; L43-V46 PolarHBondContact O-N 2.9Å; V46-N50 PolarHBondContact O-N 3.12Å; V46-N50 VanDerWaalsContact O-N 3.15Å; V46-N50 PolarHBondContact O-ND2 3.09Å
47A98.1Very high96.4Very high0 Ų040.5 Ų40.50%023%0.226CC..Hα-helixtrans-57.1-60179.900000111.2M22 A23 L43 L44 S45 K49 N50 V51M22-A47 HydrophobicContact CB-CB 4Å; M22-A47 HydrophobicContact CE-CB 4.22Å; M22-A47 HydrophobicContact CG-CB 3.62Å; M22-A47 HydrophobicContact SD-CB 3.63Å; A23-A47 HydrophobicContact CB-CB 4.11Å; L43-A47 VanDerWaalsContact O-CB 3.31Å; L43-A47 WeakPolarHBondContact O-CB 3.26Å; L43-A47 PolarHBondContact O-N 3.42Å; L44-A47 PolarHBondContact O-N 3.44Å; S45-A47 PolarHBondContact O-N 2.98Å; A47-K49 PolarHBondContact O-N 3.07Å; A47-N50 PolarHBondContact O-N 3.35Å; A47-V51 WeakPolarHBondContact O-CG2 3.41Å; A47-V51 PolarHBondContact O-N 3.05Å; A47-V51 VanDerWaalsContact O-N 3.09Å
48Y98.3Very high96.6Very high5 Ų540 Ų402%0.0223%0.225CC..Hα-helixtrans-71-32.1-175.6-78.3-80.5000113A23 L44 N50 V51 V52 I93 D96 V97 L100 Y125A23-Y48 HydrophobicContact CB-CD1 4.21Å; A23-Y48 HydrophobicContact CB-CD2 4.34Å; A23-Y48 HydrophobicContact CB-CE1 4.12Å; A23-Y48 HydrophobicContact CB-CE2 4.2Å; A23-Y48 HydrophobicContact CB-CG 4.34Å; L44-Y48 HydrophobicContact CD1-CD2 3.69Å; L44-Y48 HydrophobicContact CD1-CE2 3.53Å; L44-Y48 HydrophobicContact CG-CD2 4.28Å; L44-Y48 PolarHBondContact O-N 3.21Å; Y48-N50 VanDerWaalsContact C-N 3.3Å; Y48-N50 PolarHBondContact O-N 3.4Å; Y48-V51 PolarHBondContact O-N 2.98Å; Y48-V52 WeakPolarHBondContact O-CB 3.4Å; Y48-V52 VanDerWaalsContact O-CG1 3.26Å; Y48-V52 WeakPolarHBondContact O-CG1 3.41Å; Y48-V52 PolarHBondContact O-N 3.42Å; Y48-I93 HydrophobicContact CD1-CG2 4.2Å; Y48-D96 WeakPolarHBondContact CE1-OD2 3.33Å; Y48-D96 PolarHBondContact OH-OD2 3.39Å; Y48-V97 HydrophobicContact CD1-CG2 3.13Å; Y48-V97 HydrophobicContact CD2-CG2 3.9Å; Y48-V97 HydrophobicContact CE1-CG2 3.41Å; Y48-V97 VanDerWaalsContact CE1-CG2 3.41Å; Y48-V97 HydrophobicContact CE2-CG2 4.15Å; Y48-V97 HydrophobicContact CG-CG2 3.38Å; Y48-L100 HydrophobicContact CE2-CD1 4.04Å; Y48-L100 WeakPolarHBondContact OH-CD1 3.32Å; Y48-Y125 VanDerWaalsContact C-OH 3.23Å; Y48-Y125 WeakPolarHBondContact CB-OH 3.44Å; Y48-Y125 PolarHBondContact O-OH 2.84Å
49K96.7Very high96.9Very high116 Ų11638 Ų3850%0.50421%0.211SC..Hα-helixtrans-57.3-44.3173.5-175.6-166.375.6172.40111.3S45 A47 G53 Y125S45-K49 WeakPolarHBondContact O-CB 3.33Å; S45-K49 PolarHBondContact O-N 3.48Å; A47-K49 PolarHBondContact O-N 3.07Å; K49-G53 WeakPolarHBondContact O-CA 3.34Å; K49-G53 PolarHBondContact O-N 3.26Å; K49-Y125 PolarHBondContact N-OH 2.56Å
50N97.4Very high97Very high48 Ų4838.3 Ų38.326%0.25721%0.208SC..Hα-helixtrans-71.6-43.4179.6-78.5-69.1000111.7Y19 V46 A47 Y48 G53 A54Y19-N50 HydrophobicContact CD1-CB 3.56Å; Y19-N50 HydrophobicContact CD2-CB 3.59Å; Y19-N50 HydrophobicContact CE1-CB 3.95Å; Y19-N50 WeakPolarHBondContact CE1-ND2 3.41Å; Y19-N50 HydrophobicContact CE2-CB 3.98Å; Y19-N50 HydrophobicContact CG-CB 3.34Å; V46-N50 PolarHBondContact O-N 3.12Å; V46-N50 VanDerWaalsContact O-N 3.15Å; V46-N50 PolarHBondContact O-ND2 3.09Å; A47-N50 PolarHBondContact O-N 3.35Å; Y48-N50 VanDerWaalsContact C-N 3.3Å; Y48-N50 PolarHBondContact O-N 3.4Å; N50-G53 PolarHBondContact O-N 3.33Å; N50-A54 PolarHBondContact O-N 3.48Å
51V97.6Very high97Very high6 Ų641.3 Ų41.34%0.03623%0.228CC..Hα-helixtrans-58.5-51.6177.6171.50000111.3Y19 D20 A23 A47 Y48 R55 I93Y19-V51 VanDerWaalsContact C-CG2 3.41Å; Y19-V51 VanDerWaalsContact O-CG2 3.31Å; Y19-V51 WeakPolarHBondContact O-CG2 3.49Å; D20-V51 WeakPolarHBondContact OD1-CG1 3.43Å; A23-V51 HydrophobicContact CB-CG2 4.09Å; A47-V51 WeakPolarHBondContact O-CG2 3.41Å; A47-V51 PolarHBondContact O-N 3.05Å; A47-V51 VanDerWaalsContact O-N 3.09Å; Y48-V51 PolarHBondContact O-N 2.98Å; V51-R55 VanDerWaalsContact O-CD 3.26Å; V51-R55 WeakPolarHBondContact O-CD 3.45Å; V51-I93 HydrophobicContact CG1-CD1 3.62Å; V51-I93 HydrophobicContact CG1-CG1 3.92Å; V51-I93 HydrophobicContact CG1-CG2 4.04Å
52V97.4Very high97Very high2 Ų241.7 Ų41.71%0.01223%0.23CC..Hα-helixtrans-70.5-35.4179.178.10000112Y48 A54 R55 R56 L90 I93 Y125 Y128Y48-V52 WeakPolarHBondContact O-CB 3.4Å; Y48-V52 VanDerWaalsContact O-CG1 3.26Å; Y48-V52 WeakPolarHBondContact O-CG1 3.41Å; Y48-V52 PolarHBondContact O-N 3.42Å; V52-A54 VanDerWaalsContact C-N 3.34Å; V52-A54 PolarHBondContact O-N 3.17Å; V52-R55 PolarHBondContact O-N 3.39Å; V52-R56 HydrophobicContact CG2-CG 4.36Å; V52-R56 WeakPolarHBondContact O-CB 2.98Å; V52-R56 WeakPolarHBondContact O-CG 3.41Å; V52-R56 PolarHBondContact O-N 2.97Å; V52-L90 HydrophobicContact CG2-CG 4.38Å; V52-I93 HydrophobicContact CB-CG2 4.02Å; V52-I93 HydrophobicContact CG2-CG2 4.31Å; V52-Y125 HydrophobicContact CB-CE1 4.21Å; V52-Y125 HydrophobicContact CG1-CE1 4.08Å; V52-Y125 HydrophobicContact CG2-CE1 4.36Å; V52-Y128 HydrophobicContact CG1-CD2 4.03Å; V52-Y128 HydrophobicContact CG1-CE2 3.85Å; V52-Y128 HydrophobicContact CG2-CD2 3.93Å
53G97Very high96.9Very high23 Ų2338.7 Ų38.724%0.23722%0.216CC..Hα-helixtrans-61.6-39.1178.700000113.1K49 N50 S57K49-G53 WeakPolarHBondContact O-CA 3.34Å; K49-G53 PolarHBondContact O-N 3.26Å; N50-G53 PolarHBondContact O-N 3.33Å; G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.25Å; G53-S57 PolarHBondContact O-OG 2.98Å
54A97.3Very high96.8Very high55 Ų5540.2 Ų40.246%0.45523%0.227SC..Hα-helixtrans-62.8-45.6174.100000111.7N50 V52 S57 A58N50-A54 PolarHBondContact O-N 3.48Å; V52-A54 VanDerWaalsContact C-N 3.34Å; V52-A54 PolarHBondContact O-N 3.17Å; A54-S57 PolarHBondContact O-N 3.37Å; A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 3.46Å
55R97.6Very high96.6Very high57 Ų5744.1 Ų44.122%0.21525%0.247CC..Hα-helixtrans-68.4-40.6179.6-83.869.6-177.3-169.9-2.3111.9D20 V51 V52 S57 A58 W59 V86 E89 L90 I93D20-R55 IonicContact OD1-CZ 3.43Å; D20-R55 IonicContact OD1-NH1 2.63Å; D20-R55 PolarHBondContact OD1-NH1 3.43Å; D20-R55 IonicContact OD1-NH2 3.87Å; D20-R55 PolarHBondContact OD1-NH2 3.26Å; D20-R55 IonicContact OD2-NH1 3.7Å; D20-R55 IonicContact OD2-NH2 3.73Å; V51-R55 VanDerWaalsContact O-CD 3.26Å; V51-R55 WeakPolarHBondContact O-CD 3.45Å; V52-R55 PolarHBondContact O-N 3.39Å; R55-S57 PolarHBondContact O-N 2.99Å; R55-A58 PolarHBondContact O-N 2.99Å; R55-W59 WeakPolarHBondContact O-CB 3.21Å; R55-W59 PolarHBondContact O-N 3.45Å; R55-V86 HydrophobicContact CB-CG1 4.46Å; R55-V86 WeakPolarHBondContact O-CG1 3.48Å; R55-E89 HydrophobicContact CG-CB 4.14Å; R55-E89 IonicContact NE-OE2 2.8Å; R55-E89 PolarHBondContact NE-OE2 2.88Å; R55-L90 HydrophobicContact CB-CB 4.41Å; R55-I93 HydrophobicContact CG-CD1 3.95Å
56R97.3Very high96.3Very high29 Ų2943.1 Ų43.111%0.10924%0.242CC..Hα-helixtrans-60.6-43.8174-75.517969.7-1375112.2V52 W59 R60 L90 E131V52-R56 HydrophobicContact CG2-CG 4.36Å; V52-R56 WeakPolarHBondContact O-CB 2.98Å; V52-R56 WeakPolarHBondContact O-CG 3.41Å; V52-R56 PolarHBondContact O-N 2.97Å; R56-W59 PolarHBondContact O-N 3.46Å; R56-R60 WeakPolarHBondContact O-CG 3.4Å; R56-R60 PolarHBondContact O-N 3.31Å; R56-L90 HydrophobicContact CB-CD1 4.48Å; R56-L90 HydrophobicContact CG-CD1 3.52Å; R56-L90 HydrophobicContact CG-CG 4.5Å; R56-E131 IonicContact CZ-OE1 3.91Å; R56-E131 IonicContact CZ-OE2 2.99Å; R56-E131 VanDerWaalsContact CZ-OE2 3.29Å; R56-E131 IonicContact NE-OE1 3.19Å; R56-E131 IonicContact NE-OE2 2.81Å; R56-E131 PolarHBondContact NE-OE2 2.84Å; R56-E131 IonicContact NH2-OE1 2.63Å; R56-E131 PolarHBondContact NH2-OE1 3.19Å; R56-E131 IonicContact NH2-OE2 3.62Å; R56-E131 PolarHBondContact NH2-OE2 2.9Å
57S97.2Very high95.9Very high66 Ų6649 Ų4946%0.46227%0.267SS..Hα-helixtrans-63.4-45.6176.6-60.90000111.6G53 A54 R55 W59 R60 V61G53-S57 WeakPolarHBondContact O-CB 3.46Å; G53-S57 PolarHBondContact O-N 3.25Å; G53-S57 PolarHBondContact O-OG 2.98Å; A54-S57 PolarHBondContact O-N 3.37Å; R55-S57 PolarHBondContact O-N 2.99Å; S57-W59 PolarHBondContact O-N 3.29Å; S57-R60 PolarHBondContact O-N 3.36Å; S57-V61 WeakPolarHBondContact O-CG2 3.45Å; S57-V61 PolarHBondContact O-N 3.4Å; S57-V61 VanDerWaalsContact O-N 3.17Å
58A97.3Very high95.6Very high41 Ų4156.6 Ų56.634%0.33930%0.3SS..Hα-helixtrans-59.6-46.1175.100000111.8A54 R55 R60 V61 I62 V86A54-A58 WeakPolarHBondContact O-CB 3.34Å; A54-A58 PolarHBondContact O-N 3.46Å; R55-A58 PolarHBondContact O-N 2.99Å; A58-R60 PolarHBondContact O-N 3.24Å; A58-V61 PolarHBondContact O-N 3.14Å; A58-I62 WeakPolarHBondContact O-CD1 3.2Å; A58-I62 VanDerWaalsContact O-CG1 3.24Å; A58-I62 WeakPolarHBondContact O-CG1 3.4Å; A58-I62 PolarHBondContact O-N 3.06Å; A58-V86 HydrophobicContact CB-CG1 4.28Å
59W96.9Very high95.1Very high43 Ų4358.1 Ų58.116%0.16331%0.31CS..Hα-helixtrans-59.1-46.8178.2179.179.9000112.1R55 R56 S57 V61 I62 S63 V86 E87 E131 V132R55-W59 WeakPolarHBondContact O-CB 3.21Å; R55-W59 PolarHBondContact O-N 3.45Å; R56-W59 PolarHBondContact O-N 3.46Å; S57-W59 PolarHBondContact O-N 3.29Å; W59-V61 VanDerWaalsContact C-N 3.32Å; W59-V61 PolarHBondContact O-N 3.26Å; W59-I62 PolarHBondContact O-N 2.91Å; W59-S63 WeakPolarHBondContact O-CB 3.31Å; W59-S63 PolarHBondContact O-N 3.01Å; W59-S63 PolarHBondContact O-OG 3.33Å; W59-S63 VanDerWaalsContact O-OG 3.09Å; W59-V86 HydrophobicContact CB-CG1 3.85Å; W59-E87 VanDerWaalsContact CD1-CG 3.42Å; W59-E87 VanDerWaalsContact NE1-CG 3.29Å; W59-E87 PolarHBondContact NE1-OE1 2.87Å; W59-E131 VanDerWaalsContact CH2-O 3.27Å; W59-E131 WeakPolarHBondContact CH2-O 3.46Å; W59-V132 HydrophobicContact CD2-CG1 3.87Å; W59-V132 HydrophobicContact CE3-CG1 4.37Å; W59-V132 HydrophobicContact CG-CG1 4.19Å; W59-V132 HydrophobicContact CH2-CG1 4.48Å; W59-V132 HydrophobicContact CZ2-CG1 4.01Å
60R95.3Very high94.4Very high112 Ų11261 Ų6142%0.42333%0.325SS..Hα-helixtrans-58.2-43.3176.9-73.8177.3-177.4147.3-8.4112.5R56 S57 A58 S64R56-R60 WeakPolarHBondContact O-CG 3.4Å; R56-R60 PolarHBondContact O-N 3.31Å; S57-R60 PolarHBondContact O-N 3.36Å; A58-R60 PolarHBondContact O-N 3.24Å; R60-S64 WeakPolarHBondContact O-CB 3.29Å; R60-S64 PolarHBondContact O-N 3.49Å
61V96.6Very high93.4Very high88 Ų8863.1 Ų63.153%0.53336%0.358SS..Hα-helixtrans-62.7-48.4177.8171.40000110.6S57 A58 W59 S64 I65S57-V61 WeakPolarHBondContact O-CG2 3.45Å; S57-V61 PolarHBondContact O-N 3.4Å; S57-V61 VanDerWaalsContact O-N 3.17Å; A58-V61 PolarHBondContact O-N 3.14Å; W59-V61 VanDerWaalsContact C-N 3.32Å; W59-V61 PolarHBondContact O-N 3.26Å; V61-S64 PolarHBondContact O-N 3.07Å; V61-I65 HydrophobicContact CG1-CD1 3.93Å; V61-I65 WeakPolarHBondContact O-CG1 3.39Å; V61-I65 PolarHBondContact O-N 3.4Å
62I95.4Very high92.9Very high14 Ų1464.8 Ų64.87%0.07237%0.37CS..Hα-helixtrans-64.6-43.4-179-62.6158.1000110.7A58 W59 S64 I65 G66 V79 Y82 R83 V86A58-I62 WeakPolarHBondContact O-CD1 3.2Å; A58-I62 VanDerWaalsContact O-CG1 3.24Å; A58-I62 WeakPolarHBondContact O-CG1 3.4Å; A58-I62 PolarHBondContact O-N 3.06Å; W59-I62 PolarHBondContact O-N 2.91Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 3.32Å; I62-I65 PolarHBondContact O-N 3.42Å; I62-G66 PolarHBondContact O-N 3.01Å; I62-V79 HydrophobicContact CG2-CG1 3.99Å; I62-Y82 HydrophobicContact CD1-CD1 3.39Å; I62-Y82 HydrophobicContact CD1-CE1 3.55Å; I62-Y82 HydrophobicContact CG1-CD1 3.9Å; I62-Y82 HydrophobicContact CG1-CE1 4.22Å; I62-R83 HydrophobicContact CG2-CB 3.72Å; I62-R83 HydrophobicContact CG2-CG 4.15Å; I62-V86 HydrophobicContact CD1-CB 4.28Å; I62-V86 HydrophobicContact CD1-CG2 3.58Å
63S93.4Very high92.6Very high20 Ų2071.5 Ų71.514%0.1441%0.406CS..Hα-helixtrans-59.1-42.4175.1-68.90000111.9W59 G66 Q67 R83W59-S63 WeakPolarHBondContact O-CB 3.31Å; W59-S63 PolarHBondContact O-N 3.01Å; W59-S63 PolarHBondContact O-OG 3.33Å; W59-S63 VanDerWaalsContact O-OG 3.09Å; S63-G66 PolarHBondContact O-N 3.35Å; S63-Q67 WeakPolarHBondContact O-CG 3.19Å; S63-Q67 PolarHBondContact O-N 2.95Å; S63-R83 WeakPolarHBondContact OG-CD 3.46Å
64S94.5Very high92.4Very high42 Ų4278.1 Ų78.129%0.29443%0.428SS..Hα-helixtrans-64.9-39.2175.5-170.70000112.7R60 V61 I62 G66 Q67 K68R60-S64 WeakPolarHBondContact O-CB 3.29Å; R60-S64 PolarHBondContact O-N 3.49Å; V61-S64 PolarHBondContact O-N 3.07Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 3.32Å; S64-G66 VanDerWaalsContact C-N 3.34Å; S64-Q67 PolarHBondContact O-N 3.49Å; S64-K68 WeakPolarHBondContact O-CG 3.36Å; S64-K68 PolarHBondContact O-N 3.02Å
65I94Very high92.1Very high85 Ų8581.9 Ų81.944%0.43643%0.434SS..Hα-helixtrans-63.1-43.3174.6-68.1165.6000110.3V61 I62 Q67 K68 T69 V79V61-I65 HydrophobicContact CG1-CD1 3.93Å; V61-I65 WeakPolarHBondContact O-CG1 3.39Å; V61-I65 PolarHBondContact O-N 3.4Å; I62-I65 PolarHBondContact O-N 3.42Å; I65-Q67 PolarHBondContact O-N 3.2Å; I65-K68 PolarHBondContact O-N 3.22Å; I65-T69 WeakPolarHBondContact O-CB 3.5Å; I65-T69 PolarHBondContact O-N 3.09Å; I65-T69 VanDerWaalsContact O-N 3.08Å; I65-T69 PolarHBondContact O-OG1 2.81Å; I65-V79 HydrophobicContact CG2-CG1 4.5Å; I65-V79 HydrophobicContact CG2-CG2 4Å
66G90.6Very high91.9Very high13 Ų1382.1 Ų82.113%0.13444%0.44CS..Hα-helixtrans-59.8-43.7178.200000112.6I62 S63 S64 K68 T69I62-G66 PolarHBondContact O-N 3.01Å; S63-G66 PolarHBondContact O-N 3.35Å; S64-G66 VanDerWaalsContact C-N 3.34Å; G66-K68 VanDerWaalsContact C-N 3.29Å; G66-K68 PolarHBondContact O-N 3.49Å; G66-T69 PolarHBondContact O-N 3.45Å
67Q88.7Confident91.7Very high164 Ų16483.4 Ų83.477%0.76646%0.456SS*.Hα-helixtrans-64.2-30.4177.2-72.4174.8-9.800113.6S63 S64 I65S63-Q67 WeakPolarHBondContact O-CG 3.19Å; S63-Q67 PolarHBondContact O-N 2.95Å; S64-Q67 PolarHBondContact O-N 3.49Å; I65-Q67 PolarHBondContact O-N 3.2Å
68K91.2Very high91.6Very high160 Ų16085.9 Ų85.970%0.69646%0.462SS*.Hα-helixtrans-92.3-5.1-179.3-66.8173.4-178.8171.50113.7S64 I65 G66 E70S64-K68 WeakPolarHBondContact O-CG 3.36Å; S64-K68 PolarHBondContact O-N 3.02Å; I65-K68 PolarHBondContact O-N 3.22Å; G66-K68 VanDerWaalsContact C-N 3.29Å; G66-K68 PolarHBondContact O-N 3.49Å; K68-E70 PolarHBondContact O-N 2.81Å
69T87.2Confident91.5Very high36 Ų3685 Ų8522%0.22145%0.453CS..  trans-85.7107.3-175.9-64.30000110.1I65 G66 K75I65-T69 WeakPolarHBondContact O-CB 3.5Å; I65-T69 PolarHBondContact O-N 3.09Å; I65-T69 VanDerWaalsContact O-N 3.08Å; I65-T69 PolarHBondContact O-OG1 2.81Å; G66-T69 PolarHBondContact O-N 3.45Å; T69-K75 HydrophobicContact CG2-CB 3.94Å
70E83.1Confident91.4Very high177 Ų17785.3 Ų85.383%0.82746%0.457SS*.  trans-110.5155.4176.5-64.2-177.2179.800112.4K68 S72K68-E70 PolarHBondContact O-N 2.81Å; E70-S72 VanDerWaalsContact C-N 3.3Å; E70-S72 PolarHBondContact O-N 2.94Å; E70-S72 VanDerWaalsContact O-N 3.16Å
71G76.6Confident91.4Very high92 Ų9286.6 Ų86.695%0.94847%0.468SS*.SBendtrans70.810.7163.300000117.1
72S87.3Confident91.4Very high42 Ų4288.7 Ų88.729%0.29447%0.468SS..  trans-14798.8175.2-172.60000113E70 K74 K75 L76E70-S72 VanDerWaalsContact C-N 3.3Å; E70-S72 PolarHBondContact O-N 2.94Å; E70-S72 VanDerWaalsContact O-N 3.16Å; S72-K74 PolarHBondContact O-N 2.63Å; S72-K75 PolarHBondContact O-N 3.22Å; S72-L76 PolarHBondContact O-N 3.32Å
73D89.9Confident91.4Very high143 Ų14391.6 Ų91.677%0.76548%0.477SS*.Hα-helixtrans-55.9-36.2178.7-60.9-21.5000112.7L76 A77D73-L76 PolarHBondContact O-N 3.3Å; D73-A77 WeakPolarHBondContact O-CB 3.37Å; D73-A77 PolarHBondContact O-N 3.4Å
74K92.9Very high91.5Very high162 Ų16296 Ų9670%0.70450%0.496SS*.Hα-helixtrans-64.7-42.8177.6-173.7177.9179.5179.90112.3S72 M78S72-K74 PolarHBondContact O-N 2.63Å; K74-M78 WeakPolarHBondContact O-CG 3.38Å; K74-M78 PolarHBondContact O-N 3.44Å; K74-M78 VanDerWaalsContact O-N 3.15Å
75K91.6Very high91.7Very high134 Ų13499.7 Ų99.758%0.58351%0.507SS*.Hα-helixtrans-67.7-42.2177.6-71.3-177.2180179.10110.6T69 S72 A77 M78 V79T69-K75 HydrophobicContact CG2-CB 3.94Å; S72-K75 PolarHBondContact O-N 3.22Å; K75-A77 VanDerWaalsContact C-N 3.33Å; K75-A77 PolarHBondContact O-N 2.91Å; K75-M78 PolarHBondContact O-N 3.31Å; K75-V79 WeakPolarHBondContact O-CG2 3.33Å; K75-V79 PolarHBondContact O-N 3.03Å
76L92.7Very high91.8Very high62 Ų6296 Ų9633%0.32549%0.488SS..Hα-helixtrans-61.4-42.3177.8-172.962.4000111.6S72 D73 M78 V79 N80S72-L76 PolarHBondContact O-N 3.32Å; D73-L76 PolarHBondContact O-N 3.3Å; L76-M78 PolarHBondContact O-N 2.97Å; L76-V79 PolarHBondContact O-N 3.39Å; L76-N80 WeakPolarHBondContact O-CB 3.31Å; L76-N80 VanDerWaalsContact O-CG 3.3Å; L76-N80 PolarHBondContact O-N 3.39Å; L76-N80 PolarHBondContact O-ND2 3.18Å
77A94.4Very high92.1Very high56 Ų5696.4 Ų96.446%0.46349%0.486SS..Hα-helixtrans-59.7-46.2174.500000112.3D73 K75 V79 N80 E81D73-A77 WeakPolarHBondContact O-CB 3.37Å; D73-A77 PolarHBondContact O-N 3.4Å; K75-A77 VanDerWaalsContact C-N 3.33Å; K75-A77 PolarHBondContact O-N 2.91Å; A77-V79 VanDerWaalsContact C-N 3.34Å; A77-V79 PolarHBondContact O-N 2.91Å; A77-N80 PolarHBondContact O-N 2.63Å; A77-E81 WeakPolarHBondContact O-CB 3.47Å; A77-E81 PolarHBondContact O-N 3.09Å
78M94.8Very high92.5Very high117 Ų11789.3 Ų89.358%0.57646%0.457SS*.Hα-helixtrans-62.7-39.2177.4-69.6176.167.900112.6K74 K75 L76 Y82K74-M78 WeakPolarHBondContact O-CG 3.38Å; K74-M78 PolarHBondContact O-N 3.44Å; K74-M78 VanDerWaalsContact O-N 3.15Å; K75-M78 PolarHBondContact O-N 3.31Å; L76-M78 PolarHBondContact O-N 2.97Å; M78-Y82 WeakPolarHBondContact O-CB 3.04Å; M78-Y82 PolarHBondContact O-N 3.41Å; M78-Y82 VanDerWaalsContact O-N 3.1Å
79V95.2Very high92.8Very high24 Ų2484.9 Ų84.915%0.14544%0.439CS..Hα-helixtrans-66.8-43.3177.4172.80000110.8I62 I65 K75 L76 A77 Y82 R83I62-V79 HydrophobicContact CG2-CG1 3.99Å; I65-V79 HydrophobicContact CG2-CG1 4.5Å; I65-V79 HydrophobicContact CG2-CG2 4Å; K75-V79 WeakPolarHBondContact O-CG2 3.33Å; K75-V79 PolarHBondContact O-N 3.03Å; L76-V79 PolarHBondContact O-N 3.39Å; A77-V79 VanDerWaalsContact C-N 3.34Å; A77-V79 PolarHBondContact O-N 2.91Å; V79-Y82 PolarHBondContact O-N 3.45Å; V79-R83 WeakPolarHBondContact O-CB 3.43Å; V79-R83 PolarHBondContact O-N 3.47Å
80N93.6Very high93.3Very high49 Ų4983.1 Ų83.126%0.26243%0.428SS..Hα-helixtrans-64.2-45.3178.1-71.9-22.4000111.9L76 A77 Y82 R83 E84L76-N80 WeakPolarHBondContact O-CB 3.31Å; L76-N80 VanDerWaalsContact O-CG 3.3Å; L76-N80 PolarHBondContact O-N 3.39Å; L76-N80 PolarHBondContact O-ND2 3.18Å; A77-N80 PolarHBondContact O-N 2.63Å; N80-Y82 VanDerWaalsContact C-N 3.31Å; N80-Y82 PolarHBondContact O-N 3.42Å; N80-R83 WeakPolarHBondContact O-CB 3.31Å; N80-R83 PolarHBondContact O-N 3.39Å; N80-R83 VanDerWaalsContact O-N 3.16Å; N80-E84 WeakPolarHBondContact O-CG 3.26Å; N80-E84 PolarHBondContact O-N 2.93Å
81E96.3Very high93.9Very high139 Ų13979.7 Ų79.765%0.6541%0.408SS*.Hα-helixtrans-57.9-44.6176-176.8-175.2171.700111.4A77 E84 K85A77-E81 WeakPolarHBondContact O-CB 3.47Å; A77-E81 PolarHBondContact O-N 3.09Å; E81-E84 PolarHBondContact O-N 3.3Å; E81-K85 PolarHBondContact O-N 3.5Å; E81-K85 VanDerWaalsContact O-N 3.08Å
82Y96.9Very high94.9Very high132 Ų13280.5 Ų80.552%0.51839%0.39SS..Hα-helixtrans-70.1-34.2178.7-160.6-112.1000112.4I62 M78 V79 N80 K85 V86I62-Y82 HydrophobicContact CD1-CD1 3.39Å; I62-Y82 HydrophobicContact CD1-CE1 3.55Å; I62-Y82 HydrophobicContact CG1-CD1 3.9Å; I62-Y82 HydrophobicContact CG1-CE1 4.22Å; M78-Y82 WeakPolarHBondContact O-CB 3.04Å; M78-Y82 PolarHBondContact O-N 3.41Å; M78-Y82 VanDerWaalsContact O-N 3.1Å; V79-Y82 PolarHBondContact O-N 3.45Å; N80-Y82 VanDerWaalsContact C-N 3.31Å; N80-Y82 PolarHBondContact O-N 3.42Å; Y82-K85 HydrophobicContact CE2-CD 4.44Å; Y82-K85 PolarHBondContact O-N 3.44Å; Y82-V86 HydrophobicContact CE1-CG2 4.44Å; Y82-V86 WeakPolarHBondContact O-CG2 3.43Å; Y82-V86 PolarHBondContact O-N 2.83Å
83R95.5Very high95.4Very high74 Ų7479.6 Ų79.628%0.27938%0.382SS..Hα-helixtrans-61.9-50.2173.3-164.9-172.871.7-149.8-7110.7I62 S63 V79 N80 K85 V86 E87I62-R83 HydrophobicContact CG2-CB 3.72Å; I62-R83 HydrophobicContact CG2-CG 4.15Å; S63-R83 WeakPolarHBondContact OG-CD 3.46Å; V79-R83 WeakPolarHBondContact O-CB 3.43Å; V79-R83 PolarHBondContact O-N 3.47Å; N80-R83 WeakPolarHBondContact O-CB 3.31Å; N80-R83 PolarHBondContact O-N 3.39Å; N80-R83 VanDerWaalsContact O-N 3.16Å; R83-K85 VanDerWaalsContact C-N 3.26Å; R83-K85 PolarHBondContact O-N 2.89Å; R83-V86 PolarHBondContact O-N 3.15Å; R83-V86 VanDerWaalsContact O-N 3.09Å; R83-E87 WeakPolarHBondContact CD-OE1 3.27Å; R83-E87 WeakPolarHBondContact CG-OE1 3.47Å; R83-E87 IonicContact CZ-OE1 3.85Å; R83-E87 IonicContact NE-OE1 2.94Å; R83-E87 PolarHBondContact NE-OE1 2.88Å; R83-E87 WeakPolarHBondContact O-CG 3.39Å; R83-E87 PolarHBondContact O-N 2.91Å
84E95.4Very high95.8Very high113 Ų11372.8 Ų72.853%0.52835%0.346SS..Hα-helixtrans-59.6-36.9179.1-74.7175.2-169.700112.2N80 E81 E87 G88N80-E84 WeakPolarHBondContact O-CG 3.26Å; N80-E84 PolarHBondContact O-N 2.93Å; E81-E84 PolarHBondContact O-N 3.3Å; E84-E87 PolarHBondContact O-N 2.92Å; E84-G88 PolarHBondContact O-N 3Å
85K97.3Very high96.1Very high120 Ų12069.1 Ų69.152%0.52233%0.334SS..Hα-helixtrans-59.7-50172.8-177.4-177.9175.8-175.90111.8E81 Y82 R83 E87 G88 E89E81-K85 PolarHBondContact O-N 3.5Å; E81-K85 VanDerWaalsContact O-N 3.08Å; Y82-K85 HydrophobicContact CE2-CD 4.44Å; Y82-K85 PolarHBondContact O-N 3.44Å; R83-K85 VanDerWaalsContact C-N 3.26Å; R83-K85 PolarHBondContact O-N 2.89Å; K85-E87 VanDerWaalsContact C-N 3.33Å; K85-E87 PolarHBondContact O-N 3.33Å; K85-G88 PolarHBondContact O-N 3.39Å; K85-E89 WeakPolarHBondContact CE-OE1 3.06Å; K85-E89 PolarHBondContact O-N 3.15Å
86V97.4Very high96.3Very high6 Ų664.4 Ų64.44%0.03632%0.315CS..Hα-helixtrans-66.5-36.5179.7177.50000111.5R55 A58 W59 I62 Y82 R83 G88 E89 L90R55-V86 HydrophobicContact CB-CG1 4.46Å; R55-V86 WeakPolarHBondContact O-CG1 3.48Å; A58-V86 HydrophobicContact CB-CG1 4.28Å; W59-V86 HydrophobicContact CB-CG1 3.85Å; I62-V86 HydrophobicContact CD1-CB 4.28Å; I62-V86 HydrophobicContact CD1-CG2 3.58Å; Y82-V86 HydrophobicContact CE1-CG2 4.44Å; Y82-V86 WeakPolarHBondContact O-CG2 3.43Å; Y82-V86 PolarHBondContact O-N 2.83Å; R83-V86 PolarHBondContact O-N 3.15Å; R83-V86 VanDerWaalsContact O-N 3.09Å; V86-G88 VanDerWaalsContact C-N 3.31Å; V86-G88 PolarHBondContact O-N 3.09Å; V86-E89 PolarHBondContact O-N 3.4Å; V86-L90 WeakPolarHBondContact O-CB 3.39Å; V86-L90 PolarHBondContact O-N 3.19Å
87E96.3Very high96.6Very high23 Ų2361.5 Ų61.511%0.10730%0.3CS..Hα-helixtrans-61.9-39.6172.6-69.3170.5-176.100111.7W59 R83 E84 K85 L90 R91 V132W59-E87 VanDerWaalsContact CD1-CG 3.42Å; W59-E87 VanDerWaalsContact NE1-CG 3.29Å; W59-E87 PolarHBondContact NE1-OE1 2.87Å; R83-E87 WeakPolarHBondContact CD-OE1 3.27Å; R83-E87 WeakPolarHBondContact CG-OE1 3.47Å; R83-E87 IonicContact CZ-OE1 3.85Å; R83-E87 IonicContact NE-OE1 2.94Å; R83-E87 PolarHBondContact NE-OE1 2.88Å; R83-E87 WeakPolarHBondContact O-CG 3.39Å; R83-E87 PolarHBondContact O-N 2.91Å; E84-E87 PolarHBondContact O-N 2.92Å; K85-E87 VanDerWaalsContact C-N 3.33Å; K85-E87 PolarHBondContact O-N 3.33Å; E87-L90 PolarHBondContact O-N 3.38Å; E87-R91 WeakPolarHBondContact O-CB 3.4Å; E87-R91 WeakPolarHBondContact O-CG 3.2Å; E87-R91 PolarHBondContact O-N 3.42Å; E87-R91 PolarHBondContact O-NE 2.88Å; E87-V132 HydrophobicContact CG-CB 4.09Å; E87-V132 HydrophobicContact CG-CG1 4.25Å
88G96.9Very high96.8Very high15 Ų1559.2 Ų59.216%0.15528%0.28CS..Hα-helixtrans-59.4-51.8172.900000112.1E84 K85 V86 L90 R91 D92E84-G88 PolarHBondContact O-N 3Å; K85-G88 PolarHBondContact O-N 3.39Å; V86-G88 VanDerWaalsContact C-N 3.31Å; V86-G88 PolarHBondContact O-N 3.09Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 2.81Å; G88-R91 PolarHBondContact O-N 3.19Å; G88-D92 VanDerWaalsContact O-CG 3.31Å; G88-D92 PolarHBondContact O-N 3.28Å
89E97.7Very high96.9Very high66 Ų6658.3 Ų58.331%0.30827%0.274SS..Hα-helixtrans-58.3-43.8177.2-66.8176.4-160.300111.9R55 K85 V86 D92 I93R55-E89 HydrophobicContact CG-CB 4.14Å; R55-E89 IonicContact NE-OE2 2.8Å; R55-E89 PolarHBondContact NE-OE2 2.88Å; K85-E89 WeakPolarHBondContact CE-OE1 3.06Å; K85-E89 PolarHBondContact O-N 3.15Å; V86-E89 PolarHBondContact O-N 3.4Å; E89-D92 PolarHBondContact O-N 3.02Å; E89-I93 VanDerWaalsContact O-CD1 3.29Å; E89-I93 WeakPolarHBondContact O-CD1 3.47Å; E89-I93 VanDerWaalsContact O-CG1 3.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.02Å; E89-I93 PolarHBondContact O-N 2.95Å
90L97Very high97.1Very high0 Ų057.2 Ų57.20%027%0.267CS..Hα-helixtrans-62.8-44.3177.7-171.6156.9000111.4V52 R55 R56 V86 E87 G88 I93 C94 V132V52-L90 HydrophobicContact CG2-CG 4.38Å; R55-L90 HydrophobicContact CB-CB 4.41Å; R56-L90 HydrophobicContact CB-CD1 4.48Å; R56-L90 HydrophobicContact CG-CD1 3.52Å; R56-L90 HydrophobicContact CG-CG 4.5Å; V86-L90 WeakPolarHBondContact O-CB 3.39Å; V86-L90 PolarHBondContact O-N 3.19Å; E87-L90 PolarHBondContact O-N 3.38Å; G88-L90 VanDerWaalsContact C-N 3.32Å; G88-L90 PolarHBondContact O-N 2.81Å; L90-I93 PolarHBondContact O-N 3.32Å; L90-C94 PolarHBondContact O-N 2.96Å; L90-C94 PolarHBondContact O-SG 3.14Å; L90-V132 HydrophobicContact CD1-CG1 3.94Å; L90-V132 HydrophobicContact CD2-CG1 4.32Å; L90-V132 HydrophobicContact CD2-CG2 3.92Å
91R96.9Very high97.3Very high104 Ų10455 Ų5539%0.39226%0.255SS..Hα-helixtrans-59.6-45.9176.8-81.7-177-91.3116.2-6.7111.4E87 G88 C94 N95 L129 V132E87-R91 WeakPolarHBondContact O-CB 3.4Å; E87-R91 WeakPolarHBondContact O-CG 3.2Å; E87-R91 PolarHBondContact O-N 3.42Å; E87-R91 PolarHBondContact O-NE 2.88Å; G88-R91 PolarHBondContact O-N 3.19Å; R91-C94 PolarHBondContact O-N 2.92Å; R91-N95 WeakPolarHBondContact O-CB 3.48Å; R91-N95 VanDerWaalsContact O-CG 3.28Å; R91-N95 PolarHBondContact O-N 3.21Å; R91-N95 PolarHBondContact O-ND2 3.23Å; R91-L129 HydrophobicContact CB-CD2 4.22Å; R91-L129 HydrophobicContact CG-CD2 3.76Å; R91-V132 HydrophobicContact CG-CG2 4.37Å
92D97.6Very high97.3Very high110 Ų11051 Ų5159%0.58824%0.239SC*.Hα-helixtrans-62.7-45.9179.6-67.4-17.3000111.4G88 E89 C94 N95 D96G88-D92 VanDerWaalsContact O-CG 3.31Å; G88-D92 PolarHBondContact O-N 3.28Å; E89-D92 PolarHBondContact O-N 3.02Å; D92-C94 VanDerWaalsContact C-N 3.35Å; D92-C94 PolarHBondContact O-N 2.69Å; D92-N95 PolarHBondContact O-N 3.35Å; D92-D96 WeakPolarHBondContact O-CB 3.4Å; D92-D96 PolarHBondContact O-N 3.46Å
93I98.1Very high97.2Very high23 Ų2350.1 Ų50.112%0.11824%0.238CC..Hα-helixtrans-60.3-44.2176.6-66.9157.1000111.1Y48 V51 V52 R55 E89 L90 D96 V97Y48-I93 HydrophobicContact CD1-CG2 4.2Å; V51-I93 HydrophobicContact CG1-CD1 3.62Å; V51-I93 HydrophobicContact CG1-CG1 3.92Å; V51-I93 HydrophobicContact CG1-CG2 4.04Å; V52-I93 HydrophobicContact CB-CG2 4.02Å; V52-I93 HydrophobicContact CG2-CG2 4.31Å; R55-I93 HydrophobicContact CG-CD1 3.95Å; E89-I93 VanDerWaalsContact O-CD1 3.29Å; E89-I93 WeakPolarHBondContact O-CD1 3.47Å; E89-I93 VanDerWaalsContact O-CG1 3.23Å; E89-I93 WeakPolarHBondContact O-CG1 3.02Å; E89-I93 PolarHBondContact O-N 2.95Å; L90-I93 PolarHBondContact O-N 3.32Å; I93-D96 PolarHBondContact O-N 2.94Å; I93-V97 WeakPolarHBondContact O-CG2 3.36Å; I93-V97 PolarHBondContact O-N 3.05Å
94C97.9Very high97.2Very high0 Ų048.6 Ų48.60%023%0.232CC..Hα-helixtrans-67.7-43.4-179.1-64.80000111.8L90 R91 D92 D96 V97 L98 Y125 L129L90-C94 PolarHBondContact O-N 2.96Å; L90-C94 PolarHBondContact O-SG 3.14Å; R91-C94 PolarHBondContact O-N 2.92Å; D92-C94 VanDerWaalsContact C-N 3.35Å; D92-C94 PolarHBondContact O-N 2.69Å; C94-D96 VanDerWaalsContact C-N 3.31Å; C94-D96 PolarHBondContact O-N 3.46Å; C94-V97 PolarHBondContact O-N 3.23Å; C94-L98 WeakPolarHBondContact O-CB 3.46Å; C94-L98 WeakPolarHBondContact O-CG 3.47Å; C94-L98 PolarHBondContact O-N 3.47Å; C94-Y125 HydrophobicContact CB-CD1 4.08Å; C94-L129 HydrophobicContact CB-CD1 4.01Å; C94-L129 HydrophobicContact CB-CD2 3.63Å; C94-L129 HydrophobicContact CB-CG 3.58Å
95N97.6Very high97.2Very high84 Ų8443.4 Ų43.445%0.44921%0.208SC..Hα-helixtrans-63.9-37.9178-73.4-29.5000111.9R91 D92 L98 E99R91-N95 WeakPolarHBondContact O-CB 3.48Å; R91-N95 VanDerWaalsContact O-CG 3.28Å; R91-N95 PolarHBondContact O-N 3.21Å; R91-N95 PolarHBondContact O-ND2 3.23Å; D92-N95 PolarHBondContact O-N 3.35Å; N95-L98 PolarHBondContact O-N 2.92Å; N95-E99 WeakPolarHBondContact O-CB 3.42Å; N95-E99 PolarHBondContact O-N 3.11Å
96D97.7Very high97.1Very high35 Ų3538.8 Ų38.819%0.18719%0.189CC..Hα-helixtrans-57.7-49.8174.6-17138.6000111.5K27 Y48 D92 I93 C94 L98 E99 L100K27-D96 WeakPolarHBondContact CD-OD1 3.45Å; K27-D96 WeakPolarHBondContact CE-OD1 3.38Å; K27-D96 IonicContact NZ-OD1 3.47Å; K27-D96 PolarHBondContact NZ-OD1 2.97Å; K27-D96 IonicContact NZ-OD2 3.73Å; Y48-D96 WeakPolarHBondContact CE1-OD2 3.33Å; Y48-D96 PolarHBondContact OH-OD2 3.39Å; D92-D96 WeakPolarHBondContact O-CB 3.4Å; D92-D96 PolarHBondContact O-N 3.46Å; I93-D96 PolarHBondContact O-N 2.94Å; C94-D96 VanDerWaalsContact C-N 3.31Å; C94-D96 PolarHBondContact O-N 3.46Å; D96-L98 PolarHBondContact O-N 3.31Å; D96-E99 PolarHBondContact O-N 3.48Å; D96-L100 WeakPolarHBondContact O-CG 3.43Å; D96-L100 PolarHBondContact O-N 3.04Å; D96-L100 VanDerWaalsContact O-N 3.09Å
97V98.2Very high96.7Very high2 Ų246.2 Ų46.21%0.01222%0.223CC..Hα-helixtrans-64.5-42.9177.1175.80000112.1Y48 I93 C94 E99 L100 L101 M121 Y125Y48-V97 HydrophobicContact CD1-CG2 3.13Å; Y48-V97 HydrophobicContact CD2-CG2 3.9Å; Y48-V97 HydrophobicContact CE1-CG2 3.41Å; Y48-V97 VanDerWaalsContact CE1-CG2 3.41Å; Y48-V97 HydrophobicContact CE2-CG2 4.15Å; Y48-V97 HydrophobicContact CG-CG2 3.38Å; I93-V97 WeakPolarHBondContact O-CG2 3.36Å; I93-V97 PolarHBondContact O-N 3.05Å; C94-V97 PolarHBondContact O-N 3.23Å; V97-E99 VanDerWaalsContact C-N 3.28Å; V97-E99 PolarHBondContact O-N 2.88Å; V97-L100 PolarHBondContact O-N 3.19Å; V97-L101 HydrophobicContact CG1-CD1 3.68Å; V97-L101 HydrophobicContact CG1-CG 4.08Å; V97-L101 WeakPolarHBondContact O-CB 3.3Å; V97-L101 VanDerWaalsContact O-CG 3.25Å; V97-L101 WeakPolarHBondContact O-CG 3.25Å; V97-L101 PolarHBondContact O-N 3.41Å; V97-M121 HydrophobicContact CG1-CE 3.78Å; V97-Y125 HydrophobicContact CB-CD1 3.99Å; V97-Y125 HydrophobicContact CB-CD2 4.13Å; V97-Y125 HydrophobicContact CB-CE1 4.03Å; V97-Y125 HydrophobicContact CB-CE2 4.25Å; V97-Y125 HydrophobicContact CB-CG 4.04Å; V97-Y125 HydrophobicContact CG1-CD1 4.22Å; V97-Y125 HydrophobicContact CG1-CD2 3.45Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.45Å; V97-Y125 HydrophobicContact CG1-CE1 4.23Å; V97-Y125 HydrophobicContact CG1-CE2 3.54Å; V97-Y125 HydrophobicContact CG1-CG 3.85Å; V97-Y125 HydrophobicContact CG2-CD1 4.16Å; V97-Y125 HydrophobicContact CG2-CE1 3.71Å; V97-Y125 HydrophobicContact CG2-CE2 4.31Å
98L98.3Very high96.4Very high7 Ų748.8 Ų48.84%0.03724%0.238CC..Hα-helixtrans-62.7-37.3179.2-71.3171.5000111.6C94 N95 D96 N102 K122 Y126 L129C94-L98 WeakPolarHBondContact O-CB 3.46Å; C94-L98 WeakPolarHBondContact O-CG 3.47Å; C94-L98 PolarHBondContact O-N 3.47Å; N95-L98 PolarHBondContact O-N 2.92Å; D96-L98 PolarHBondContact O-N 3.31Å; L98-N102 WeakPolarHBondContact O-CB 3.21Å; L98-N102 VanDerWaalsContact O-CG 3.28Å; L98-N102 PolarHBondContact O-N 3.05Å; L98-N102 PolarHBondContact O-ND2 3.34Å; L98-K122 HydrophobicContact CD2-CG 3.87Å; L98-Y126 HydrophobicContact CD1-CD1 3.85Å; L98-Y126 HydrophobicContact CD1-CE1 3.6Å; L98-Y126 HydrophobicContact CD1-CE2 4.28Å; L98-Y126 HydrophobicContact CD1-CG 4.29Å; L98-Y126 HydrophobicContact CD2-CD2 3.76Å; L98-Y126 HydrophobicContact CD2-CE1 4.39Å; L98-Y126 HydrophobicContact CD2-CE2 3.55Å; L98-Y126 HydrophobicContact CD2-CG 4.25Å; L98-L129 HydrophobicContact CD1-CD1 3.63Å
99E97.9Very high96Very high98 Ų9848.9 Ų48.946%0.45824%0.236SC..Hα-helixtrans-62.8-47.6172.8-172.9177.2172.500110.9N95 D96 V97 L101 N102 K103N95-E99 WeakPolarHBondContact O-CB 3.42Å; N95-E99 PolarHBondContact O-N 3.11Å; D96-E99 PolarHBondContact O-N 3.48Å; V97-E99 VanDerWaalsContact C-N 3.28Å; V97-E99 PolarHBondContact O-N 2.88Å; E99-L101 VanDerWaalsContact C-N 3.33Å; E99-L101 PolarHBondContact O-N 2.98Å; E99-N102 PolarHBondContact O-N 3.45Å; E99-K103 WeakPolarHBondContact O-CB 3.49Å; E99-K103 PolarHBondContact O-N 2.91Å
100L97.9Very high95.6Very high2 Ų251.1 Ų51.11%0.0125%0.254CS..Hα-helixtrans-58.9-45177.9-67.1178.8000112.4K27 T30 E31 Y48 D96 V97 Y104 L105K27-L100 HydrophobicContact CB-CD1 4.24Å; K27-L100 HydrophobicContact CG-CD1 4.08Å; K27-L100 HydrophobicContact CG-CD2 4.17Å; T30-L100 HydrophobicContact CG2-CB 4.22Å; T30-L100 HydrophobicContact CG2-CD2 3.99Å; E31-L100 HydrophobicContact CG-CD2 3.78Å; Y48-L100 HydrophobicContact CE2-CD1 4.04Å; Y48-L100 WeakPolarHBondContact OH-CD1 3.32Å; D96-L100 WeakPolarHBondContact O-CG 3.43Å; D96-L100 PolarHBondContact O-N 3.04Å; D96-L100 VanDerWaalsContact O-N 3.09Å; V97-L100 PolarHBondContact O-N 3.19Å; L100-Y104 HydrophobicContact CD2-CD2 3.98Å; L100-Y104 HydrophobicContact CD2-CE2 4.1Å; L100-Y104 PolarHBondContact O-N 3.49Å; L100-L105 PolarHBondContact O-N 3.42Å
101L97.8Very high95.3Very high1 Ų154.2 Ų54.21%0.00527%0.271CS..Iπ-helixtrans-62-48.9179.9-72.2169.1000111.7V97 E99 L105 I106 Y118 M121 K122V97-L101 HydrophobicContact CG1-CD1 3.68Å; V97-L101 HydrophobicContact CG1-CG 4.08Å; V97-L101 WeakPolarHBondContact O-CB 3.3Å; V97-L101 VanDerWaalsContact O-CG 3.25Å; V97-L101 WeakPolarHBondContact O-CG 3.25Å; V97-L101 PolarHBondContact O-N 3.41Å; E99-L101 VanDerWaalsContact C-N 3.33Å; E99-L101 PolarHBondContact O-N 2.98Å; L101-L105 HydrophobicContact CD2-CB 4.45Å; L101-L105 HydrophobicContact CD2-CD1 3.89Å; L101-L105 PolarHBondContact O-N 3.17Å; L101-I106 HydrophobicContact CB-CD1 4.04Å; L101-I106 HydrophobicContact CB-CG1 4.45Å; L101-I106 WeakPolarHBondContact O-CB 3.46Å; L101-I106 WeakPolarHBondContact O-CG1 3.22Å; L101-I106 PolarHBondContact O-N 3.31Å; L101-Y118 HydrophobicContact CD2-CD1 3.79Å; L101-Y118 HydrophobicContact CD2-CG 4.16Å; L101-M121 HydrophobicContact CD1-CB 4.19Å; L101-M121 HydrophobicContact CD1-CG 4.13Å; L101-M121 HydrophobicContact CD2-CB 4.22Å; L101-M121 HydrophobicContact CD2-CG 4.39Å; L101-M121 HydrophobicContact CD2-SD 4.21Å; L101-K122 HydrophobicContact CD1-CB 3.94Å
102N96.2Very high95.1Very high57 Ų5750.7 Ų50.731%0.30526%0.264SS..Iπ-helixtrans-71.7-41-176.4-69.9-40.6000112.1L98 E99 K122L98-N102 WeakPolarHBondContact O-CB 3.21Å; L98-N102 VanDerWaalsContact O-CG 3.28Å; L98-N102 PolarHBondContact O-N 3.05Å; L98-N102 PolarHBondContact O-ND2 3.34Å; E99-N102 PolarHBondContact O-N 3.45Å; N102-K122 VanDerWaalsContact OD1-CE 3.32Å; N102-K122 WeakPolarHBondContact OD1-CE 3.24Å; N102-K122 PolarHBondContact OD1-NZ 3.12Å
103K95.5Very high94.9Very high113 Ų11348.2 Ų48.249%0.49125%0.249SC..Iπ-helixtrans-87.4-31.5-170.7-172.8174.9175.2-167.60114.2E99E99-K103 WeakPolarHBondContact O-CB 3.49Å; E99-K103 PolarHBondContact O-N 2.91Å
104Y95.6Very high94.8Very high41 Ų4147.1 Ų47.116%0.16124%0.243CC..Iπ-helixtrans-124.4-27.5-170.6-56.4-82.8000114.5T30 E31 L100 N108T30-Y104 HydrophobicContact CG2-CD2 4.45Å; T30-Y104 HydrophobicContact CG2-CG 4.36Å; E31-Y104 HydrophobicContact CG-CE2 3.87Å; L100-Y104 HydrophobicContact CD2-CD2 3.98Å; L100-Y104 HydrophobicContact CD2-CE2 4.1Å; L100-Y104 PolarHBondContact O-N 3.49Å; Y104-N108 WeakPolarHBondContact O-CB 3.43Å; Y104-N108 PolarHBondContact O-ND2 2.66Å
105L96.1Very high94.7Very high5 Ų551.3 Ų51.33%0.02626%0.261CS..Iπ-helixtrans-105.4-52.8-167.3-59.9172.1000113.5T30 L36 L44 L100 L101 N108 S109 Y118T30-L105 HydrophobicContact CG2-CD1 4.05Å; T30-L105 HydrophobicContact CG2-CD2 3.72Å; T30-L105 HydrophobicContact CG2-CG 3.82Å; L36-L105 HydrophobicContact CD1-CD2 3.63Å; L36-L105 HydrophobicContact CG-CD2 3.81Å; L44-L105 HydrophobicContact CD2-CD1 3.6Å; L100-L105 PolarHBondContact O-N 3.42Å; L101-L105 HydrophobicContact CD2-CB 4.45Å; L101-L105 HydrophobicContact CD2-CD1 3.89Å; L101-L105 PolarHBondContact O-N 3.17Å; L105-N108 PolarHBondContact O-N 2.87Å; L105-S109 WeakPolarHBondContact O-CB 3.27Å; L105-S109 PolarHBondContact O-N 2.8Å; L105-S109 VanDerWaalsContact O-N 3.08Å; L105-Y118 HydrophobicContact CB-CD1 3.97Å; L105-Y118 HydrophobicContact CB-CD2 3.9Å; L105-Y118 HydrophobicContact CB-CE1 4.03Å; L105-Y118 HydrophobicContact CB-CE2 3.98Å; L105-Y118 HydrophobicContact CB-CG 3.93Å; L105-Y118 HydrophobicContact CD1-CD1 4.02Å; L105-Y118 HydrophobicContact CD1-CE1 3.86Å; L105-Y118 HydrophobicContact CD2-CE1 4.15Å; L105-Y118 HydrophobicContact CD2-CE2 4.49Å; L105-Y118 HydrophobicContact CG-CE1 4.24Å
106I95.1Very high94.7Very high23 Ų2347.3 Ų47.312%0.11824%0.24CC..THydrogen-bonded Turntrans-67.2-48.6-174.2-67.1169.1000110.7L101 N108 S109 L119 K122L101-I106 HydrophobicContact CB-CD1 4.04Å; L101-I106 HydrophobicContact CB-CG1 4.45Å; L101-I106 WeakPolarHBondContact O-CB 3.46Å; L101-I106 WeakPolarHBondContact O-CG1 3.22Å; L101-I106 PolarHBondContact O-N 3.31Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 2.93Å; I106-S109 PolarHBondContact O-N 2.77Å; I106-S109 PolarHBondContact O-OG 3.01Å; I106-L119 HydrophobicContact CD1-CD2 4.14Å; I106-L119 HydrophobicContact CG2-CD2 4.42Å; I106-K122 HydrophobicContact CD1-CB 4.34Å; I106-K122 HydrophobicContact CD1-CD 3.71Å
107E89.1Confident94.6Very high161 Ų16146.9 Ų46.975%0.75224%0.237SC*.THydrogen-bonded Turntrans-66.5-29.2-178.4-66.3-168163.200113
108N88.6Confident94.6Very high78 Ų7846.9 Ų46.942%0.41724%0.237SC..THydrogen-bonded Turntrans-92.6-4.5-179.4-65.3-41.2000113.6Y104 L105 I106 T110Y104-N108 WeakPolarHBondContact O-CB 3.43Å; Y104-N108 PolarHBondContact O-ND2 2.66Å; L105-N108 PolarHBondContact O-N 2.87Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 2.93Å; N108-T110 PolarHBondContact O-N 2.91Å
109S89.7Confident94.6Very high17 Ų1746.7 Ų46.712%0.11924%0.235CC..  trans-71.7122.1-179.763.80000111.6L105 I106 K115L105-S109 WeakPolarHBondContact O-CB 3.27Å; L105-S109 PolarHBondContact O-N 2.8Å; L105-S109 VanDerWaalsContact O-N 3.08Å; I106-S109 PolarHBondContact O-N 2.77Å; I106-S109 PolarHBondContact O-OG 3.01Å; S109-K115 WeakPolarHBondContact OG-CB 3.32Å
110T88.2Confident94.7Very high113 Ų11343.8 Ų43.869%0.69322%0.221SC*.  trans-93.9-27.7-174.460.40000113.1E35 N108E35-T110 PolarHBondContact OE1-N 3.37Å; E35-T110 VanDerWaalsContact OE1-N 3.09Å; E35-T110 PolarHBondContact OE1-OG1 2.99Å; E35-T110 VanDerWaalsContact OE1-OG1 3.07Å; E35-T110 PolarHBondContact OE2-OG1 3.48Å; N108-T110 PolarHBondContact O-N 2.91Å
111N90.8Very high94.7Very high64 Ų6444.1 Ų44.134%0.34222%0.223SC..SBendtrans-109.9153.9-177.461.874.3000112.6E35 E113 S114 K115E35-N111 PolarHBondContact OE1-ND2 3.21Å; N111-E113 VanDerWaalsContact C-N 3.31Å; N111-E113 PolarHBondContact O-N 2.87Å; N111-E113 PolarHBondContact OD1-N 2.78Å; N111-S114 PolarHBondContact ND2-OG 3.42Å; N111-S114 PolarHBondContact O-N 3.18Å; N111-S114 WeakPolarHBondContact OD1-CB 3.32Å; N111-S114 PolarHBondContact OD1-N 2.85Å; N111-S114 PolarHBondContact OD1-OG 3.29Å; N111-K115 WeakPolarHBondContact O-CB 3.09Å; N111-K115 PolarHBondContact O-N 3.08Å; N111-K115 VanDerWaalsContact O-N 3.12Å
112A93.9Very high94.7Very high31 Ų3146.1 Ų46.126%0.25623%0.232SC..Hα-helixtrans-60.2-39.9-178.400000112.3S114 K115 V116 I155 E159A112-S114 PolarHBondContact O-N 2.82Å; A112-K115 PolarHBondContact O-N 3.41Å; A112-V116 WeakPolarHBondContact O-CB 3.4Å; A112-V116 VanDerWaalsContact O-CG2 3.24Å; A112-V116 WeakPolarHBondContact O-CG2 3.38Å; A112-V116 PolarHBondContact O-N 3.5Å; A112-I155 HydrophobicContact CB-CG2 4.08Å; A112-E159 HydrophobicContact CB-CB 3.64Å; A112-E159 HydrophobicContact CB-CG 3.98Å
113E93.4Very high94.8Very high57 Ų5743.4 Ų43.427%0.26622%0.217SC..Hα-helixtrans-59.7-49.8-178.5-169.4-166.6126.800112R41 N111 V116 F117 M160 H164 I166R41-E113 IonicContact CZ-OE1 3.49Å; R41-E113 IonicContact NH1-OE1 3.88Å; R41-E113 PolarHBondContact NH1-OE1 3.22Å; R41-E113 IonicContact NH2-OE1 3.16Å; R41-E113 PolarHBondContact NH2-OE1 3.26Å; N111-E113 VanDerWaalsContact C-N 3.31Å; N111-E113 PolarHBondContact O-N 2.87Å; N111-E113 PolarHBondContact OD1-N 2.78Å; E113-V116 PolarHBondContact O-N 2.95Å; E113-F117 WeakPolarHBondContact O-CB 3.33Å; E113-F117 PolarHBondContact O-N 2.79Å; E113-M160 HydrophobicContact CB-CE 4.44Å; E113-M160 HydrophobicContact CG-CE 4.05Å; E113-H164 IonicContact OE2-NE2 2.73Å; E113-I166 HydrophobicContact CG-CD1 3.4Å
114S94.6Very high94.9Very high1 Ų138.5 Ų38.51%0.00720%0.196CC..Hα-helixtrans-66.5-40.1178.7-58.30000111.5R41 N111 A112 F117 Y118R41-S114 VanDerWaalsContact NH1-CA 3.3Å; R41-S114 PolarHBondContact NH1-OG 3.48Å; N111-S114 PolarHBondContact ND2-OG 3.42Å; N111-S114 PolarHBondContact O-N 3.18Å; N111-S114 WeakPolarHBondContact OD1-CB 3.32Å; N111-S114 PolarHBondContact OD1-N 2.85Å; N111-S114 PolarHBondContact OD1-OG 3.29Å; A112-S114 PolarHBondContact O-N 2.82Å; S114-F117 WeakPolarHBondContact O-CB 3.28Å; S114-F117 PolarHBondContact O-N 3.25Å; S114-Y118 WeakPolarHBondContact O-CD2 3.25Å; S114-Y118 PolarHBondContact O-N 3.12Å
115K96.2Very high95.1Very high87 Ų8736.8 Ų36.838%0.37819%0.19SC..Hα-helixtrans-62.7-45.3176.7-167.7164.1-176.3169.40112.1S109 N111 A112 F117 Y118 L119 I155S109-K115 WeakPolarHBondContact OG-CB 3.32Å; N111-K115 WeakPolarHBondContact O-CB 3.09Å; N111-K115 PolarHBondContact O-N 3.08Å; N111-K115 VanDerWaalsContact O-N 3.12Å; A112-K115 PolarHBondContact O-N 3.41Å; K115-F117 VanDerWaalsContact C-N 3.35Å; K115-Y118 PolarHBondContact O-N 3.34Å; K115-L119 HydrophobicContact CG-CD1 3.93Å; K115-L119 WeakPolarHBondContact O-CB 3Å; K115-L119 VanDerWaalsContact O-CG 3.28Å; K115-L119 WeakPolarHBondContact O-CG 3.46Å; K115-L119 PolarHBondContact O-N 3Å; K115-I155 HydrophobicContact CD-CD1 4.06Å; K115-I155 HydrophobicContact CG-CD1 4.11Å
116V97.8Very high95.2Very high0 Ų038.3 Ų38.30%020%0.195CC..Hα-helixtrans-63.2-42.6175.1173.10000110.6A112 E113 Y118 L119 K120 A152 I155 M160 I166 L170A112-V116 WeakPolarHBondContact O-CB 3.4Å; A112-V116 VanDerWaalsContact O-CG2 3.24Å; A112-V116 WeakPolarHBondContact O-CG2 3.38Å; A112-V116 PolarHBondContact O-N 3.5Å; E113-V116 PolarHBondContact O-N 2.95Å; V116-Y118 PolarHBondContact O-N 3.44Å; V116-L119 PolarHBondContact O-N 3.32Å; V116-K120 WeakPolarHBondContact O-CB 3.43Å; V116-K120 PolarHBondContact O-N 3.19Å; V116-A152 HydrophobicContact CG1-CB 4.36Å; V116-I155 HydrophobicContact CG2-CB 3.77Å; V116-I155 HydrophobicContact CG2-CG2 3.5Å; V116-I155 VanDerWaalsContact CG2-CG2 3.5Å; V116-M160 HydrophobicContact CB-SD 4.08Å; V116-M160 HydrophobicContact CG1-SD 4.07Å; V116-M160 HydrophobicContact CG2-SD 3.93Å; V116-I166 HydrophobicContact CB-CG2 4.3Å; V116-I166 HydrophobicContact CG1-CG2 3.68Å; V116-L170 HydrophobicContact CG1-CD2 4.04Å
117F96.8Very high95.3Very high26 Ų2637.8 Ų37.811%0.11419%0.192CC..Hα-helixtrans-57.7-49.9176.9-174-82.1000112R41 E113 S114 K115 K120 M121 I166R41-F117 VanDerWaalsContact CD-CD1 3.47Å; R41-F117 HydrophobicContact CG-CD1 3.53Å; R41-F117 HydrophobicContact CG-CE1 3.33Å; R41-F117 HydrophobicContact CG-CE2 4.4Å; R41-F117 HydrophobicContact CG-CG 4.17Å; R41-F117 HydrophobicContact CG-CZ 3.79Å; E113-F117 WeakPolarHBondContact O-CB 3.33Å; E113-F117 PolarHBondContact O-N 2.79Å; S114-F117 WeakPolarHBondContact O-CB 3.28Å; S114-F117 PolarHBondContact O-N 3.25Å; K115-F117 VanDerWaalsContact C-N 3.35Å; F117-K120 PolarHBondContact O-N 3.28Å; F117-M121 HydrophobicContact CE1-SD 4.31Å; F117-M121 WeakPolarHBondContact O-CB 3.48Å; F117-M121 PolarHBondContact O-N 3.07Å; F117-I166 HydrophobicContact CB-CD1 4.45Å; F117-I166 HydrophobicContact CD2-CD1 4Å; F117-I166 HydrophobicContact CD2-CG1 4.25Å
118Y98.2Very high95.6Very high3 Ų331.1 Ų31.11%0.01216%0.16CC..Hα-helixtrans-71.1-37.8-178.7-62.9-46.7000112.9R41 L101 L105 S114 K115 V116 M121 K122R41-Y118 HydrophobicContact CG-CE1 3.76Å; L101-Y118 HydrophobicContact CD2-CD1 3.79Å; L101-Y118 HydrophobicContact CD2-CG 4.16Å; L105-Y118 HydrophobicContact CB-CD1 3.97Å; L105-Y118 HydrophobicContact CB-CD2 3.9Å; L105-Y118 HydrophobicContact CB-CE1 4.03Å; L105-Y118 HydrophobicContact CB-CE2 3.98Å; L105-Y118 HydrophobicContact CB-CG 3.93Å; L105-Y118 HydrophobicContact CD1-CD1 4.02Å; L105-Y118 HydrophobicContact CD1-CE1 3.86Å; L105-Y118 HydrophobicContact CD2-CE1 4.15Å; L105-Y118 HydrophobicContact CD2-CE2 4.49Å; L105-Y118 HydrophobicContact CG-CE1 4.24Å; S114-Y118 WeakPolarHBondContact O-CD2 3.25Å; S114-Y118 PolarHBondContact O-N 3.12Å; K115-Y118 PolarHBondContact O-N 3.34Å; V116-Y118 PolarHBondContact O-N 3.44Å; Y118-M121 WeakPolarHBondContact O-CB 3.49Å; Y118-M121 PolarHBondContact O-N 3.03Å; Y118-K122 WeakPolarHBondContact O-CB 3.11Å; Y118-K122 PolarHBondContact O-N 3.23Å
119L98.4Very high96Very high2 Ų228.1 Ų28.11%0.0114%0.143CC..Hα-helixtrans-66.8-40.1174.6-73.5168.3000111.9I106 K115 V116 M121 K122 G123 Q151 A152 I155I106-L119 HydrophobicContact CD1-CD2 4.14Å; I106-L119 HydrophobicContact CG2-CD2 4.42Å; K115-L119 HydrophobicContact CG-CD1 3.93Å; K115-L119 WeakPolarHBondContact O-CB 3Å; K115-L119 VanDerWaalsContact O-CG 3.28Å; K115-L119 WeakPolarHBondContact O-CG 3.46Å; K115-L119 PolarHBondContact O-N 3Å; V116-L119 PolarHBondContact O-N 3.32Å; L119-M121 VanDerWaalsContact C-N 3.32Å; L119-M121 PolarHBondContact O-N 3.38Å; L119-K122 WeakPolarHBondContact O-CB 3.3Å; L119-K122 PolarHBondContact O-N 3.48Å; L119-G123 PolarHBondContact O-N 3Å; L119-Q151 HydrophobicContact CD1-CB 4.08Å; L119-Q151 HydrophobicContact CD2-CB 4.48Å; L119-A152 HydrophobicContact CB-CB 3.69Å; L119-I155 HydrophobicContact CD1-CD1 3.74Å
120K98.1Very high96.2Very high38 Ų3827.3 Ų27.317%0.16514%0.138CC..Hα-helixtrans-58-47.5171178.6-169172.4-67.80110.6V116 F117 K122 G123 D124 Y149 G169 L170 N173V116-K120 WeakPolarHBondContact O-CB 3.43Å; V116-K120 PolarHBondContact O-N 3.19Å; F117-K120 PolarHBondContact O-N 3.28Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 3.47Å; K120-G123 PolarHBondContact O-N 3.4Å; K120-D124 IonicContact NZ-OD2 2.76Å; K120-D124 PolarHBondContact NZ-OD2 2.89Å; K120-D124 PolarHBondContact O-N 2.99Å; K120-Y149 HydrophobicContact CG-CE1 4.42Å; K120-G169 WeakPolarHBondContact CE-O 3.42Å; K120-L170 HydrophobicContact CB-CD1 4.03Å; K120-L170 HydrophobicContact CD-CB 4.08Å; K120-L170 HydrophobicContact CG-CB 4.34Å; K120-L170 HydrophobicContact CG-CD1 3.96Å; K120-N173 PolarHBondContact NZ-ND2 3.11Å
121M98Very high96.4Very high8 Ų823.4 Ų23.44%0.03911%0.112CC..Hα-helixtrans-60.1-44.3177.3-164.5170.7176.200110.6V97 L101 F117 Y118 L119 G123 D124 Y125V97-M121 HydrophobicContact CG1-CE 3.78Å; L101-M121 HydrophobicContact CD1-CB 4.19Å; L101-M121 HydrophobicContact CD1-CG 4.13Å; L101-M121 HydrophobicContact CD2-CB 4.22Å; L101-M121 HydrophobicContact CD2-CG 4.39Å; L101-M121 HydrophobicContact CD2-SD 4.21Å; F117-M121 HydrophobicContact CE1-SD 4.31Å; F117-M121 WeakPolarHBondContact O-CB 3.48Å; F117-M121 PolarHBondContact O-N 3.07Å; Y118-M121 WeakPolarHBondContact O-CB 3.49Å; Y118-M121 PolarHBondContact O-N 3.03Å; L119-M121 VanDerWaalsContact C-N 3.32Å; L119-M121 PolarHBondContact O-N 3.38Å; M121-G123 VanDerWaalsContact C-N 3.33Å; M121-G123 PolarHBondContact O-N 3.48Å; M121-D124 WeakPolarHBondContact O-CB 3.39Å; M121-D124 PolarHBondContact O-N 2.96Å; M121-Y125 HydrophobicContact CE-CE2 3.65Å; M121-Y125 HydrophobicContact CG-CD2 3.83Å; M121-Y125 HydrophobicContact CG-CE2 3.58Å; M121-Y125 WeakPolarHBondContact O-CD2 3.3Å; M121-Y125 PolarHBondContact O-N 2.9Å; M121-Y125 HydrophobicContact SD-CE2 4.46Å
122K98.6Very high96.4Very high44 Ų4421 Ų2119%0.19110%0.1CC..Hα-helixtrans-56-46.3174.5-175.9172.8175.5173.40111.8L98 L101 N102 I106 Y118 L119 K120 Y125 Y126 A148L98-K122 HydrophobicContact CD2-CG 3.87Å; L101-K122 HydrophobicContact CD1-CB 3.94Å; N102-K122 VanDerWaalsContact OD1-CE 3.32Å; N102-K122 WeakPolarHBondContact OD1-CE 3.24Å; N102-K122 PolarHBondContact OD1-NZ 3.12Å; I106-K122 HydrophobicContact CD1-CB 4.34Å; I106-K122 HydrophobicContact CD1-CD 3.71Å; Y118-K122 WeakPolarHBondContact O-CB 3.11Å; Y118-K122 PolarHBondContact O-N 3.23Å; L119-K122 WeakPolarHBondContact O-CB 3.3Å; L119-K122 PolarHBondContact O-N 3.48Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 3.47Å; K122-Y125 PolarHBondContact O-N 3.31Å; K122-Y126 HydrophobicContact CD-CE2 4.27Å; K122-Y126 HydrophobicContact CG-CD2 3.87Å; K122-Y126 HydrophobicContact CG-CE2 3.66Å; K122-Y126 VanDerWaalsContact O-CD2 3.25Å; K122-Y126 WeakPolarHBondContact O-CD2 3.32Å; K122-Y126 PolarHBondContact O-N 3.31Å; K122-Y126 VanDerWaalsContact O-N 3.08Å; K122-A148 HydrophobicContact CB-CB 4.08Å; K122-A148 HydrophobicContact CD-CB 4.21Å; K122-A148 HydrophobicContact CG-CB 3.9Å
123G98.4Very high96.2Very high0 Ų020.6 Ų20.60%010%0.096CC..Hα-helixtrans-59.6-43.9173.500000112.6L119 K120 M121 Y125 Y126 R127 S145 Y149L119-G123 PolarHBondContact O-N 3Å; K120-G123 PolarHBondContact O-N 3.4Å; M121-G123 VanDerWaalsContact C-N 3.33Å; M121-G123 PolarHBondContact O-N 3.48Å; G123-Y125 PolarHBondContact O-N 2.75Å; G123-Y126 PolarHBondContact O-N 2.94Å; G123-R127 VanDerWaalsContact O-CB 3.32Å; G123-R127 WeakPolarHBondContact O-CB 3.23Å; G123-R127 PolarHBondContact O-N 2.89Å; G123-S145 PolarHBondContact O-OG 2.93Å; G123-Y149 VanDerWaalsContact C-CZ 3.41Å
124D98.1Very high95.7Very high9 Ų922.5 Ų22.55%0.04812%0.116CC..Hα-helixtrans-59-46.1177.1-75-39000112.5K120 M121 R127 Y128 Y149 N173K120-D124 IonicContact NZ-OD2 2.76Å; K120-D124 PolarHBondContact NZ-OD2 2.89Å; K120-D124 PolarHBondContact O-N 2.99Å; M121-D124 WeakPolarHBondContact O-CB 3.39Å; M121-D124 PolarHBondContact O-N 2.96Å; D124-R127 WeakPolarHBondContact O-CB 3.44Å; D124-R127 PolarHBondContact O-N 2.93Å; D124-R127 IonicContact OD1-CZ 3.29Å; D124-R127 IonicContact OD1-NE 2.93Å; D124-R127 IonicContact OD1-NH2 3.42Å; D124-R127 PolarHBondContact OD1-NH2 3.37Å; D124-Y128 HydrophobicContact CB-CE2 4.16Å; D124-Y128 VanDerWaalsContact O-CD1 3.27Å; D124-Y128 WeakPolarHBondContact O-CD1 3.49Å; D124-Y128 VanDerWaalsContact O-CD2 3.24Å; D124-Y128 WeakPolarHBondContact O-CD2 3.46Å; D124-Y128 WeakPolarHBondContact O-CE2 3.27Å; D124-Y128 PolarHBondContact O-N 3.49Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.4Å; D124-Y149 PolarHBondContact N-OH 3.47Å; D124-Y149 PolarHBondContact OD1-OH 2.92Å; D124-N173 WeakPolarHBondContact OD1-CB 3.42Å; D124-N173 PolarHBondContact OD1-ND2 2.69Å; D124-N173 PolarHBondContact OD2-ND2 2.92Å
125Y98.2Very high95Very high6 Ų625.2 Ų25.22%0.02414%0.144CC..Hα-helixtrans-73.2-35.5-178.8-77.1-84.2000113.4Y48 K49 V52 C94 V97 M121 K122 G123 R127 Y128 L129Y48-Y125 VanDerWaalsContact C-OH 3.23Å; Y48-Y125 WeakPolarHBondContact CB-OH 3.44Å; Y48-Y125 PolarHBondContact O-OH 2.84Å; K49-Y125 PolarHBondContact N-OH 2.56Å; V52-Y125 HydrophobicContact CB-CE1 4.21Å; V52-Y125 HydrophobicContact CG1-CE1 4.08Å; V52-Y125 HydrophobicContact CG2-CE1 4.36Å; C94-Y125 HydrophobicContact CB-CD1 4.08Å; V97-Y125 HydrophobicContact CB-CD1 3.99Å; V97-Y125 HydrophobicContact CB-CD2 4.13Å; V97-Y125 HydrophobicContact CB-CE1 4.03Å; V97-Y125 HydrophobicContact CB-CE2 4.25Å; V97-Y125 HydrophobicContact CB-CG 4.04Å; V97-Y125 HydrophobicContact CG1-CD1 4.22Å; V97-Y125 HydrophobicContact CG1-CD2 3.45Å; V97-Y125 VanDerWaalsContact CG1-CD2 3.45Å; V97-Y125 HydrophobicContact CG1-CE1 4.23Å; V97-Y125 HydrophobicContact CG1-CE2 3.54Å; V97-Y125 HydrophobicContact CG1-CG 3.85Å; V97-Y125 HydrophobicContact CG2-CD1 4.16Å; V97-Y125 HydrophobicContact CG2-CE1 3.71Å; V97-Y125 HydrophobicContact CG2-CE2 4.31Å; M121-Y125 HydrophobicContact CE-CE2 3.65Å; M121-Y125 HydrophobicContact CG-CD2 3.83Å; M121-Y125 HydrophobicContact CG-CE2 3.58Å; M121-Y125 WeakPolarHBondContact O-CD2 3.3Å; M121-Y125 PolarHBondContact O-N 2.9Å; M121-Y125 HydrophobicContact SD-CE2 4.46Å; K122-Y125 PolarHBondContact O-N 3.31Å; G123-Y125 PolarHBondContact O-N 2.75Å; Y125-R127 VanDerWaalsContact C-N 3.34Å; Y125-Y128 AromaticContact CD1-CD2 3.9Å; Y125-Y128 HydrophobicContact CD1-CD2 3.9Å; Y125-Y128 HydrophobicContact CD1-CE2 4.31Å; Y125-Y128 HydrophobicContact CE1-CD2 4.18Å; Y125-Y128 HydrophobicContact CE1-CE2 4.28Å; Y125-Y128 HydrophobicContact CG-CD2 4.27Å; Y125-Y128 PolarHBondContact O-N 2.8Å; Y125-L129 WeakPolarHBondContact O-CG 3.5Å; Y125-L129 PolarHBondContact O-N 2.98Å
126Y98.3Very high94.1Very high36 Ų3628.2 Ų28.214%0.14116%0.164CC..Hα-helixtrans-65.1-39169.1-79.3-61.7000111.9L98 K122 G123 Y128 L129 A130 T141 N144L98-Y126 HydrophobicContact CD1-CD1 3.85Å; L98-Y126 HydrophobicContact CD1-CE1 3.6Å; L98-Y126 HydrophobicContact CD1-CE2 4.28Å; L98-Y126 HydrophobicContact CD1-CG 4.29Å; L98-Y126 HydrophobicContact CD2-CD2 3.76Å; L98-Y126 HydrophobicContact CD2-CE1 4.39Å; L98-Y126 HydrophobicContact CD2-CE2 3.55Å; L98-Y126 HydrophobicContact CD2-CG 4.25Å; K122-Y126 HydrophobicContact CD-CE2 4.27Å; K122-Y126 HydrophobicContact CG-CD2 3.87Å; K122-Y126 HydrophobicContact CG-CE2 3.66Å; K122-Y126 VanDerWaalsContact O-CD2 3.25Å; K122-Y126 WeakPolarHBondContact O-CD2 3.32Å; K122-Y126 PolarHBondContact O-N 3.31Å; K122-Y126 VanDerWaalsContact O-N 3.08Å; G123-Y126 PolarHBondContact O-N 2.94Å; Y126-Y128 VanDerWaalsContact C-N 3.32Å; Y126-Y128 PolarHBondContact O-N 2.89Å; Y126-L129 HydrophobicContact CD1-CD1 4.14Å; Y126-L129 WeakPolarHBondContact O-CB 3.45Å; Y126-L129 PolarHBondContact O-N 3.38Å; Y126-A130 PolarHBondContact O-N 3.4Å; Y126-T141 HydrophobicContact CD1-CG2 4.22Å; Y126-T141 WeakPolarHBondContact O-CG2 3.45Å; Y126-N144 HydrophobicContact CD1-CB 3.77Å; Y126-N144 HydrophobicContact CD2-CB 3.81Å; Y126-N144 HydrophobicContact CE1-CB 3.76Å; Y126-N144 HydrophobicContact CE2-CB 3.79Å; Y126-N144 HydrophobicContact CG-CB 3.81Å
127R97.3Very high93.3Very high12 Ų1234 Ų345%0.04520%0.196CC..Hα-helixtrans-59-43.4173.4173169.263.788.9-3.4111.9G123 D124 Y125 L129 A130 E131 S145 Y149 F177 I181G123-R127 VanDerWaalsContact O-CB 3.32Å; G123-R127 WeakPolarHBondContact O-CB 3.23Å; G123-R127 PolarHBondContact O-N 2.89Å; D124-R127 WeakPolarHBondContact O-CB 3.44Å; D124-R127 PolarHBondContact O-N 2.93Å; D124-R127 IonicContact OD1-CZ 3.29Å; D124-R127 IonicContact OD1-NE 2.93Å; D124-R127 IonicContact OD1-NH2 3.42Å; D124-R127 PolarHBondContact OD1-NH2 3.37Å; Y125-R127 VanDerWaalsContact C-N 3.34Å; R127-L129 VanDerWaalsContact C-N 3.31Å; R127-L129 PolarHBondContact O-N 3.09Å; R127-A130 WeakPolarHBondContact O-CB 3.42Å; R127-A130 PolarHBondContact O-N 3.32Å; R127-A130 VanDerWaalsContact O-N 3.11Å; R127-E131 IonicContact NH1-OE1 3.6Å; R127-E131 PolarHBondContact O-N 3.13Å; R127-E131 VanDerWaalsContact O-N 3.12Å; R127-S145 PolarHBondContact N-OG 3.02Å; R127-Y149 HydrophobicContact CB-CE2 4.49Å; R127-Y149 PolarHBondContact NE-OH 3.5Å; R127-F177 HydrophobicContact CB-CD2 4.32Å; R127-F177 HydrophobicContact CG-CD2 4.31Å; R127-I181 HydrophobicContact CG-CD1 4.15Å; R127-I181 HydrophobicContact CG-CG1 3.86Å
128Y96.8Very high93Very high21 Ų2136.9 Ų36.98%0.08221%0.208CC..Hα-helixtrans-63.5-37.2176.5-54.7-27.6000112.4V52 D124 Y125 Y126 A130 E131V52-Y128 HydrophobicContact CG1-CD2 4.03Å; V52-Y128 HydrophobicContact CG1-CE2 3.85Å; V52-Y128 HydrophobicContact CG2-CD2 3.93Å; D124-Y128 HydrophobicContact CB-CE2 4.16Å; D124-Y128 VanDerWaalsContact O-CD1 3.27Å; D124-Y128 WeakPolarHBondContact O-CD1 3.49Å; D124-Y128 VanDerWaalsContact O-CD2 3.24Å; D124-Y128 WeakPolarHBondContact O-CD2 3.46Å; D124-Y128 WeakPolarHBondContact O-CE2 3.27Å; D124-Y128 PolarHBondContact O-N 3.49Å; Y125-Y128 AromaticContact CD1-CD2 3.9Å; Y125-Y128 HydrophobicContact CD1-CD2 3.9Å; Y125-Y128 HydrophobicContact CD1-CE2 4.31Å; Y125-Y128 HydrophobicContact CE1-CD2 4.18Å; Y125-Y128 HydrophobicContact CE1-CE2 4.28Å; Y125-Y128 HydrophobicContact CG-CD2 4.27Å; Y125-Y128 PolarHBondContact O-N 2.8Å; Y126-Y128 VanDerWaalsContact C-N 3.32Å; Y126-Y128 PolarHBondContact O-N 2.89Å; Y128-A130 VanDerWaalsContact C-N 3.35Å; Y128-E131 WeakPolarHBondContact O-CB 3.31Å; Y128-E131 PolarHBondContact O-N 3.07Å
129L95.9Very high92.8Very high15 Ų1540.6 Ų40.68%0.07923%0.231CC..Hα-helixtrans-63.2-41.1171.2-72.6173.7000111.5R91 C94 L98 Y125 Y126 R127 E131 V132 A133 T141R91-L129 HydrophobicContact CB-CD2 4.22Å; R91-L129 HydrophobicContact CG-CD2 3.76Å; C94-L129 HydrophobicContact CB-CD1 4.01Å; C94-L129 HydrophobicContact CB-CD2 3.63Å; C94-L129 HydrophobicContact CB-CG 3.58Å; L98-L129 HydrophobicContact CD1-CD1 3.63Å; Y125-L129 WeakPolarHBondContact O-CG 3.5Å; Y125-L129 PolarHBondContact O-N 2.98Å; Y126-L129 HydrophobicContact CD1-CD1 4.14Å; Y126-L129 WeakPolarHBondContact O-CB 3.45Å; Y126-L129 PolarHBondContact O-N 3.38Å; R127-L129 VanDerWaalsContact C-N 3.31Å; R127-L129 PolarHBondContact O-N 3.09Å; L129-E131 PolarHBondContact O-N 3.08Å; L129-V132 WeakPolarHBondContact O-CG2 3.44Å; L129-V132 PolarHBondContact O-N 2.74Å; L129-A133 VanDerWaalsContact O-CB 3.27Å; L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 2.79Å; L129-T141 HydrophobicContact CB-CG2 3.44Å; L129-T141 VanDerWaalsContact CB-CG2 3.44Å
130A94.9Very high92.5Very high1 Ų142.7 Ų42.71%0.00825%0.248CC..Hα-helixtrans-65.3-27.1-179.800000113.1Y126 R127 Y128 V132 T141 I142 I181Y126-A130 PolarHBondContact O-N 3.4Å; R127-A130 WeakPolarHBondContact O-CB 3.42Å; R127-A130 PolarHBondContact O-N 3.32Å; R127-A130 VanDerWaalsContact O-N 3.11Å; Y128-A130 VanDerWaalsContact C-N 3.35Å; A130-V132 VanDerWaalsContact C-N 3.3Å; A130-V132 PolarHBondContact O-N 3.34Å; A130-T141 HydrophobicContact CB-CG2 3.91Å; A130-I142 HydrophobicContact CB-CG1 3.82Å; A130-I181 HydrophobicContact CB-CD1 4.42Å; A130-I181 HydrophobicContact CB-CG2 4.18Å
131E91.4Very high92.4Very high31 Ų3141.9 Ų41.915%0.14525%0.246CC..Hα-helixtrans-63.4-35.5174.9-70.9170.9-157.200112.3R56 W59 R127 Y128 L129 I181R56-E131 IonicContact CZ-OE1 3.91Å; R56-E131 IonicContact CZ-OE2 2.99Å; R56-E131 VanDerWaalsContact CZ-OE2 3.29Å; R56-E131 IonicContact NE-OE1 3.19Å; R56-E131 IonicContact NE-OE2 2.81Å; R56-E131 PolarHBondContact NE-OE2 2.84Å; R56-E131 IonicContact NH2-OE1 2.63Å; R56-E131 PolarHBondContact NH2-OE1 3.19Å; R56-E131 IonicContact NH2-OE2 3.62Å; R56-E131 PolarHBondContact NH2-OE2 2.9Å; W59-E131 VanDerWaalsContact CH2-O 3.27Å; W59-E131 WeakPolarHBondContact CH2-O 3.46Å; R127-E131 IonicContact NH1-OE1 3.6Å; R127-E131 PolarHBondContact O-N 3.13Å; R127-E131 VanDerWaalsContact O-N 3.12Å; Y128-E131 WeakPolarHBondContact O-CB 3.31Å; Y128-E131 PolarHBondContact O-N 3.07Å; L129-E131 PolarHBondContact O-N 3.08Å; E131-I181 HydrophobicContact CG-CD1 4.03Å
132V91.3Very high92.3Very high13 Ų1342.7 Ų42.78%0.07925%0.251CS..Hα-helixtrans-105.3-11.1-176.9-56.80000113.9W59 E87 L90 R91 L129 A130W59-V132 HydrophobicContact CD2-CG1 3.87Å; W59-V132 HydrophobicContact CE3-CG1 4.37Å; W59-V132 HydrophobicContact CG-CG1 4.19Å; W59-V132 HydrophobicContact CH2-CG1 4.48Å; W59-V132 HydrophobicContact CZ2-CG1 4.01Å; E87-V132 HydrophobicContact CG-CB 4.09Å; E87-V132 HydrophobicContact CG-CG1 4.25Å; L90-V132 HydrophobicContact CD1-CG1 3.94Å; L90-V132 HydrophobicContact CD2-CG1 4.32Å; L90-V132 HydrophobicContact CD2-CG2 3.92Å; R91-V132 HydrophobicContact CG-CG2 4.37Å; L129-V132 WeakPolarHBondContact O-CG2 3.44Å; L129-V132 PolarHBondContact O-N 2.74Å; A130-V132 VanDerWaalsContact C-N 3.3Å; A130-V132 PolarHBondContact O-N 3.34Å
133A89.3Confident92.2Very high22 Ų2246.5 Ų46.518%0.18227%0.269CS..  trans-72151-178.600000112.6L129 K138L129-A133 VanDerWaalsContact O-CB 3.27Å; L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 2.79Å; A133-K138 HydrophobicContact CB-CB 3.91Å; A133-K138 HydrophobicContact CB-CG 4.19Å
134S82.2Confident92.1Very high97 Ų9749.3 Ų49.368%0.67828%0.284SS*.  trans-137.1151.7177.258.90000111
135G80.6Confident92.1Very high59 Ų5948.9 Ų48.961%0.60828%0.282SS*.THydrogen-bonded Turntrans67.4-146.9178.400000113.3D137 K138G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 2.95Å; G135-K138 VanDerWaalsContact O-CB 3.32Å; G135-K138 WeakPolarHBondContact O-CB 3.22Å; G135-K138 PolarHBondContact O-N 2.81Å; G135-K138 VanDerWaalsContact O-N 3.14Å
136D77.2Confident92.1Very high150 Ų15051.7 Ų51.780%0.80230%0.296SS*.Hα-helixtrans-65.1-31.1-172.7-64.1-22.6000113.2K138 T139D136-K138 PolarHBondContact O-N 3.45Å; D136-T139 PolarHBondContact O-N 3.49Å
137D82.3Confident92.1Very high122 Ų12255.2 Ų55.265%0.65231%0.313SS*.Hα-helixtrans-61.7-27.7176.5-69.7-19.6000112.2G135 T141G135-D137 VanDerWaalsContact C-N 3.3Å; G135-D137 PolarHBondContact O-N 2.95Å; D137-T141 VanDerWaalsContact O-CB 3.3Å; D137-T141 WeakPolarHBondContact O-CB 3.35Å; D137-T141 PolarHBondContact O-N 3.49Å; D137-T141 VanDerWaalsContact O-N 3.12Å; D137-T141 PolarHBondContact O-OG1 3.48Å
138K90.6Very high92.2Very high86 Ų8654.8 Ų54.837%0.37431%0.312SS..Hα-helixtrans-67.3-45.5-179.8-171.7173.3-173.2165.80111.5A133 G135 D136 T141 I142A133-K138 HydrophobicContact CB-CB 3.91Å; A133-K138 HydrophobicContact CB-CG 4.19Å; G135-K138 VanDerWaalsContact O-CB 3.32Å; G135-K138 WeakPolarHBondContact O-CB 3.22Å; G135-K138 PolarHBondContact O-N 2.81Å; G135-K138 VanDerWaalsContact O-N 3.14Å; D136-K138 PolarHBondContact O-N 3.45Å; K138-T141 PolarHBondContact O-N 2.94Å; K138-I142 HydrophobicContact CD-CD1 4.48Å; K138-I142 HydrophobicContact CG-CD1 3.85Å; K138-I142 HydrophobicContact CG-CG1 4.38Å; K138-I142 VanDerWaalsContact O-CG1 3.23Å; K138-I142 WeakPolarHBondContact O-CG1 3.28Å; K138-I142 PolarHBondContact O-N 3.04Å
139T92.2Very high92.2Very high81 Ų8153.8 Ų53.850%0.49731%0.308SS..Hα-helixtrans-61.8-49.7-177.8-55.20000110.9D136 T141 I142 E143D136-T139 PolarHBondContact O-N 3.49Å; T139-T141 VanDerWaalsContact C-N 3.29Å; T139-T141 PolarHBondContact O-N 3.32Å; T139-I142 PolarHBondContact O-N 3.49Å; T139-E143 WeakPolarHBondContact O-CG 3.42Å; T139-E143 PolarHBondContact O-N 3.1Å
140A93.3Very high92.4Very high45 Ų4556.1 Ų56.137%0.37232%0.319SS..Hα-helixtrans-60.9-39.4178.100000112E143 N144A140-E143 PolarHBondContact O-N 3.45Å; A140-N144 WeakPolarHBondContact O-CB 3.44Å; A140-N144 PolarHBondContact O-N 2.93Å; A140-N144 PolarHBondContact O-ND2 2.87Å
141T94.9Very high92.5Very high21 Ų2159.9 Ų59.913%0.12934%0.336CS..Hα-helixtrans-65.1-40.9177.8-59.70000111.9Y126 L129 A130 D137 K138 T139 N144 S145Y126-T141 HydrophobicContact CD1-CG2 4.22Å; Y126-T141 WeakPolarHBondContact O-CG2 3.45Å; L129-T141 HydrophobicContact CB-CG2 3.44Å; L129-T141 VanDerWaalsContact CB-CG2 3.44Å; A130-T141 HydrophobicContact CB-CG2 3.91Å; D137-T141 VanDerWaalsContact O-CB 3.3Å; D137-T141 WeakPolarHBondContact O-CB 3.35Å; D137-T141 PolarHBondContact O-N 3.49Å; D137-T141 VanDerWaalsContact O-N 3.12Å; D137-T141 PolarHBondContact O-OG1 3.48Å; K138-T141 PolarHBondContact O-N 2.94Å; T139-T141 VanDerWaalsContact C-N 3.29Å; T139-T141 PolarHBondContact O-N 3.32Å; T141-N144 PolarHBondContact O-N 3.12Å; T141-S145 PolarHBondContact O-N 3.28Å
142I96.2Very high92.8Very high26 Ų2658.4 Ų58.413%0.13333%0.329CS..Hα-helixtrans-63.7-45.8176.4-69.8174.6000110.9A130 K138 T139 N144 S145 Q146 F177 I181 L182A130-I142 HydrophobicContact CB-CG1 3.82Å; K138-I142 HydrophobicContact CD-CD1 4.48Å; K138-I142 HydrophobicContact CG-CD1 3.85Å; K138-I142 HydrophobicContact CG-CG1 4.38Å; K138-I142 VanDerWaalsContact O-CG1 3.23Å; K138-I142 WeakPolarHBondContact O-CG1 3.28Å; K138-I142 PolarHBondContact O-N 3.04Å; T139-I142 PolarHBondContact O-N 3.49Å; I142-N144 PolarHBondContact O-N 3.49Å; I142-S145 WeakPolarHBondContact O-CB 3.43Å; I142-S145 PolarHBondContact O-N 3.22Å; I142-Q146 PolarHBondContact O-N 3.21Å; I142-F177 HydrophobicContact CG2-CE2 4.38Å; I142-F177 HydrophobicContact CG2-CZ 3.96Å; I142-I181 HydrophobicContact CB-CG2 4.44Å; I142-I181 HydrophobicContact CD1-CG2 3.78Å; I142-I181 HydrophobicContact CG1-CG2 3.56Å; I142-I181 HydrophobicContact CG2-CG2 4.19Å; I142-L182 HydrophobicContact CG2-CD2 3.47Å; I142-L182 VanDerWaalsContact CG2-CD2 3.47Å; I142-L182 HydrophobicContact CG2-CG 4.44Å
143E96.3Very high93.1Very high123 Ų12359.5 Ų59.558%0.57533%0.333SS*.Hα-helixtrans-60.1-46.5178.3-72.4175172.800111.4T139 A140 S145 Q146 E147T139-E143 WeakPolarHBondContact O-CG 3.42Å; T139-E143 PolarHBondContact O-N 3.1Å; A140-E143 PolarHBondContact O-N 3.45Å; E143-S145 VanDerWaalsContact C-N 3.33Å; E143-S145 PolarHBondContact O-N 2.99Å; E143-Q146 PolarHBondContact O-N 3.41Å; E143-E147 WeakPolarHBondContact O-CB 3.44Å; E143-E147 PolarHBondContact O-N 3.24Å
144N97.2Very high93.6Very high59 Ų5962.7 Ų62.732%0.31635%0.347SS..Hα-helixtrans-61.1-40.2176.1-78.4-60.8000112.5Y126 A140 T141 I142 A148Y126-N144 HydrophobicContact CD1-CB 3.77Å; Y126-N144 HydrophobicContact CD2-CB 3.81Å; Y126-N144 HydrophobicContact CE1-CB 3.76Å; Y126-N144 HydrophobicContact CE2-CB 3.79Å; Y126-N144 HydrophobicContact CG-CB 3.81Å; A140-N144 WeakPolarHBondContact O-CB 3.44Å; A140-N144 PolarHBondContact O-N 2.93Å; A140-N144 PolarHBondContact O-ND2 2.87Å; T141-N144 PolarHBondContact O-N 3.12Å; I142-N144 PolarHBondContact O-N 3.49Å; N144-A148 WeakPolarHBondContact O-CB 3.18Å; N144-A148 PolarHBondContact O-N 2.9Å; N144-A148 VanDerWaalsContact O-N 3.1Å
145S98.1Very high94.3Very high0 Ų060 Ų600%033%0.325CS..Hα-helixtrans-62.2-46.6174.9-174.10000111.4G123 R127 T141 I142 E143 A148 Y149 F177G123-S145 PolarHBondContact O-OG 2.93Å; R127-S145 PolarHBondContact N-OG 3.02Å; T141-S145 PolarHBondContact O-N 3.28Å; I142-S145 WeakPolarHBondContact O-CB 3.43Å; I142-S145 PolarHBondContact O-N 3.22Å; E143-S145 VanDerWaalsContact C-N 3.33Å; E143-S145 PolarHBondContact O-N 2.99Å; S145-A148 PolarHBondContact O-N 3.48Å; S145-Y149 WeakPolarHBondContact O-CD2 3.16Å; S145-Y149 PolarHBondContact O-N 3.1Å; S145-Y149 VanDerWaalsContact O-N 3.1Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.3Å; S145-F177 WeakPolarHBondContact OG-CD2 3.35Å; S145-F177 VanDerWaalsContact OG-CE2 3.3Å; S145-F177 WeakPolarHBondContact OG-CE2 3.44Å
146Q97.9Very high95.1Very high66 Ų6657.2 Ų57.231%0.30830%0.296SS..Hα-helixtrans-65-44-178.8-175.2175.1-19.200111.2I142 E143 Y149 Q150 F177I142-Q146 PolarHBondContact O-N 3.21Å; E143-Q146 PolarHBondContact O-N 3.41Å; Q146-Y149 PolarHBondContact O-N 3.43Å; Q146-Q150 VanDerWaalsContact O-CB 3.28Å; Q146-Q150 WeakPolarHBondContact O-CB 3.42Å; Q146-Q150 PolarHBondContact O-N 2.92Å; Q146-F177 HydrophobicContact CB-CE1 3.73Å; Q146-F177 HydrophobicContact CB-CZ 3.77Å; Q146-F177 HydrophobicContact CG-CE1 4.07Å
147E98.3Very high96Very high109 Ų10955.8 Ų55.851%0.50928%0.283SS..Hα-helixtrans-60.2-47.7178.4-170.5-172.5170.500111E143 Y149 Q150 Q151E143-E147 WeakPolarHBondContact O-CB 3.44Å; E143-E147 PolarHBondContact O-N 3.24Å; E147-Y149 PolarHBondContact O-N 2.76Å; E147-Q150 PolarHBondContact O-N 3.49Å; E147-Q151 HydrophobicContact CG-CG 4.47Å; E147-Q151 WeakPolarHBondContact O-CB 3.44Å; E147-Q151 WeakPolarHBondContact O-CG 3.28Å; E147-Q151 PolarHBondContact O-N 3.22Å; E147-Q151 PolarHBondContact OE1-NE2 2.85Å
148A98.5Very high96.6Very high3 Ų357.8 Ų57.83%0.02529%0.285CS..Hα-helixtrans-61.5-44.8179.600000112.3K122 N144 S145 A152K122-A148 HydrophobicContact CB-CB 4.08Å; K122-A148 HydrophobicContact CD-CB 4.21Å; K122-A148 HydrophobicContact CG-CB 3.9Å; N144-A148 WeakPolarHBondContact O-CB 3.18Å; N144-A148 PolarHBondContact O-N 2.9Å; N144-A148 VanDerWaalsContact O-N 3.1Å; S145-A148 PolarHBondContact O-N 3.48Å; A148-A152 WeakPolarHBondContact O-CB 3.41Å; A148-A152 PolarHBondContact O-N 2.85Å
149Y98.6Very high96.9Very high0 Ų058.6 Ų58.60%029%0.29CS..Hα-helixtrans-65-41175.3-75.9-52.4000112.6K120 G123 D124 R127 S145 Q146 E147 A152 F153 L170 N173 F174 F177K120-Y149 HydrophobicContact CG-CE1 4.42Å; G123-Y149 VanDerWaalsContact C-CZ 3.41Å; D124-Y149 VanDerWaalsContact CA-OH 3.3Å; D124-Y149 WeakPolarHBondContact CA-OH 3.4Å; D124-Y149 PolarHBondContact N-OH 3.47Å; D124-Y149 PolarHBondContact OD1-OH 2.92Å; R127-Y149 HydrophobicContact CB-CE2 4.49Å; R127-Y149 PolarHBondContact NE-OH 3.5Å; S145-Y149 WeakPolarHBondContact O-CD2 3.16Å; S145-Y149 PolarHBondContact O-N 3.1Å; S145-Y149 VanDerWaalsContact O-N 3.1Å; S145-Y149 WeakPolarHBondContact OG-CE2 3.3Å; Q146-Y149 PolarHBondContact O-N 3.43Å; E147-Y149 PolarHBondContact O-N 2.76Å; Y149-A152 PolarHBondContact O-N 3.35Å; Y149-F153 VanDerWaalsContact O-CB 3.27Å; Y149-F153 WeakPolarHBondContact O-CB 3.1Å; Y149-F153 PolarHBondContact O-N 3.45Å; Y149-L170 HydrophobicContact CD1-CD1 3.66Å; Y149-L170 HydrophobicContact CE1-CD1 4.37Å; Y149-N173 HydrophobicContact CE1-CB 4.09Å; Y149-F174 VanDerWaalsContact CB-CD2 3.46Å; Y149-F174 HydrophobicContact CD1-CB 4.29Å; Y149-F174 AromaticContact CD2-CD2 3.79Å; Y149-F174 HydrophobicContact CD2-CD2 3.79Å; Y149-F174 HydrophobicContact CD2-CE2 4.23Å; Y149-F174 HydrophobicContact CD2-CG 4.47Å; Y149-F174 HydrophobicContact CG-CB 4.23Å; Y149-F174 AromaticContact CG-CD2 3.76Å; Y149-F174 HydrophobicContact CG-CD2 3.76Å; Y149-F174 HydrophobicContact CG-CE2 4.23Å; Y149-F174 HydrophobicContact CG-CG 4.04Å; Y149-F177 HydrophobicContact CD2-CB 4.19Å; Y149-F177 HydrophobicContact CD2-CD1 4.34Å; Y149-F177 HydrophobicContact CD2-CD2 4.44Å; Y149-F177 HydrophobicContact CD2-CG 4.07Å; Y149-F177 HydrophobicContact CE2-CB 3.8Å; Y149-F177 HydrophobicContact CE2-CD2 4.13Å; Y149-F177 AromaticContact CE2-CG 3.96Å; Y149-F177 HydrophobicContact CE2-CG 3.96Å
150Q98.4Very high97.1Very high65 Ų6555.6 Ų55.630%0.30427%0.271SS..Hα-helixtrans-65.1-44.9179.8-171.362.457.100111.2Q146 E147 A152 F153 D154 F174Q146-Q150 VanDerWaalsContact O-CB 3.28Å; Q146-Q150 WeakPolarHBondContact O-CB 3.42Å; Q146-Q150 PolarHBondContact O-N 2.92Å; E147-Q150 PolarHBondContact O-N 3.49Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 3.38Å; Q150-F153 WeakPolarHBondContact O-CB 3.41Å; Q150-F153 PolarHBondContact O-N 3.45Å; Q150-F153 VanDerWaalsContact O-N 3.11Å; Q150-D154 PolarHBondContact NE2-OD1 3.02Å; Q150-D154 VanDerWaalsContact O-CG 3.24Å; Q150-D154 PolarHBondContact O-N 3.21Å; Q150-F174 HydrophobicContact CB-CZ 4.44Å
151Q98.1Very high97.1Very high79 Ų7958.5 Ų58.537%0.36928%0.28SS..Hα-helixtrans-59.7-44.3174.7-70.7-176.924.400111.6L119 E147 F153 I155L119-Q151 HydrophobicContact CD1-CB 4.08Å; L119-Q151 HydrophobicContact CD2-CB 4.48Å; E147-Q151 HydrophobicContact CG-CG 4.47Å; E147-Q151 WeakPolarHBondContact O-CB 3.44Å; E147-Q151 WeakPolarHBondContact O-CG 3.28Å; E147-Q151 PolarHBondContact O-N 3.22Å; E147-Q151 PolarHBondContact OE1-NE2 2.85Å; Q151-F153 VanDerWaalsContact C-N 3.29Å; Q151-F153 PolarHBondContact O-N 3.4Å; Q151-I155 WeakPolarHBondContact O-CD1 3.19Å; Q151-I155 VanDerWaalsContact O-CG1 3.31Å; Q151-I155 WeakPolarHBondContact O-CG1 3.34Å; Q151-I155 PolarHBondContact O-N 3.25Å
152A98.3Very high97.2Very high0 Ų058.3 Ų58.30%028%0.279CS..Hα-helixtrans-60.5-41.4174.800000111.3V116 L119 A148 Y149 Q150 S156 L170V116-A152 HydrophobicContact CG1-CB 4.36Å; L119-A152 HydrophobicContact CB-CB 3.69Å; A148-A152 WeakPolarHBondContact O-CB 3.41Å; A148-A152 PolarHBondContact O-N 2.85Å; Y149-A152 PolarHBondContact O-N 3.35Å; Q150-A152 VanDerWaalsContact C-N 3.34Å; Q150-A152 PolarHBondContact O-N 3.38Å; A152-S156 VanDerWaalsContact O-CB 3.29Å; A152-S156 WeakPolarHBondContact O-CB 3.34Å; A152-S156 PolarHBondContact O-N 3.1Å; A152-S156 PolarHBondContact O-OG 3.49Å; A152-L170 VanDerWaalsContact C-CD2 3.43Å; A152-L170 HydrophobicContact CB-CD1 3.81Å; A152-L170 HydrophobicContact CB-CD2 3.64Å; A152-L170 HydrophobicContact CB-CG 4.4Å
153F97.8Very high97.2Very high36 Ų3657.4 Ų57.416%0.15828%0.275CS..Hα-helixtrans-67.2-45.8-176-173-100000111.1Y149 Q150 Q151 I155 S156 K157 L170 F174 L191Y149-F153 VanDerWaalsContact O-CB 3.27Å; Y149-F153 WeakPolarHBondContact O-CB 3.1Å; Y149-F153 PolarHBondContact O-N 3.45Å; Q150-F153 WeakPolarHBondContact O-CB 3.41Å; Q150-F153 PolarHBondContact O-N 3.45Å; Q150-F153 VanDerWaalsContact O-N 3.11Å; Q151-F153 VanDerWaalsContact C-N 3.29Å; Q151-F153 PolarHBondContact O-N 3.4Å; F153-I155 PolarHBondContact O-N 3.15Å; F153-S156 PolarHBondContact O-N 3.2Å; F153-S156 PolarHBondContact O-OG 3.39Å; F153-K157 HydrophobicContact CE1-CD 4.37Å; F153-K157 WeakPolarHBondContact O-CB 3.37Å; F153-K157 PolarHBondContact O-N 3.46Å; F153-L170 HydrophobicContact CB-CD2 4.2Å; F153-L170 HydrophobicContact CD2-CD2 4.49Å; F153-F174 HydrophobicContact CB-CD1 4.37Å; F153-F174 HydrophobicContact CB-CE1 4.28Å; F153-F174 HydrophobicContact CD2-CD1 4.45Å; F153-F174 HydrophobicContact CG-CD1 4.5Å; F153-L191 HydrophobicContact CE2-CD1 3.68Å; F153-L191 HydrophobicContact CZ-CD1 3.8Å
154D98Very high97.1Very high90 Ų9053.9 Ų53.948%0.48126%0.259SS..Hα-helixtrans-62.3-42.4179.4-65.9-19.6000111.8Q150 K158Q150-D154 PolarHBondContact NE2-OD1 3.02Å; Q150-D154 VanDerWaalsContact O-CG 3.24Å; Q150-D154 PolarHBondContact O-N 3.21Å; D154-K158 PolarHBondContact O-N 2.98Å
155I97.6Very high97Very high41 Ų4152.6 Ų52.621%0.2125%0.253CS..Hα-helixtrans-65.5-48.2174.8-62.5166.4000110.2A112 K115 V116 L119 Q151 F153 K157 K158 E159A112-I155 HydrophobicContact CB-CG2 4.08Å; K115-I155 HydrophobicContact CD-CD1 4.06Å; K115-I155 HydrophobicContact CG-CD1 4.11Å; V116-I155 HydrophobicContact CG2-CB 3.77Å; V116-I155 HydrophobicContact CG2-CG2 3.5Å; V116-I155 VanDerWaalsContact CG2-CG2 3.5Å; L119-I155 HydrophobicContact CD1-CD1 3.74Å; Q151-I155 WeakPolarHBondContact O-CD1 3.19Å; Q151-I155 VanDerWaalsContact O-CG1 3.31Å; Q151-I155 WeakPolarHBondContact O-CG1 3.34Å; Q151-I155 PolarHBondContact O-N 3.25Å; F153-I155 PolarHBondContact O-N 3.15Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 3.31Å; I155-K158 PolarHBondContact O-N 3.37Å; I155-K158 VanDerWaalsContact O-N 3.14Å; I155-E159 HydrophobicContact CG2-CG 4.31Å; I155-E159 PolarHBondContact O-N 2.98Å
156S97.6Very high96.9Very high0 Ų053.8 Ų53.80%026%0.26CS..Hα-helixtrans-61.6-36.4-177.6760000112.7A152 F153 K158 M160A152-S156 VanDerWaalsContact O-CB 3.29Å; A152-S156 WeakPolarHBondContact O-CB 3.34Å; A152-S156 PolarHBondContact O-N 3.1Å; A152-S156 PolarHBondContact O-OG 3.49Å; F153-S156 PolarHBondContact O-N 3.2Å; F153-S156 PolarHBondContact O-OG 3.39Å; S156-K158 VanDerWaalsContact C-N 3.28Å; S156-K158 PolarHBondContact O-N 3.31Å; S156-M160 WeakPolarHBondContact O-CB 3.39Å; S156-M160 PolarHBondContact O-N 3.1Å; S156-M160 VanDerWaalsContact O-N 3.08Å
157K95.5Very high96.8Very high120 Ų12052.2 Ų52.252%0.52225%0.251SS..Hα-helixtrans-68-30.3179.5-171.5173.5-177.7175.90112.3F153 I155F153-K157 HydrophobicContact CE1-CD 4.37Å; F153-K157 WeakPolarHBondContact O-CB 3.37Å; F153-K157 PolarHBondContact O-N 3.46Å; I155-K157 VanDerWaalsContact C-N 3.29Å; I155-K157 PolarHBondContact O-N 3.31Å
158K96.1Very high96.8Very high164 Ų16447.1 Ų47.171%0.71323%0.227SC*.Hα-helixtrans-87.6-37.3-178.4-174.1-175.6171.3-124.50112.9D154 I155 S156D154-K158 PolarHBondContact O-N 2.98Å; I155-K158 PolarHBondContact O-N 3.37Å; I155-K158 VanDerWaalsContact O-N 3.14Å; S156-K158 VanDerWaalsContact C-N 3.28Å; S156-K158 PolarHBondContact O-N 3.31Å
159E96.4Very high96.7Very high102 Ų10247.5 Ų47.548%0.47723%0.231SC..Hα-helixtrans-115.5-1.7-165.1-53.3-68.9160.400114A112 I155A112-E159 HydrophobicContact CB-CB 3.64Å; A112-E159 HydrophobicContact CB-CG 3.98Å; I155-E159 HydrophobicContact CG2-CG 4.31Å; I155-E159 PolarHBondContact O-N 2.98Å
160M95.1Very high96.7Very high18 Ų1847.5 Ų47.59%0.08923%0.231CC..SBendtrans-135.7143.8-174.4-49.41787500111.9E113 V116 S156 H164 I166 R167E113-M160 HydrophobicContact CB-CE 4.44Å; E113-M160 HydrophobicContact CG-CE 4.05Å; V116-M160 HydrophobicContact CB-SD 4.08Å; V116-M160 HydrophobicContact CG1-SD 4.07Å; V116-M160 HydrophobicContact CG2-SD 3.93Å; S156-M160 WeakPolarHBondContact O-CB 3.39Å; S156-M160 PolarHBondContact O-N 3.1Å; S156-M160 VanDerWaalsContact O-N 3.08Å; M160-H164 HydrophobicContact CB-CB 4.34Å; M160-H164 HydrophobicContact CE-CB 4.3Å; M160-H164 WeakPolarHBondContact CE-CE1 3.23Å; M160-H164 VanDerWaalsContact CE-CG 3.48Å; M160-H164 VanDerWaalsContact CE-ND1 3.28Å; M160-H164 WeakPolarHBondContact CE-ND1 3.42Å; M160-I166 HydrophobicContact CE-CB 3.9Å; M160-I166 HydrophobicContact CE-CG2 4.04Å; M160-R167 HydrophobicContact CB-CB 4.46Å; M160-R167 PolarHBondContact O-NH1 2.99Å
161D94.9Very high96.7Very high106 Ų10644.5 Ų44.557%0.56722%0.218SC*.  trans-66.2149.2176.6-65.5-40.9000112T163 H164 R167D161-T163 PolarHBondContact O-N 2.81Å; D161-T163 VanDerWaalsContact O-N 3.14Å; D161-H164 WeakPolarHBondContact O-CB 3.24Å; D161-H164 PolarHBondContact O-N 3.41Å; D161-R167 WeakPolarHBondContact O-CD 3.48Å
162P96.2Very high96.7Very high17 Ų1741.7 Ų41.711%0.1121%0.205CC..THydrogen-bonded Turntrans-56.4-29.8179.2-25.935000114.3H164 D198P162-H164 VanDerWaalsContact C-N 3.33Å; P162-D198 HydrophobicContact CB-CB 3.97Å
163T95.7Very high96.7Very high7 Ų743.1 Ų43.14%0.04321%0.213CC..THydrogen-bonded Turntrans-84-4.6179.351.70000113.5D161 A199 E202 L206 S214D161-T163 PolarHBondContact O-N 2.81Å; D161-T163 VanDerWaalsContact O-N 3.14Å; T163-A199 HydrophobicContact CG2-CB 4.22Å; T163-A199 WeakPolarHBondContact CG2-O 3.45Å; T163-E202 HydrophobicContact CG2-CB 4.02Å; T163-L206 HydrophobicContact CG2-CD1 4.28Å; T163-L206 HydrophobicContact CG2-CG 4.35Å; T163-L206 WeakPolarHBondContact OG1-CD2 3.32Å; T163-S214 WeakPolarHBondContact O-CB 3.22Å; T163-S214 PolarHBondContact O-OG 3.31Å
164H94.8Very high96.7Very high50 Ų5041.6 Ų41.623%0.23121%0.206CC..  trans-65.3128.2-176.7-168.8-59.8000111.3E113 M160 D161 P162 I166 R167 L168E113-H164 IonicContact OE2-NE2 2.73Å; M160-H164 HydrophobicContact CB-CB 4.34Å; M160-H164 HydrophobicContact CE-CB 4.3Å; M160-H164 WeakPolarHBondContact CE-CE1 3.23Å; M160-H164 VanDerWaalsContact CE-CG 3.48Å; M160-H164 VanDerWaalsContact CE-ND1 3.28Å; M160-H164 WeakPolarHBondContact CE-ND1 3.42Å; D161-H164 WeakPolarHBondContact O-CB 3.24Å; D161-H164 PolarHBondContact O-N 3.41Å; P162-H164 VanDerWaalsContact C-N 3.33Å; H164-I166 PolarHBondContact ND1-N 2.79Å; H164-I166 PolarHBondContact O-N 3.14Å; H164-R167 HydrophobicContact CB-CB 4.24Å; H164-R167 PolarHBondContact O-N 2.89Å; H164-L168 PolarHBondContact O-N 2.81Å
165P94.8Very high96.7Very high31 Ų3137.3 Ų37.320%0.20118%0.183CC..Hα-helixtrans-54.1-43.4-175-29.934.7000114.8R167 L168 G169 D213 I217P165-R167 PolarHBondContact O-N 3.23Å; P165-L168 PolarHBondContact O-N 2.91Å; P165-G169 PolarHBondContact O-N 2.85Å; P165-D213 HydrophobicContact CB-CB 4.29Å; P165-D213 HydrophobicContact CG-CB 3.93Å; P165-I217 HydrophobicContact CB-CD1 4.01Å; P165-I217 WeakPolarHBondContact O-CD1 3.35Å
166I95.3Very high96.7Very high26 Ų2636.2 Ų36.213%0.13318%0.179CC..Hα-helixtrans-61.9-41176-68.2170.5000112.6E113 V116 F117 M160 H164 G169 L170E113-I166 HydrophobicContact CG-CD1 3.4Å; V116-I166 HydrophobicContact CB-CG2 4.3Å; V116-I166 HydrophobicContact CG1-CG2 3.68Å; F117-I166 HydrophobicContact CB-CD1 4.45Å; F117-I166 HydrophobicContact CD2-CD1 4Å; F117-I166 HydrophobicContact CD2-CG1 4.25Å; M160-I166 HydrophobicContact CE-CB 3.9Å; M160-I166 HydrophobicContact CE-CG2 4.04Å; H164-I166 PolarHBondContact ND1-N 2.79Å; H164-I166 PolarHBondContact O-N 3.14Å; I166-G169 PolarHBondContact O-N 3.07Å; I166-L170 WeakPolarHBondContact O-CB 3.31Å; I166-L170 PolarHBondContact O-N 3.44Å
167R97.3Very high96.7Very high32 Ų3236.2 Ų36.212%0.12118%0.179CC..Hα-helixtrans-67.8-43.2177.6-179.9174.3171.1-177.5-9.1111.3M160 D161 H164 P165 L170 A171M160-R167 HydrophobicContact CB-CB 4.46Å; M160-R167 PolarHBondContact O-NH1 2.99Å; D161-R167 WeakPolarHBondContact O-CD 3.48Å; H164-R167 HydrophobicContact CB-CB 4.24Å; H164-R167 PolarHBondContact O-N 2.89Å; P165-R167 PolarHBondContact O-N 3.23Å; R167-L170 WeakPolarHBondContact O-CB 3.46Å; R167-L170 PolarHBondContact O-N 3.31Å; R167-A171 PolarHBondContact O-N 2.98Å
168L97.8Very high96.8Very high2 Ų230.7 Ų30.71%0.0116%0.155CC..Hα-helixtrans-61.7-46.9174-75.7172.2000111.9H164 P165 L170 A171 L172 A199 I217 M218 L221H164-L168 PolarHBondContact O-N 2.81Å; P165-L168 PolarHBondContact O-N 2.91Å; L168-L170 VanDerWaalsContact C-N 3.27Å; L168-L170 PolarHBondContact O-N 3.47Å; L168-A171 PolarHBondContact O-N 3.23Å; L168-L172 PolarHBondContact O-N 3.44Å; L168-A199 HydrophobicContact CD2-CB 3.81Å; L168-I217 HydrophobicContact CB-CB 4.2Å; L168-I217 HydrophobicContact CB-CD1 4.41Å; L168-I217 HydrophobicContact CB-CG2 3.7Å; L168-M218 HydrophobicContact CD1-CG 4.02Å; L168-M218 HydrophobicContact CD1-SD 4.49Å; L168-M218 HydrophobicContact CD2-CG 4.22Å; L168-L221 HydrophobicContact CD2-CD1 4.11Å
169G97.4Very high96.8Very high11 Ų1125.2 Ų25.211%0.11313%0.13CC..Hα-helixtrans-64.7-32.1178.600000112.6K120 P165 I166 N173K120-G169 WeakPolarHBondContact CE-O 3.42Å; P165-G169 PolarHBondContact O-N 2.85Å; I166-G169 PolarHBondContact O-N 3.07Å; G169-N173 PolarHBondContact O-N 3.29Å; G169-N173 VanDerWaalsContact O-N 3.1Å
170L98.3Very high96.7Very high0 Ų025.3 Ų25.30%013%0.13CC..Hα-helixtrans-65-49.6170.6170.362.9000111.3V116 K120 Y149 A152 F153 I166 R167 L168 L172 N173 F174V116-L170 HydrophobicContact CG1-CD2 4.04Å; K120-L170 HydrophobicContact CB-CD1 4.03Å; K120-L170 HydrophobicContact CD-CB 4.08Å; K120-L170 HydrophobicContact CG-CB 4.34Å; K120-L170 HydrophobicContact CG-CD1 3.96Å; Y149-L170 HydrophobicContact CD1-CD1 3.66Å; Y149-L170 HydrophobicContact CE1-CD1 4.37Å; A152-L170 VanDerWaalsContact C-CD2 3.43Å; A152-L170 HydrophobicContact CB-CD1 3.81Å; A152-L170 HydrophobicContact CB-CD2 3.64Å; A152-L170 HydrophobicContact CB-CG 4.4Å; F153-L170 HydrophobicContact CB-CD2 4.2Å; F153-L170 HydrophobicContact CD2-CD2 4.49Å; I166-L170 WeakPolarHBondContact O-CB 3.31Å; I166-L170 PolarHBondContact O-N 3.44Å; R167-L170 WeakPolarHBondContact O-CB 3.46Å; R167-L170 PolarHBondContact O-N 3.31Å; L168-L170 VanDerWaalsContact C-N 3.27Å; L168-L170 PolarHBondContact O-N 3.47Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.45Å; L170-N173 PolarHBondContact O-N 3.3Å; L170-F174 VanDerWaalsContact O-CB 3.28Å; L170-F174 WeakPolarHBondContact O-CB 3.37Å; L170-F174 PolarHBondContact O-N 2.97Å
171A98.2Very high96.7Very high3 Ų325.8 Ų25.83%0.02513%0.133CC..Hα-helixtrans-60.5-40.3178.400000112R167 L168 F174 S175 A195R167-A171 PolarHBondContact O-N 2.98Å; L168-A171 PolarHBondContact O-N 3.23Å; A171-F174 PolarHBondContact O-N 3.43Å; A171-S175 WeakPolarHBondContact O-CB 3.4Å; A171-S175 PolarHBondContact O-N 3.49Å; A171-S175 PolarHBondContact O-OG 3.26Å; A171-S175 VanDerWaalsContact O-OG 3.07Å; A171-A195 HydrophobicContact CB-CB 3.49Å; A171-A195 VanDerWaalsContact CB-CB 3.49Å
172L98.1Very high96.6Very high20 Ų2023.2 Ų23.211%0.10512%0.119CC..Hα-helixtrans-56.7-54.2173.1178.865.6000111.3L168 L170 F174 S175 V176 I217 L220 L221 N224L168-L172 PolarHBondContact O-N 3.44Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.45Å; L172-F174 PolarHBondContact O-N 3.22Å; L172-S175 PolarHBondContact O-N 3.41Å; L172-S175 PolarHBondContact O-OG 3.45Å; L172-V176 WeakPolarHBondContact O-CG2 3.5Å; L172-V176 PolarHBondContact O-N 2.98Å; L172-V176 VanDerWaalsContact O-N 3.14Å; L172-I217 HydrophobicContact CB-CG2 4.4Å; L172-I217 HydrophobicContact CD2-CG2 4.2Å; L172-L220 HydrophobicContact CD1-CB 4.13Å; L172-L220 HydrophobicContact CD2-CB 3.87Å; L172-L220 HydrophobicContact CD2-CD1 3.92Å; L172-L221 HydrophobicContact CB-CD2 3.95Å; L172-L221 HydrophobicContact CB-CG 4.27Å; L172-L221 HydrophobicContact CD1-CD2 3.85Å; L172-L221 HydrophobicContact CD1-CG 4.09Å; L172-N224 WeakPolarHBondContact CD1-ND2 3.36Å
173N97.5Very high96.5Very high30 Ų3029 Ų2916%0.1615%0.148CC..Hα-helixtrans-70.4-33.4-176.7-73.411.3000112.7K120 D124 Y149 G169 L170 V176 F177K120-N173 PolarHBondContact NZ-ND2 3.11Å; D124-N173 WeakPolarHBondContact OD1-CB 3.42Å; D124-N173 PolarHBondContact OD1-ND2 2.69Å; D124-N173 PolarHBondContact OD2-ND2 2.92Å; Y149-N173 HydrophobicContact CE1-CB 4.09Å; G169-N173 PolarHBondContact O-N 3.29Å; G169-N173 VanDerWaalsContact O-N 3.1Å; L170-N173 PolarHBondContact O-N 3.3Å; N173-V176 PolarHBondContact O-N 3.48Å; N173-F177 PolarHBondContact O-N 3.17Å
174F98.4Very high96.6Very high3 Ų330.8 Ų30.81%0.01316%0.161CC..Hα-helixtrans-73.4-34.1178.7-165.5-166.9000112.1Y149 Q150 F153 L170 A171 L172 F177 F178 L191Y149-F174 VanDerWaalsContact CB-CD2 3.46Å; Y149-F174 HydrophobicContact CD1-CB 4.29Å; Y149-F174 AromaticContact CD2-CD2 3.79Å; Y149-F174 HydrophobicContact CD2-CD2 3.79Å; Y149-F174 HydrophobicContact CD2-CE2 4.23Å; Y149-F174 HydrophobicContact CD2-CG 4.47Å; Y149-F174 HydrophobicContact CG-CB 4.23Å; Y149-F174 AromaticContact CG-CD2 3.76Å; Y149-F174 HydrophobicContact CG-CD2 3.76Å; Y149-F174 HydrophobicContact CG-CE2 4.23Å; Y149-F174 HydrophobicContact CG-CG 4.04Å; Q150-F174 HydrophobicContact CB-CZ 4.44Å; F153-F174 HydrophobicContact CB-CD1 4.37Å; F153-F174 HydrophobicContact CB-CE1 4.28Å; F153-F174 HydrophobicContact CD2-CD1 4.45Å; F153-F174 HydrophobicContact CG-CD1 4.5Å; L170-F174 VanDerWaalsContact O-CB 3.28Å; L170-F174 WeakPolarHBondContact O-CB 3.37Å; L170-F174 PolarHBondContact O-N 2.97Å; A171-F174 PolarHBondContact O-N 3.43Å; L172-F174 PolarHBondContact O-N 3.22Å; F174-F177 HydrophobicContact CD2-CB 4.32Å; F174-F177 AromaticContact CD2-CD1 3.85Å; F174-F177 HydrophobicContact CD2-CD1 3.85Å; F174-F177 HydrophobicContact CD2-CG 4.45Å; F174-F177 AromaticContact CE2-CD1 3.82Å; F174-F177 HydrophobicContact CE2-CD1 3.82Å; F174-F177 HydrophobicContact CE2-CE1 4.26Å; F174-F177 WeakPolarHBondContact O-CB 3.24Å; F174-F177 PolarHBondContact O-N 3.48Å; F174-F178 HydrophobicContact CD1-CE2 4.06Å; F174-F178 HydrophobicContact CD2-CD2 4.01Å; F174-F178 AromaticContact CD2-CE2 3.53Å; F174-F178 HydrophobicContact CD2-CE2 3.53Å; F174-F178 HydrophobicContact CD2-CZ 4.03Å; F174-F178 AromaticContact CE1-CE2 3.88Å; F174-F178 HydrophobicContact CE1-CE2 3.88Å; F174-F178 HydrophobicContact CE1-CZ 4.17Å; F174-F178 HydrophobicContact CE2-CD2 4.15Å; F174-F178 HydrophobicContact CE2-CE1 4.21Å; F174-F178 AromaticContact CE2-CE2 3.32Å; F174-F178 HydrophobicContact CE2-CE2 3.32Å; F174-F178 AromaticContact CE2-CZ 3.33Å; F174-F178 HydrophobicContact CE2-CZ 3.33Å; F174-F178 HydrophobicContact CG-CD2 4.41Å; F174-F178 AromaticContact CG-CE2 3.92Å; F174-F178 HydrophobicContact CG-CE2 3.92Å; F174-F178 AromaticContact CZ-CE2 3.51Å; F174-F178 HydrophobicContact CZ-CE2 3.51Å; F174-F178 AromaticContact CZ-CZ 3.43Å; F174-F178 HydrophobicContact CZ-CZ 3.43Å; F174-F178 VanDerWaalsContact CZ-CZ 3.43Å; F174-F178 WeakPolarHBondContact O-CD2 3.4Å; F174-F178 PolarHBondContact O-N 3.38Å; F174-L191 HydrophobicContact CB-CD2 3.91Å; F174-L191 HydrophobicContact CD1-CD2 3.82Å; F174-L191 HydrophobicContact CG-CD2 3.9Å
175S98.1Very high96.6Very high0 Ų030 Ų300%016%0.161CC..Hα-helixtrans-64.9-42.8170.962.80000111.7A171 L172 F177 F178 Y179 A188A171-S175 WeakPolarHBondContact O-CB 3.4Å; A171-S175 PolarHBondContact O-N 3.49Å; A171-S175 PolarHBondContact O-OG 3.26Å; A171-S175 VanDerWaalsContact O-OG 3.07Å; L172-S175 PolarHBondContact O-N 3.41Å; L172-S175 PolarHBondContact O-OG 3.45Å; S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.02Å; S175-F178 PolarHBondContact O-N 3.01Å; S175-F178 VanDerWaalsContact O-N 3.15Å; S175-Y179 PolarHBondContact O-N 3.49Å; S175-A188 WeakPolarHBondContact CB-O 3.43Å; S175-A188 WeakPolarHBondContact O-CB 3.47Å
176V97.1Very high96.6Very high19 Ų1936.8 Ų36.812%0.11519%0.19CC..Hα-helixtrans-59-41.3172.81730000111.1L172 N173 Y179 E180 N224 W228L172-V176 WeakPolarHBondContact O-CG2 3.5Å; L172-V176 PolarHBondContact O-N 2.98Å; L172-V176 VanDerWaalsContact O-N 3.14Å; N173-V176 PolarHBondContact O-N 3.48Å; V176-Y179 PolarHBondContact O-N 3.16Å; V176-E180 HydrophobicContact CG1-CG 4Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.49Å; V176-E180 WeakPolarHBondContact O-CB 3.31Å; V176-E180 PolarHBondContact O-N 3.32Å; V176-N224 WeakPolarHBondContact CG2-ND2 3.49Å; V176-W228 HydrophobicContact CG2-CH2 4.14Å; V176-W228 HydrophobicContact CG2-CZ2 4.03Å
177F97.9Very high96.7Very high0 Ų040.4 Ų40.40%021%0.205CC..Hα-helixtrans-59.3-46.5174172.5-98.9000112.4R127 I142 S145 Q146 Y149 N173 F174 S175 Y179 I181 L182R127-F177 HydrophobicContact CB-CD2 4.32Å; R127-F177 HydrophobicContact CG-CD2 4.31Å; I142-F177 HydrophobicContact CG2-CE2 4.38Å; I142-F177 HydrophobicContact CG2-CZ 3.96Å; S145-F177 WeakPolarHBondContact OG-CD2 3.35Å; S145-F177 VanDerWaalsContact OG-CE2 3.3Å; S145-F177 WeakPolarHBondContact OG-CE2 3.44Å; Q146-F177 HydrophobicContact CB-CE1 3.73Å; Q146-F177 HydrophobicContact CB-CZ 3.77Å; Q146-F177 HydrophobicContact CG-CE1 4.07Å; Y149-F177 HydrophobicContact CD2-CB 4.19Å; Y149-F177 HydrophobicContact CD2-CD1 4.34Å; Y149-F177 HydrophobicContact CD2-CD2 4.44Å; Y149-F177 HydrophobicContact CD2-CG 4.07Å; Y149-F177 HydrophobicContact CE2-CB 3.8Å; Y149-F177 HydrophobicContact CE2-CD2 4.13Å; Y149-F177 AromaticContact CE2-CG 3.96Å; Y149-F177 HydrophobicContact CE2-CG 3.96Å; N173-F177 PolarHBondContact O-N 3.17Å; F174-F177 HydrophobicContact CD2-CB 4.32Å; F174-F177 AromaticContact CD2-CD1 3.85Å; F174-F177 HydrophobicContact CD2-CD1 3.85Å; F174-F177 HydrophobicContact CD2-CG 4.45Å; F174-F177 AromaticContact CE2-CD1 3.82Å; F174-F177 HydrophobicContact CE2-CD1 3.82Å; F174-F177 HydrophobicContact CE2-CE1 4.26Å; F174-F177 WeakPolarHBondContact O-CB 3.24Å; F174-F177 PolarHBondContact O-N 3.48Å; S175-F177 VanDerWaalsContact C-N 3.29Å; S175-F177 PolarHBondContact O-N 3.02Å; F177-Y179 VanDerWaalsContact C-N 3.26Å; F177-Y179 PolarHBondContact O-N 3.36Å; F177-I181 HydrophobicContact CD2-CB 3.77Å; F177-I181 HydrophobicContact CD2-CG1 3.77Å; F177-I181 HydrophobicContact CD2-CG2 4.09Å; F177-I181 HydrophobicContact CE2-CB 3.84Å; F177-I181 HydrophobicContact CE2-CG1 4.2Å; F177-I181 HydrophobicContact CE2-CG2 3.64Å; F177-I181 HydrophobicContact CG-CB 4.49Å; F177-I181 HydrophobicContact CZ-CG2 4.36Å; F177-I181 VanDerWaalsContact O-CB 3.31Å; F177-I181 WeakPolarHBondContact O-CB 3.33Å; F177-I181 PolarHBondContact O-N 2.93Å; F177-L182 HydrophobicContact CD1-CD1 4.11Å; F177-L182 HydrophobicContact CD1-CG 4.38Å; F177-L182 HydrophobicContact CE1-CD1 3.38Å; F177-L182 HydrophobicContact CE1-CG 3.71Å; F177-L182 HydrophobicContact CZ-CD1 3.99Å; F177-L182 HydrophobicContact CZ-CD2 4.34Å; F177-L182 HydrophobicContact CZ-CG 3.89Å; F177-L182 PolarHBondContact O-N 3.12Å
178F97.8Very high96.6Very high4 Ų438.9 Ų38.92%0.01820%0.199CC..Hα-helixtrans-60.6-38176.2-78-58.3000112.4F174 S175 L182 N183 S184 K187 A188 L191F174-F178 HydrophobicContact CD1-CE2 4.06Å; F174-F178 HydrophobicContact CD2-CD2 4.01Å; F174-F178 AromaticContact CD2-CE2 3.53Å; F174-F178 HydrophobicContact CD2-CE2 3.53Å; F174-F178 HydrophobicContact CD2-CZ 4.03Å; F174-F178 AromaticContact CE1-CE2 3.88Å; F174-F178 HydrophobicContact CE1-CE2 3.88Å; F174-F178 HydrophobicContact CE1-CZ 4.17Å; F174-F178 HydrophobicContact CE2-CD2 4.15Å; F174-F178 HydrophobicContact CE2-CE1 4.21Å; F174-F178 AromaticContact CE2-CE2 3.32Å; F174-F178 HydrophobicContact CE2-CE2 3.32Å; F174-F178 AromaticContact CE2-CZ 3.33Å; F174-F178 HydrophobicContact CE2-CZ 3.33Å; F174-F178 HydrophobicContact CG-CD2 4.41Å; F174-F178 AromaticContact CG-CE2 3.92Å; F174-F178 HydrophobicContact CG-CE2 3.92Å; F174-F178 AromaticContact CZ-CE2 3.51Å; F174-F178 HydrophobicContact CZ-CE2 3.51Å; F174-F178 AromaticContact CZ-CZ 3.43Å; F174-F178 HydrophobicContact CZ-CZ 3.43Å; F174-F178 VanDerWaalsContact CZ-CZ 3.43Å; F174-F178 WeakPolarHBondContact O-CD2 3.4Å; F174-F178 PolarHBondContact O-N 3.38Å; S175-F178 PolarHBondContact O-N 3.01Å; S175-F178 VanDerWaalsContact O-N 3.15Å; F178-L182 HydrophobicContact CD1-CB 4.45Å; F178-L182 HydrophobicContact CD1-CD1 3.57Å; F178-L182 HydrophobicContact CE1-CD1 3.6Å; F178-L182 CarbonylContact O-C 3.59Å; F178-N183 PolarHBondContact O-N 2.98Å; F178-S184 PolarHBondContact O-N 3.36Å; F178-K187 HydrophobicContact CD1-CB 4.42Å; F178-K187 HydrophobicContact CD1-CD 3.63Å; F178-K187 HydrophobicContact CD1-CG 4.02Å; F178-K187 HydrophobicContact CD2-CD 4.46Å; F178-K187 HydrophobicContact CD2-CG 4.17Å; F178-K187 HydrophobicContact CE1-CD 3.5Å; F178-K187 VanDerWaalsContact CE1-CD 3.5Å; F178-K187 HydrophobicContact CE1-CG 4.23Å; F178-K187 VanDerWaalsContact CE1-NZ 3.27Å; F178-K187 HydrophobicContact CE2-CD 4.31Å; F178-K187 HydrophobicContact CE2-CG 4.33Å; F178-K187 HydrophobicContact CG-CB 4.37Å; F178-K187 HydrophobicContact CG-CD 4.16Å; F178-K187 HydrophobicContact CG-CG 4.04Å; F178-K187 HydrophobicContact CZ-CD 3.87Å; F178-K187 HydrophobicContact CZ-CG 4.38Å; F178-A188 HydrophobicContact CB-CB 3.83Å; F178-L191 HydrophobicContact CD2-CD2 3.93Å; F178-L191 HydrophobicContact CE2-CD2 3.92Å
179Y96.3Very high96.6Very high49 Ų4939.8 Ų39.819%0.19221%0.205CC..Hα-helixtrans-73.9-60.3-179.2-165.5-87.4000111.9S175 V176 F177 N183 P185 A188 W228S175-Y179 PolarHBondContact O-N 3.49Å; V176-Y179 PolarHBondContact O-N 3.16Å; F177-Y179 VanDerWaalsContact C-N 3.26Å; F177-Y179 PolarHBondContact O-N 3.36Å; Y179-N183 WeakPolarHBondContact O-CA 3.29Å; Y179-N183 PolarHBondContact O-N 2.91Å; Y179-P185 HydrophobicContact CD2-CB 3.88Å; Y179-P185 HydrophobicContact CE2-CB 3.74Å; Y179-A188 HydrophobicContact CD2-CB 4.16Å; Y179-A188 HydrophobicContact CG-CB 4.45Å; Y179-W228 AromaticContact CD1-CD1 3.95Å; Y179-W228 AromaticContact CD1-NE1 3.56Å; Y179-W228 HydrophobicContact CD2-CB 4.13Å; Y179-W228 AromaticContact CD2-CD1 3.66Å; Y179-W228 AromaticContact CD2-CD2 3.59Å; Y179-W228 HydrophobicContact CD2-CD2 3.59Å; Y179-W228 AromaticContact CD2-CE2 3.76Å; Y179-W228 HydrophobicContact CD2-CE3 4.22Å; Y179-W228 AromaticContact CD2-CG 3.54Å; Y179-W228 HydrophobicContact CD2-CG 3.54Å; Y179-W228 HydrophobicContact CD2-CZ2 4.47Å; Y179-W228 AromaticContact CD2-NE1 3.77Å; Y179-W228 AromaticContact CE1-CD1 3.61Å; Y179-W228 HydrophobicContact CE1-CG 4.41Å; Y179-W228 AromaticContact CE1-NE1 3.64Å; Y179-W228 HydrophobicContact CE2-CB 3.59Å; Y179-W228 AromaticContact CE2-CD1 3.3Å; Y179-W228 AromaticContact CE2-CD2 3.92Å; Y179-W228 HydrophobicContact CE2-CD2 3.92Å; Y179-W228 AromaticContact CE2-CG 3.31Å; Y179-W228 HydrophobicContact CE2-CG 3.31Å; Y179-W228 AromaticContact CE2-NE1 3.86Å; Y179-W228 AromaticContact CG-CD1 3.97Å; Y179-W228 HydrophobicContact CG-CD2 4.02Å; Y179-W228 AromaticContact CG-CE2 3.66Å; Y179-W228 HydrophobicContact CG-CG 4.2Å; Y179-W228 HydrophobicContact CG-CZ2 4.09Å; Y179-W228 AromaticContact CG-NE1 3.63Å; Y179-W228 AromaticContact CZ-CD1 3.27Å; Y179-W228 AromaticContact CZ-CG 3.79Å; Y179-W228 AromaticContact CZ-NE1 3.8Å
180E93.7Very high96.6Very high103 Ų10342.8 Ų42.848%0.48123%0.225SC..Hα-helixtrans-79.9-30.5-169.2-64.3-175.3169.100113.6V176V176-E180 HydrophobicContact CG1-CG 4Å; V176-E180 WeakPolarHBondContact CG1-OE2 3.49Å; V176-E180 WeakPolarHBondContact O-CB 3.31Å; V176-E180 PolarHBondContact O-N 3.32Å
181I94.8Very high96.5Very high29 Ų2943.7 Ų43.715%0.14923%0.229CC..THydrogen-bonded Turntrans-104.8-47-172-53.7-59.5000112.2R127 A130 E131 I142 F177R127-I181 HydrophobicContact CG-CD1 4.15Å; R127-I181 HydrophobicContact CG-CG1 3.86Å; A130-I181 HydrophobicContact CB-CD1 4.42Å; A130-I181 HydrophobicContact CB-CG2 4.18Å; E131-I181 HydrophobicContact CG-CD1 4.03Å; I142-I181 HydrophobicContact CB-CG2 4.44Å; I142-I181 HydrophobicContact CD1-CG2 3.78Å; I142-I181 HydrophobicContact CG1-CG2 3.56Å; I142-I181 HydrophobicContact CG2-CG2 4.19Å; F177-I181 HydrophobicContact CD2-CB 3.77Å; F177-I181 HydrophobicContact CD2-CG1 3.77Å; F177-I181 HydrophobicContact CD2-CG2 4.09Å; F177-I181 HydrophobicContact CE2-CB 3.84Å; F177-I181 HydrophobicContact CE2-CG1 4.2Å; F177-I181 HydrophobicContact CE2-CG2 3.64Å; F177-I181 HydrophobicContact CG-CB 4.49Å; F177-I181 HydrophobicContact CZ-CG2 4.36Å; F177-I181 VanDerWaalsContact O-CB 3.31Å; F177-I181 WeakPolarHBondContact O-CB 3.33Å; F177-I181 PolarHBondContact O-N 2.93Å
182L94.4Very high96.5Very high51 Ų5143.6 Ų43.627%0.26723%0.228SC..THydrogen-bonded Turntrans-90.4-0.8-179.4-69.1-177.8000113.8I142 F177 F178 S184I142-L182 HydrophobicContact CG2-CD2 3.47Å; I142-L182 VanDerWaalsContact CG2-CD2 3.47Å; I142-L182 HydrophobicContact CG2-CG 4.44Å; F177-L182 HydrophobicContact CD1-CD1 4.11Å; F177-L182 HydrophobicContact CD1-CG 4.38Å; F177-L182 HydrophobicContact CE1-CD1 3.38Å; F177-L182 HydrophobicContact CE1-CG 3.71Å; F177-L182 HydrophobicContact CZ-CD1 3.99Å; F177-L182 HydrophobicContact CZ-CD2 4.34Å; F177-L182 HydrophobicContact CZ-CG 3.89Å; F177-L182 PolarHBondContact O-N 3.12Å; F178-L182 HydrophobicContact CD1-CB 4.45Å; F178-L182 HydrophobicContact CD1-CD1 3.57Å; F178-L182 HydrophobicContact CE1-CD1 3.6Å; F178-L182 CarbonylContact O-C 3.59Å; L182-S184 PolarHBondContact O-N 2.65Å; L182-S184 VanDerWaalsContact O-N 3.1Å; L182-S184 PolarHBondContact O-OG 3.22Å
183N94.1Very high96.4Very high138 Ų13848.3 Ų48.374%0.73825%0.248SC*.  trans47.542.1-178.6-165.845.4000112.3F178 Y179 P185F178-N183 PolarHBondContact O-N 2.98Å; Y179-N183 WeakPolarHBondContact O-CA 3.29Å; Y179-N183 PolarHBondContact O-N 2.91Å; N183-P185 VanDerWaalsContact O-CD 3.24Å; N183-P185 WeakPolarHBondContact O-CD 3.5Å
184S96.1Very high96.4Very high45 Ų4551 Ų5132%0.31526%0.26SS..  trans-118.667.4-174.4-66.10000110.1F178 L182 E186 K187 A188F178-S184 PolarHBondContact O-N 3.36Å; L182-S184 PolarHBondContact O-N 2.65Å; L182-S184 VanDerWaalsContact O-N 3.1Å; L182-S184 PolarHBondContact O-OG 3.22Å; S184-E186 VanDerWaalsContact C-N 3.32Å; S184-E186 PolarHBondContact O-N 3.43Å; S184-K187 PolarHBondContact O-N 2.92Å; S184-K187 VanDerWaalsContact O-N 3.13Å; S184-A188 PolarHBondContact O-N 3.2Å
185P95.5Very high96.4Very high34 Ų3451.6 Ų51.622%0.22127%0.265CS..Hα-helixtrans-61.4-37-171.124.1-34.7000113.1Y179 N183 K187 A188 C189Y179-P185 HydrophobicContact CD2-CB 3.88Å; Y179-P185 HydrophobicContact CE2-CB 3.74Å; N183-P185 VanDerWaalsContact O-CD 3.24Å; N183-P185 WeakPolarHBondContact O-CD 3.5Å; P185-K187 VanDerWaalsContact C-N 3.31Å; P185-K187 PolarHBondContact O-N 3.48Å; P185-A188 WeakPolarHBondContact O-CB 3.27Å; P185-A188 PolarHBondContact O-N 2.9Å; P185-C189 WeakPolarHBondContact O-CB 3.32Å; P185-C189 PolarHBondContact O-N 3.37Å; P185-C189 PolarHBondContact O-SG 3.09Å; P185-C189 VanDerWaalsContact O-SG 3.39Å
186E94.9Very high96.3Very high174 Ų17453.8 Ų53.881%0.81327%0.274SS*.Hα-helixtrans-58.9-43.8176.4-64.3-178.7178.800111.9S184 S190S184-E186 VanDerWaalsContact C-N 3.32Å; S184-E186 PolarHBondContact O-N 3.43Å; E186-S190 VanDerWaalsContact O-CB 3.22Å; E186-S190 WeakPolarHBondContact O-CB 3.28Å; E186-S190 PolarHBondContact O-N 3.18Å
187K96.2Very high96.3Very high101 Ų10156.5 Ų56.544%0.43929%0.289SS..Hα-helixtrans-70.4-38.3179.4-168.4170.1179.7-172.60111.5F178 S184 P185 L191F178-K187 HydrophobicContact CD1-CB 4.42Å; F178-K187 HydrophobicContact CD1-CD 3.63Å; F178-K187 HydrophobicContact CD1-CG 4.02Å; F178-K187 HydrophobicContact CD2-CD 4.46Å; F178-K187 HydrophobicContact CD2-CG 4.17Å; F178-K187 HydrophobicContact CE1-CD 3.5Å; F178-K187 VanDerWaalsContact CE1-CD 3.5Å; F178-K187 HydrophobicContact CE1-CG 4.23Å; F178-K187 VanDerWaalsContact CE1-NZ 3.27Å; F178-K187 HydrophobicContact CE2-CD 4.31Å; F178-K187 HydrophobicContact CE2-CG 4.33Å; F178-K187 HydrophobicContact CG-CB 4.37Å; F178-K187 HydrophobicContact CG-CD 4.16Å; F178-K187 HydrophobicContact CG-CG 4.04Å; F178-K187 HydrophobicContact CZ-CD 3.87Å; F178-K187 HydrophobicContact CZ-CG 4.38Å; S184-K187 PolarHBondContact O-N 2.92Å; S184-K187 VanDerWaalsContact O-N 3.13Å; P185-K187 VanDerWaalsContact C-N 3.31Å; P185-K187 PolarHBondContact O-N 3.48Å; K187-L191 WeakPolarHBondContact O-CB 3.21Å; K187-L191 PolarHBondContact O-N 3.02Å
188A97Very high96.2Very high0 Ų059.4 Ų59.40%030%0.304CS..Hα-helixtrans-60.8-51.5174.400000111.8S175 F178 Y179 S184 P185 S190 L191 A192 W228S175-A188 WeakPolarHBondContact CB-O 3.43Å; S175-A188 WeakPolarHBondContact O-CB 3.47Å; F178-A188 HydrophobicContact CB-CB 3.83Å; Y179-A188 HydrophobicContact CD2-CB 4.16Å; Y179-A188 HydrophobicContact CG-CB 4.45Å; S184-A188 PolarHBondContact O-N 3.2Å; P185-A188 WeakPolarHBondContact O-CB 3.27Å; P185-A188 PolarHBondContact O-N 2.9Å; A188-S190 PolarHBondContact O-N 3.4Å; A188-L191 PolarHBondContact O-N 2.8Å; A188-A192 WeakPolarHBondContact O-CB 3.28Å; A188-A192 PolarHBondContact O-N 3.46Å; A188-W228 HydrophobicContact CB-CE3 4.29Å; A188-W228 HydrophobicContact CB-CH2 4.46Å; A188-W228 HydrophobicContact CB-CZ3 4Å
189C96.4Very high96.1Very high22 Ų2259.2 Ų59.215%0.14930%0.303CS..Hα-helixtrans-63.3-42.5178.7-70.20000111.8P185 A192 K193 L225P185-C189 WeakPolarHBondContact O-CB 3.32Å; P185-C189 PolarHBondContact O-N 3.37Å; P185-C189 PolarHBondContact O-SG 3.09Å; P185-C189 VanDerWaalsContact O-SG 3.39Å; C189-A192 PolarHBondContact O-N 3.18Å; C189-K193 WeakPolarHBondContact O-CB 3.37Å; C189-K193 PolarHBondContact O-N 3.47Å; C189-L225 HydrophobicContact CB-CD2 4.07Å; C189-L225 WeakPolarHBondContact O-CD2 3.45Å
190S97Very high96Very high74 Ų7460.9 Ų60.952%0.51732%0.315SS..Hα-helixtrans-59.5-47.7176.8-176.80000111.8E186 A188 Q194E186-S190 VanDerWaalsContact O-CB 3.22Å; E186-S190 WeakPolarHBondContact O-CB 3.28Å; E186-S190 PolarHBondContact O-N 3.18Å; A188-S190 PolarHBondContact O-N 3.4Å; S190-Q194 VanDerWaalsContact O-CB 3.32Å; S190-Q194 WeakPolarHBondContact O-CB 3.4Å; S190-Q194 PolarHBondContact O-N 3.3Å
191L97.6Very high96.1Very high19 Ų1959.5 Ų59.510%0.09932%0.321CS..Hα-helixtrans-64.4-47.3178.9179.762.1000112.3F153 F174 F178 K187 A188 Q194 A195F153-L191 HydrophobicContact CE2-CD1 3.68Å; F153-L191 HydrophobicContact CZ-CD1 3.8Å; F174-L191 HydrophobicContact CB-CD2 3.91Å; F174-L191 HydrophobicContact CD1-CD2 3.82Å; F174-L191 HydrophobicContact CG-CD2 3.9Å; F178-L191 HydrophobicContact CD2-CD2 3.93Å; F178-L191 HydrophobicContact CE2-CD2 3.92Å; K187-L191 WeakPolarHBondContact O-CB 3.21Å; K187-L191 PolarHBondContact O-N 3.02Å; A188-L191 PolarHBondContact O-N 2.8Å; L191-Q194 PolarHBondContact O-N 3.21Å; L191-A195 WeakPolarHBondContact O-CB 3.37Å; L191-A195 PolarHBondContact O-N 3.35Å
192A97.6Very high96.1Very high0 Ų060.7 Ų60.70%033%0.326CS..Hα-helixtrans-63.9-42.6-179.900000111.7A188 C189 A195 F196 L221 L225 W228A188-A192 WeakPolarHBondContact O-CB 3.28Å; A188-A192 PolarHBondContact O-N 3.46Å; C189-A192 PolarHBondContact O-N 3.18Å; A192-A195 PolarHBondContact O-N 3.32Å; A192-F196 WeakPolarHBondContact O-CB 3.46Å; A192-F196 PolarHBondContact O-N 3.08Å; A192-L221 HydrophobicContact CB-CD2 3.85Å; A192-L225 HydrophobicContact CB-CD1 4.32Å; A192-L225 HydrophobicContact CB-CD2 3.9Å; A192-L225 HydrophobicContact CB-CG 3.98Å; A192-W228 HydrophobicContact CB-CZ3 4.21Å
193K96.7Very high95.9Very high119 Ų11959.7 Ų59.752%0.51732%0.32SS..Hα-helixtrans-64.4-46.9177.3-174.8-178.1178.3-169.30111.5C189 A195 F196 D197 L225C189-K193 WeakPolarHBondContact O-CB 3.37Å; C189-K193 PolarHBondContact O-N 3.47Å; K193-A195 PolarHBondContact O-N 3.23Å; K193-F196 PolarHBondContact O-N 3.29Å; K193-D197 WeakPolarHBondContact CE-OD2 3.45Å; K193-D197 WeakPolarHBondContact O-CB 3.44Å; K193-D197 PolarHBondContact O-N 3.46Å; K193-L225 HydrophobicContact CB-CD1 4.21Å; K193-L225 HydrophobicContact CB-CD2 4.28Å
194Q97.4Very high95.7Very high87 Ų8759.7 Ų59.741%0.40732%0.32SS..Hα-helixtrans-58.7-47.1177.8179.5171.815.300111.5S190 L191 F196 D197 D198S190-Q194 VanDerWaalsContact O-CB 3.32Å; S190-Q194 WeakPolarHBondContact O-CB 3.4Å; S190-Q194 PolarHBondContact O-N 3.3Å; L191-Q194 PolarHBondContact O-N 3.21Å; Q194-F196 VanDerWaalsContact C-N 3.3Å; Q194-F196 PolarHBondContact O-N 3.08Å; Q194-D197 PolarHBondContact O-N 2.9Å; Q194-D198 VanDerWaalsContact O-CB 3.31Å; Q194-D198 WeakPolarHBondContact O-CB 3.42Å; Q194-D198 PolarHBondContact O-N 3.48Å
195A97.3Very high95.3Very high15 Ų1564.2 Ų64.212%0.12433%0.334CS..Hα-helixtrans-62.8-37.6178.800000112.5A171 L191 A192 K193 A199 L221A171-A195 HydrophobicContact CB-CB 3.49Å; A171-A195 VanDerWaalsContact CB-CB 3.49Å; L191-A195 WeakPolarHBondContact O-CB 3.37Å; L191-A195 PolarHBondContact O-N 3.35Å; A192-A195 PolarHBondContact O-N 3.32Å; K193-A195 PolarHBondContact O-N 3.23Å; A195-A199 VanDerWaalsContact O-CB 3.32Å; A195-A199 WeakPolarHBondContact O-CB 3.5Å; A195-A199 PolarHBondContact O-N 3.37Å; A195-L221 HydrophobicContact CB-CD1 4.25Å
196F96.8Very high95Very high46 Ų4664.5 Ų64.520%0.20233%0.334CS..Hα-helixtrans-66.1-49.9175.8-173.7-87.4000111.8A192 K193 Q194 A199 I200 M218 L221 R222A192-F196 WeakPolarHBondContact O-CB 3.46Å; A192-F196 PolarHBondContact O-N 3.08Å; K193-F196 PolarHBondContact O-N 3.29Å; Q194-F196 VanDerWaalsContact C-N 3.3Å; Q194-F196 PolarHBondContact O-N 3.08Å; F196-A199 PolarHBondContact O-N 2.86Å; F196-I200 HydrophobicContact CD1-CG1 3.92Å; F196-I200 HydrophobicContact CE1-CD1 4.08Å; F196-I200 HydrophobicContact CE1-CG1 3.59Å; F196-I200 HydrophobicContact CZ-CD1 4.12Å; F196-I200 HydrophobicContact CZ-CG1 4.08Å; F196-I200 WeakPolarHBondContact O-CG1 3.35Å; F196-I200 PolarHBondContact O-N 3.22Å; F196-M218 HydrophobicContact CD2-CB 4.06Å; F196-M218 HydrophobicContact CD2-CE 4.48Å; F196-M218 WeakPolarHBondContact CD2-O 3.34Å; F196-M218 HydrophobicContact CE2-CB 3.97Å; F196-M218 HydrophobicContact CE2-CE 4.36Å; F196-M218 WeakPolarHBondContact CE2-O 3.38Å; F196-L221 HydrophobicContact CD2-CB 4.39Å; F196-R222 HydrophobicContact CD2-CB 4.46Å; F196-R222 HydrophobicContact CE2-CB 4Å
197D96.9Very high94.4Very high77 Ų7760.8 Ų60.841%0.41232%0.319SS..Hα-helixtrans-63.9-44.2-178.5-69.9-16.6000111.3K193 Q194 A199 I200 A201K193-D197 WeakPolarHBondContact CE-OD2 3.45Å; K193-D197 WeakPolarHBondContact O-CB 3.44Å; K193-D197 PolarHBondContact O-N 3.46Å; Q194-D197 PolarHBondContact O-N 2.9Å; D197-A199 VanDerWaalsContact C-N 3.31Å; D197-A199 PolarHBondContact O-N 3.43Å; D197-I200 PolarHBondContact O-N 3.44Å; D197-A201 PolarHBondContact O-N 2.9Å; D197-A201 VanDerWaalsContact O-N 3.12Å
198D95.9Very high93.8Very high60 Ų6062.8 Ų62.832%0.32133%0.331SS..Hα-helixtrans-61-39.3176.7-71.6-11.3000111.4P162 Q194P162-D198 HydrophobicContact CB-CB 3.97Å; Q194-D198 VanDerWaalsContact O-CB 3.31Å; Q194-D198 WeakPolarHBondContact O-CB 3.42Å; Q194-D198 PolarHBondContact O-N 3.48Å
199A95.6Very high92.9Very high0 Ų070.4 Ų70.40%037%0.366CS..Hα-helixtrans-74.6-36.2178.600000113T163 L168 A195 F196 D197 A201 E202 L203 M218T163-A199 HydrophobicContact CG2-CB 4.22Å; T163-A199 WeakPolarHBondContact CG2-O 3.45Å; L168-A199 HydrophobicContact CD2-CB 3.81Å; A195-A199 VanDerWaalsContact O-CB 3.32Å; A195-A199 WeakPolarHBondContact O-CB 3.5Å; A195-A199 PolarHBondContact O-N 3.37Å; F196-A199 PolarHBondContact O-N 2.86Å; D197-A199 VanDerWaalsContact C-N 3.31Å; D197-A199 PolarHBondContact O-N 3.43Å; A199-A201 VanDerWaalsContact C-N 3.27Å; A199-A201 PolarHBondContact O-N 3.44Å; A199-E202 PolarHBondContact O-N 3.33Å; A199-L203 PolarHBondContact O-N 3.11Å; A199-L203 VanDerWaalsContact O-N 3.08Å; A199-M218 HydrophobicContact CB-CE 3.88Å; A199-M218 HydrophobicContact CB-CG 4.31Å; A199-M218 HydrophobicContact CB-SD 3.87Å
200I94.9Very high92.2Very high85 Ų8571.2 Ų71.244%0.43637%0.372SS..Hα-helixtrans-59.5-40.5173.2-74.8-69.7000111F196 D197 E202 L203 M218F196-I200 HydrophobicContact CD1-CG1 3.92Å; F196-I200 HydrophobicContact CE1-CD1 4.08Å; F196-I200 HydrophobicContact CE1-CG1 3.59Å; F196-I200 HydrophobicContact CZ-CD1 4.12Å; F196-I200 HydrophobicContact CZ-CG1 4.08Å; F196-I200 WeakPolarHBondContact O-CG1 3.35Å; F196-I200 PolarHBondContact O-N 3.22Å; D197-I200 PolarHBondContact O-N 3.44Å; I200-E202 PolarHBondContact O-N 3.26Å; I200-E202 VanDerWaalsContact O-N 3.16Å; I200-L203 HydrophobicContact CD1-CD2 4.47Å; I200-L203 PolarHBondContact O-N 2.83Å; I200-M218 HydrophobicContact CB-CE 4.42Å; I200-M218 HydrophobicContact CD1-CE 3.41Å; I200-M218 VanDerWaalsContact CD1-CE 3.41Å; I200-M218 HydrophobicContact CG1-CE 3.52Å
201A95.2Very high91.8Very high74 Ų7472.9 Ų72.961%0.61237%0.368SS*.THydrogen-bonded Turntrans-63.8-18.3-178.500000114.1D197 A199D197-A201 PolarHBondContact O-N 2.9Å; D197-A201 VanDerWaalsContact O-N 3.12Å; A199-A201 VanDerWaalsContact C-N 3.27Å; A199-A201 PolarHBondContact O-N 3.44Å
202E94Very high91.5Very high54 Ų5477.8 Ų77.825%0.25239%0.388SS..THydrogen-bonded Turntrans-126.111.6-176.9-57.9-158.7-153.800113.6T163 A199 I200 D204 K205T163-E202 HydrophobicContact CG2-CB 4.02Å; A199-E202 PolarHBondContact O-N 3.33Å; I200-E202 PolarHBondContact O-N 3.26Å; I200-E202 VanDerWaalsContact O-N 3.16Å; E202-D204 PolarHBondContact O-N 3.46Å; E202-K205 HydrophobicContact CB-CD 4.33Å; E202-K205 WeakPolarHBondContact O-CB 3.15Å; E202-K205 PolarHBondContact O-N 3.35Å; E202-K205 IonicContact OE2-NZ 2.8Å; E202-K205 PolarHBondContact OE2-NZ 2.91Å
203L90.4Very high91.1Very high30 Ų3082.2 Ų82.216%0.15741%0.412CS..G310 helixtrans-65.6-28-173.7-164.970.6000112.9A199 I200 K205 L206 Y211 T215 M218A199-L203 PolarHBondContact O-N 3.11Å; A199-L203 VanDerWaalsContact O-N 3.08Å; I200-L203 HydrophobicContact CD1-CD2 4.47Å; I200-L203 PolarHBondContact O-N 2.83Å; L203-K205 PolarHBondContact O-N 2.9Å; L203-L206 HydrophobicContact CD1-CD1 3.81Å; L203-L206 PolarHBondContact O-N 2.87Å; L203-Y211 HydrophobicContact CD1-CD2 4.45Å; L203-Y211 HydrophobicContact CD1-CE2 4.31Å; L203-Y211 HydrophobicContact CD2-CE2 3.96Å; L203-Y211 HydrophobicContact CG-CD2 4.32Å; L203-Y211 HydrophobicContact CG-CE2 3.84Å; L203-T215 HydrophobicContact CD1-CG2 4.15Å; L203-T215 HydrophobicContact CD2-CG2 4.4Å; L203-M218 HydrophobicContact CD1-CE 4.28Å; L203-M218 HydrophobicContact CD1-SD 3.75Å
204D89.9Confident91Very high137 Ų13776.5 Ų76.573%0.73339%0.387SS*.G310 helixtrans-67.4-16.1178.664.8-42.9000113.7E202E202-D204 PolarHBondContact O-N 3.46Å
205K87.7Confident90.8Very high140 Ų14074.4 Ų74.461%0.60938%0.38SS*.G310 helixtrans-86.3-9.2179.8-56.2179.8-169.1167.90113.9E202 L203E202-K205 HydrophobicContact CB-CD 4.33Å; E202-K205 WeakPolarHBondContact O-CB 3.15Å; E202-K205 PolarHBondContact O-N 3.35Å; E202-K205 IonicContact OE2-NZ 2.8Å; E202-K205 PolarHBondContact OE2-NZ 2.91Å; L203-K205 PolarHBondContact O-N 2.9Å
206L88.6Confident90.7Very high40 Ų4079 Ų7921%0.20940%0.402CS..  trans-77.4147-174.3-69.2-178.1000112.9T163 L203 Y211T163-L206 HydrophobicContact CG2-CD1 4.28Å; T163-L206 HydrophobicContact CG2-CG 4.35Å; T163-L206 WeakPolarHBondContact OG1-CD2 3.32Å; L203-L206 HydrophobicContact CD1-CD1 3.81Å; L203-L206 PolarHBondContact O-N 2.87Å; L206-Y211 HydrophobicContact CB-CD2 4.32Å; L206-Y211 HydrophobicContact CD1-CD2 4.43Å
207N84.3Confident90.7Very high96 Ų9678.2 Ų78.251%0.51340%0.4SS..  trans-79.9167.9165.167.937.2000110.8E209 S210 Y211N207-E209 VanDerWaalsContact C-N 3.32Å; N207-E209 PolarHBondContact O-N 3.18Å; N207-E209 PolarHBondContact OD1-N 2.98Å; N207-S210 WeakPolarHBondContact OD1-CB 3.23Å; N207-S210 PolarHBondContact OD1-N 3.48Å; N207-S210 PolarHBondContact OD1-OG 3.03Å; N207-Y211 WeakPolarHBondContact O-CB 3.48Å; N207-Y211 PolarHBondContact O-N 2.89Å
208E82.2Confident90.7Very high144 Ų14474.9 Ų74.967%0.67338%0.382SS*.Hα-helixtrans-61.8-34.8-172.9-164.1-171.4155.200114K212E208-K212 PolarHBondContact O-N 2.58Å; E208-K212 IonicContact OE1-NZ 2.66Å; E208-K212 PolarHBondContact OE1-NZ 3.5Å; E208-K212 VanDerWaalsContact OE1-NZ 3.16Å
209E77.8Confident90.7Very high159 Ų15975.1 Ų75.174%0.74338%0.381SS*.Hα-helixtrans-70.9-53.9-179.3-172.8174.7-172.900111N207 Y211 K212N207-E209 VanDerWaalsContact C-N 3.32Å; N207-E209 PolarHBondContact O-N 3.18Å; N207-E209 PolarHBondContact OD1-N 2.98Å; E209-Y211 PolarHBondContact O-N 3.31Å; E209-K212 PolarHBondContact O-N 2.98Å
210S82.1Confident90.8Very high40 Ų4078.9 Ų78.928%0.2840%0.401SS..Hα-helixtrans-63.4-31.2176.4-59.40000112.2N207 K212 D213 S214N207-S210 WeakPolarHBondContact OD1-CB 3.23Å; N207-S210 PolarHBondContact OD1-N 3.48Å; N207-S210 PolarHBondContact OD1-OG 3.03Å; S210-K212 PolarHBondContact O-N 2.99Å; S210-D213 PolarHBondContact O-N 3.37Å; S210-S214 VanDerWaalsContact O-CB 3.32Å; S210-S214 WeakPolarHBondContact O-CB 3.36Å; S210-S214 PolarHBondContact O-N 3.01Å; S210-S214 PolarHBondContact O-OG 3.13Å
211Y88.9Confident90.8Very high108 Ų10874.8 Ų74.842%0.42438%0.38SS..Hα-helixtrans-60.5-43.4178.7-175.1-89.1000112.1L203 L206 N207 E209 T215L203-Y211 HydrophobicContact CD1-CD2 4.45Å; L203-Y211 HydrophobicContact CD1-CE2 4.31Å; L203-Y211 HydrophobicContact CD2-CE2 3.96Å; L203-Y211 HydrophobicContact CG-CD2 4.32Å; L203-Y211 HydrophobicContact CG-CE2 3.84Å; L206-Y211 HydrophobicContact CB-CD2 4.32Å; L206-Y211 HydrophobicContact CD1-CD2 4.43Å; N207-Y211 WeakPolarHBondContact O-CB 3.48Å; N207-Y211 PolarHBondContact O-N 2.89Å; E209-Y211 PolarHBondContact O-N 3.31Å; Y211-T215 HydrophobicContact CD1-CG2 4.01Å; Y211-T215 HydrophobicContact CD2-CG2 4.31Å; Y211-T215 HydrophobicContact CE1-CG2 3.7Å; Y211-T215 HydrophobicContact CE2-CG2 4.03Å; Y211-T215 HydrophobicContact CG-CG2 4.3Å; Y211-T215 VanDerWaalsContact O-CB 3.31Å; Y211-T215 WeakPolarHBondContact O-CB 3.47Å; Y211-T215 VanDerWaalsContact O-CG2 3.23Å; Y211-T215 WeakPolarHBondContact O-CG2 3.41Å; Y211-T215 PolarHBondContact O-N 2.89Å; Y211-T215 PolarHBondContact O-OG1 3.21Å
212K90.3Very high90.9Very high123 Ų12377.2 Ų77.254%0.53537%0.373SS..Hα-helixtrans-64.3-46.6-179.3-72.4175.6-173.8162.80111.6E208 E209 S210 T215 L216E208-K212 PolarHBondContact O-N 2.58Å; E208-K212 IonicContact OE1-NZ 2.66Å; E208-K212 PolarHBondContact OE1-NZ 3.5Å; E208-K212 VanDerWaalsContact OE1-NZ 3.16Å; E209-K212 PolarHBondContact O-N 2.98Å; S210-K212 PolarHBondContact O-N 2.99Å; K212-T215 PolarHBondContact O-OG1 3.48Å; K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 2.96Å; K212-L216 VanDerWaalsContact O-N 3.11Å
213D90.7Very high91Very high92 Ų9278 Ų7849%0.49238%0.379SS..Hα-helixtrans-67.7-44.9-179.1-73.4-8.9000111.9P165 S210 L216 I217P165-D213 HydrophobicContact CB-CB 4.29Å; P165-D213 HydrophobicContact CG-CB 3.93Å; S210-D213 PolarHBondContact O-N 3.37Å; D213-L216 PolarHBondContact O-N 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.3Å; D213-I217 PolarHBondContact O-N 3.06Å
214S93.3Very high91.2Very high0 Ų078.3 Ų78.30%038%0.381CS..Hα-helixtrans-65.7-44179.9-60.40000112T163 S210 L216 I217 M218T163-S214 WeakPolarHBondContact O-CB 3.22Å; T163-S214 PolarHBondContact O-OG 3.31Å; S210-S214 VanDerWaalsContact O-CB 3.32Å; S210-S214 WeakPolarHBondContact O-CB 3.36Å; S210-S214 PolarHBondContact O-N 3.01Å; S210-S214 PolarHBondContact O-OG 3.13Å; S214-L216 VanDerWaalsContact C-N 3.34Å; S214-L216 PolarHBondContact O-N 3.03Å; S214-I217 PolarHBondContact O-N 2.79Å; S214-M218 VanDerWaalsContact O-CG 3.23Å; S214-M218 WeakPolarHBondContact O-CG 3.44Å; S214-M218 PolarHBondContact O-N 3.31Å
215T93.8Very high91.4Very high43 Ų4373.2 Ų73.226%0.26435%0.353SS..Hα-helixtrans-66.5-34.517953.20000112.8L203 Y211 K212 I217 M218 Q219L203-T215 HydrophobicContact CD1-CG2 4.15Å; L203-T215 HydrophobicContact CD2-CG2 4.4Å; Y211-T215 HydrophobicContact CD1-CG2 4.01Å; Y211-T215 HydrophobicContact CD2-CG2 4.31Å; Y211-T215 HydrophobicContact CE1-CG2 3.7Å; Y211-T215 HydrophobicContact CE2-CG2 4.03Å; Y211-T215 HydrophobicContact CG-CG2 4.3Å; Y211-T215 VanDerWaalsContact O-CB 3.31Å; Y211-T215 WeakPolarHBondContact O-CB 3.47Å; Y211-T215 VanDerWaalsContact O-CG2 3.23Å; Y211-T215 WeakPolarHBondContact O-CG2 3.41Å; Y211-T215 PolarHBondContact O-N 2.89Å; Y211-T215 PolarHBondContact O-OG1 3.21Å; K212-T215 PolarHBondContact O-OG1 3.48Å; T215-I217 VanDerWaalsContact C-N 3.35Å; T215-I217 PolarHBondContact O-N 2.66Å; T215-M218 PolarHBondContact O-N 2.79Å; T215-Q219 WeakPolarHBondContact O-CB 3.48Å; T215-Q219 PolarHBondContact O-N 2.81Å
216L94.9Very high91.8Very high111 Ų11170.7 Ų70.758%0.58135%0.35SS*.Hα-helixtrans-61-43.5172.9179.262.3000111.6K212 D213 S214 Q219 L220K212-L216 WeakPolarHBondContact O-CB 3.45Å; K212-L216 PolarHBondContact O-N 2.96Å; K212-L216 VanDerWaalsContact O-N 3.11Å; D213-L216 PolarHBondContact O-N 3.26Å; S214-L216 VanDerWaalsContact C-N 3.34Å; S214-L216 PolarHBondContact O-N 3.03Å; L216-Q219 WeakPolarHBondContact O-CB 3.41Å; L216-Q219 PolarHBondContact O-N 3.39Å; L216-L220 WeakPolarHBondContact O-CG 3.49Å; L216-L220 PolarHBondContact O-N 2.9Å
217I96.4Very high92Very high29 Ų2973.2 Ų73.215%0.14936%0.363CS..Hα-helixtrans-72.3-38.9179.6-59167.2000111.2P165 L168 L172 D213 S214 T215 Q219 L220 L221P165-I217 HydrophobicContact CB-CD1 4.01Å; P165-I217 WeakPolarHBondContact O-CD1 3.35Å; L168-I217 HydrophobicContact CB-CB 4.2Å; L168-I217 HydrophobicContact CB-CD1 4.41Å; L168-I217 HydrophobicContact CB-CG2 3.7Å; L172-I217 HydrophobicContact CB-CG2 4.4Å; L172-I217 HydrophobicContact CD2-CG2 4.2Å; D213-I217 WeakPolarHBondContact O-CG1 3.3Å; D213-I217 PolarHBondContact O-N 3.06Å; S214-I217 PolarHBondContact O-N 2.79Å; T215-I217 VanDerWaalsContact C-N 3.35Å; T215-I217 PolarHBondContact O-N 2.66Å; I217-Q219 PolarHBondContact O-N 3Å; I217-L220 WeakPolarHBondContact O-CB 3.22Å; I217-L220 PolarHBondContact O-N 2.95Å; I217-L220 VanDerWaalsContact O-N 3.12Å; I217-L221 PolarHBondContact O-N 3.1Å
218M96.9Very high92.5Very high7 Ų769 Ų693%0.03434%0.34CS..Hα-helixtrans-60.5-37.1174.1-70169.972.200111.8L168 F196 A199 I200 L203 S214 T215 L220 L221 R222L168-M218 HydrophobicContact CD1-CG 4.02Å; L168-M218 HydrophobicContact CD1-SD 4.49Å; L168-M218 HydrophobicContact CD2-CG 4.22Å; F196-M218 HydrophobicContact CD2-CB 4.06Å; F196-M218 HydrophobicContact CD2-CE 4.48Å; F196-M218 WeakPolarHBondContact CD2-O 3.34Å; F196-M218 HydrophobicContact CE2-CB 3.97Å; F196-M218 HydrophobicContact CE2-CE 4.36Å; F196-M218 WeakPolarHBondContact CE2-O 3.38Å; A199-M218 HydrophobicContact CB-CE 3.88Å; A199-M218 HydrophobicContact CB-CG 4.31Å; A199-M218 HydrophobicContact CB-SD 3.87Å; I200-M218 HydrophobicContact CB-CE 4.42Å; I200-M218 HydrophobicContact CD1-CE 3.41Å; I200-M218 VanDerWaalsContact CD1-CE 3.41Å; I200-M218 HydrophobicContact CG1-CE 3.52Å; L203-M218 HydrophobicContact CD1-CE 4.28Å; L203-M218 HydrophobicContact CD1-SD 3.75Å; S214-M218 VanDerWaalsContact O-CG 3.23Å; S214-M218 WeakPolarHBondContact O-CG 3.44Å; S214-M218 PolarHBondContact O-N 3.31Å; T215-M218 PolarHBondContact O-N 2.79Å; M218-L220 VanDerWaalsContact C-N 3.35Å; M218-L221 WeakPolarHBondContact O-CB 3.33Å; M218-L221 PolarHBondContact O-N 3.41Å; M218-R222 PolarHBondContact O-N 3.32Å
219Q96.6Very high92.7Very high65 Ų6566.1 Ų66.130%0.30433%0.332SS..Hα-helixtrans-60.3-44.8173.3-179.856.138.600111.5T215 L216 I217 L221 R222 D223T215-Q219 WeakPolarHBondContact O-CB 3.48Å; T215-Q219 PolarHBondContact O-N 2.81Å; L216-Q219 WeakPolarHBondContact O-CB 3.41Å; L216-Q219 PolarHBondContact O-N 3.39Å; I217-Q219 PolarHBondContact O-N 3Å; Q219-L221 PolarHBondContact O-N 3.33Å; Q219-R222 WeakPolarHBondContact O-CB 3.32Å; Q219-R222 PolarHBondContact O-N 2.9Å; Q219-D223 VanDerWaalsContact NE2-CG 3.25Å; Q219-D223 PolarHBondContact NE2-OD1 3.14Å; Q219-D223 PolarHBondContact NE2-OD2 2.82Å; Q219-D223 VanDerWaalsContact NE2-OD2 3.13Å; Q219-D223 PolarHBondContact O-N 2.78Å
220L96.9Very high93.1Very high79 Ų7961.9 Ų61.941%0.41432%0.32SS..Hα-helixtrans-64-38.6176.5-64.3173.2000112.7L172 L216 I217 M218 R222 D223 N224L172-L220 HydrophobicContact CD1-CB 4.13Å; L172-L220 HydrophobicContact CD2-CB 3.87Å; L172-L220 HydrophobicContact CD2-CD1 3.92Å; L216-L220 WeakPolarHBondContact O-CG 3.49Å; L216-L220 PolarHBondContact O-N 2.9Å; I217-L220 WeakPolarHBondContact O-CB 3.22Å; I217-L220 PolarHBondContact O-N 2.95Å; I217-L220 VanDerWaalsContact O-N 3.12Å; M218-L220 VanDerWaalsContact C-N 3.35Å; L220-R222 VanDerWaalsContact C-N 3.34Å; L220-D223 PolarHBondContact O-N 3.04Å; L220-N224 PolarHBondContact O-N 3.15Å
221L96.6Very high92.7Very high0 Ų064.7 Ų64.70%033%0.332CS..Hα-helixtrans-60.2-44.8173-78168.5000111.4L168 L172 A192 A195 F196 I217 M218 Q219 N224 L225L168-L221 HydrophobicContact CD2-CD1 4.11Å; L172-L221 HydrophobicContact CB-CD2 3.95Å; L172-L221 HydrophobicContact CB-CG 4.27Å; L172-L221 HydrophobicContact CD1-CD2 3.85Å; L172-L221 HydrophobicContact CD1-CG 4.09Å; A192-L221 HydrophobicContact CB-CD2 3.85Å; A195-L221 HydrophobicContact CB-CD1 4.25Å; F196-L221 HydrophobicContact CD2-CB 4.39Å; I217-L221 PolarHBondContact O-N 3.1Å; M218-L221 WeakPolarHBondContact O-CB 3.33Å; M218-L221 PolarHBondContact O-N 3.41Å; Q219-L221 PolarHBondContact O-N 3.33Å; L221-N224 PolarHBondContact O-N 3.08Å; L221-L225 WeakPolarHBondContact O-CG 3.32Å; L221-L225 PolarHBondContact O-N 2.97Å
222R96.3Very high91.6Very high124 Ų12463.9 Ų63.947%0.46834%0.335SS..Hα-helixtrans-62.1-44.5176.6-172.8-177.275179.74.7111.6F196 M218 Q219 L220 N224 L225 T226F196-R222 HydrophobicContact CD2-CB 4.46Å; F196-R222 HydrophobicContact CE2-CB 4Å; M218-R222 PolarHBondContact O-N 3.32Å; Q219-R222 WeakPolarHBondContact O-CB 3.32Å; Q219-R222 PolarHBondContact O-N 2.9Å; L220-R222 VanDerWaalsContact C-N 3.34Å; R222-N224 VanDerWaalsContact C-N 3.35Å; R222-N224 PolarHBondContact O-N 3.45Å; R222-L225 WeakPolarHBondContact O-CB 3.34Å; R222-L225 PolarHBondContact O-N 3.43Å; R222-T226 PolarHBondContact O-N 2.84Å; R222-T226 PolarHBondContact O-OG1 3.41Å
223D96.6Very high89.9Confident70 Ų7060.9 Ų60.937%0.37433%0.333SS..Hα-helixtrans-63.9-42-178.3-64.9-13.7000111Q219 L220 T226 L227Q219-D223 VanDerWaalsContact NE2-CG 3.25Å; Q219-D223 PolarHBondContact NE2-OD1 3.14Å; Q219-D223 PolarHBondContact NE2-OD2 2.82Å; Q219-D223 VanDerWaalsContact NE2-OD2 3.13Å; Q219-D223 PolarHBondContact O-N 2.78Å; L220-D223 PolarHBondContact O-N 3.04Å; D223-T226 PolarHBondContact O-N 3.14Å; D223-L227 PolarHBondContact O-N 3.24Å
224N94.6Very high88.1Confident37 Ų3761.7 Ų61.720%0.19834%0.344CS..Hα-helixtrans-61-45.1172-79.1-0.1000112.1L172 V176 L220 L221 R222 T226 L227 W228L172-N224 WeakPolarHBondContact CD1-ND2 3.36Å; V176-N224 WeakPolarHBondContact CG2-ND2 3.49Å; L220-N224 PolarHBondContact O-N 3.15Å; L221-N224 PolarHBondContact O-N 3.08Å; R222-N224 VanDerWaalsContact C-N 3.35Å; R222-N224 PolarHBondContact O-N 3.45Å; N224-T226 VanDerWaalsContact C-N 3.33Å; N224-T226 PolarHBondContact O-N 2.97Å; N224-L227 PolarHBondContact O-N 3.46Å; N224-W228 HydrophobicContact CB-CD2 4.22Å; N224-W228 HydrophobicContact CB-CE3 4.17Å; N224-W228 HydrophobicContact CB-CH2 3.75Å; N224-W228 HydrophobicContact CB-CZ2 3.79Å; N224-W228 HydrophobicContact CB-CZ3 3.94Å; N224-W228 WeakPolarHBondContact O-CB 3.14Å; N224-W228 VanDerWaalsContact O-CD2 3.24Å; N224-W228 PolarHBondContact O-N 3.29Å
225L94.4Very high86Confident30 Ų3070.9 Ų70.916%0.15739%0.387CS..Hα-helixtrans-60.5-42.1177.4-76168000112.1C189 A192 K193 L221 R222 T229C189-L225 HydrophobicContact CB-CD2 4.07Å; C189-L225 WeakPolarHBondContact O-CD2 3.45Å; A192-L225 HydrophobicContact CB-CD1 4.32Å; A192-L225 HydrophobicContact CB-CD2 3.9Å; A192-L225 HydrophobicContact CB-CG 3.98Å; K193-L225 HydrophobicContact CB-CD1 4.21Å; K193-L225 HydrophobicContact CB-CD2 4.28Å; L221-L225 WeakPolarHBondContact O-CG 3.32Å; L221-L225 PolarHBondContact O-N 2.97Å; R222-L225 WeakPolarHBondContact O-CB 3.34Å; R222-L225 PolarHBondContact O-N 3.43Å; L225-T229 WeakPolarHBondContact O-CB 3.31Å; L225-T229 VanDerWaalsContact O-CG2 3.3Å; L225-T229 WeakPolarHBondContact O-CG2 3.47Å; L225-T229 PolarHBondContact O-N 3.2Å; L225-T229 PolarHBondContact O-OG1 3.08Å
226T94.8Very high83.6Confident88 Ų8877.8 Ų77.854%0.5442%0.416SS..Hα-helixtrans-61.8-47.5176.3-61.80000111.1R222 D223 N224 T229 S230R222-T226 PolarHBondContact O-N 2.84Å; R222-T226 PolarHBondContact O-OG1 3.41Å; D223-T226 PolarHBondContact O-N 3.14Å; N224-T226 VanDerWaalsContact C-N 3.33Å; N224-T226 PolarHBondContact O-N 2.97Å; T226-T229 PolarHBondContact O-N 2.71Å; T226-T229 PolarHBondContact O-OG1 3.43Å; T226-S230 PolarHBondContact O-N 3.48Å; T226-S230 VanDerWaalsContact O-N 3.08Å; T226-S230 PolarHBondContact O-OG 3.04Å
227L93.5Very high81Confident92 Ų9275.6 Ų75.648%0.48242%0.42SS..Hα-helixtrans-60.9-48.4178.6-177.665.8000111.9D223 N224 T229 S230 D231D223-L227 PolarHBondContact O-N 3.24Å; N224-L227 PolarHBondContact O-N 3.46Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 2.93Å; L227-S230 PolarHBondContact O-N 2.92Å; L227-S230 PolarHBondContact O-OG 3.38Å; L227-D231 PolarHBondContact O-N 3.38Å; L227-D231 VanDerWaalsContact O-N 3.09Å
228W94.1Very high78.3Confident7 Ų783.8 Ų83.83%0.02746%0.458CS..Hα-helixtrans-73-24.3-176-60.1-23.3000113.6V176 Y179 A188 A192 N224 N232V176-W228 HydrophobicContact CG2-CH2 4.14Å; V176-W228 HydrophobicContact CG2-CZ2 4.03Å; Y179-W228 AromaticContact CD1-CD1 3.95Å; Y179-W228 AromaticContact CD1-NE1 3.56Å; Y179-W228 HydrophobicContact CD2-CB 4.13Å; Y179-W228 AromaticContact CD2-CD1 3.66Å; Y179-W228 AromaticContact CD2-CD2 3.59Å; Y179-W228 HydrophobicContact CD2-CD2 3.59Å; Y179-W228 AromaticContact CD2-CE2 3.76Å; Y179-W228 HydrophobicContact CD2-CE3 4.22Å; Y179-W228 AromaticContact CD2-CG 3.54Å; Y179-W228 HydrophobicContact CD2-CG 3.54Å; Y179-W228 HydrophobicContact CD2-CZ2 4.47Å; Y179-W228 AromaticContact CD2-NE1 3.77Å; Y179-W228 AromaticContact CE1-CD1 3.61Å; Y179-W228 HydrophobicContact CE1-CG 4.41Å; Y179-W228 AromaticContact CE1-NE1 3.64Å; Y179-W228 HydrophobicContact CE2-CB 3.59Å; Y179-W228 AromaticContact CE2-CD1 3.3Å; Y179-W228 AromaticContact CE2-CD2 3.92Å; Y179-W228 HydrophobicContact CE2-CD2 3.92Å; Y179-W228 AromaticContact CE2-CG 3.31Å; Y179-W228 HydrophobicContact CE2-CG 3.31Å; Y179-W228 AromaticContact CE2-NE1 3.86Å; Y179-W228 AromaticContact CG-CD1 3.97Å; Y179-W228 HydrophobicContact CG-CD2 4.02Å; Y179-W228 AromaticContact CG-CE2 3.66Å; Y179-W228 HydrophobicContact CG-CG 4.2Å; Y179-W228 HydrophobicContact CG-CZ2 4.09Å; Y179-W228 AromaticContact CG-NE1 3.63Å; Y179-W228 AromaticContact CZ-CD1 3.27Å; Y179-W228 AromaticContact CZ-CG 3.79Å; Y179-W228 AromaticContact CZ-NE1 3.8Å; A188-W228 HydrophobicContact CB-CE3 4.29Å; A188-W228 HydrophobicContact CB-CH2 4.46Å; A188-W228 HydrophobicContact CB-CZ3 4Å; A192-W228 HydrophobicContact CB-CZ3 4.21Å; N224-W228 HydrophobicContact CB-CD2 4.22Å; N224-W228 HydrophobicContact CB-CE3 4.17Å; N224-W228 HydrophobicContact CB-CH2 3.75Å; N224-W228 HydrophobicContact CB-CZ2 3.79Å; N224-W228 HydrophobicContact CB-CZ3 3.94Å; N224-W228 WeakPolarHBondContact O-CB 3.14Å; N224-W228 VanDerWaalsContact O-CD2 3.24Å; N224-W228 PolarHBondContact O-N 3.29Å; W228-N232 PolarHBondContact O-N 3.34Å; W228-N232 PolarHBondContact O-ND2 3.42Å
229T87.4Confident75.5Confident84 Ų8487 Ų8752%0.51549%0.493SS..Hα-helixtrans-83.8-28175.450.90000112.4L225 T226 L227 A233L225-T229 WeakPolarHBondContact O-CB 3.31Å; L225-T229 VanDerWaalsContact O-CG2 3.3Å; L225-T229 WeakPolarHBondContact O-CG2 3.47Å; L225-T229 PolarHBondContact O-N 3.2Å; L225-T229 PolarHBondContact O-OG1 3.08Å; T226-T229 PolarHBondContact O-N 2.71Å; T226-T229 PolarHBondContact O-OG1 3.43Å; L227-T229 VanDerWaalsContact C-N 3.32Å; L227-T229 PolarHBondContact O-N 2.93Å; T229-A233 PolarHBondContact O-N 3.41Å
230S85.8Confident72.6Confident70 Ų7087.4 Ų87.449%0.4951%0.514SS..Hα-helixtrans-70-38.9169.155.50000112.5T226 L227 N232 A233T226-S230 PolarHBondContact O-N 3.48Å; T226-S230 VanDerWaalsContact O-N 3.08Å; T226-S230 PolarHBondContact O-OG 3.04Å; L227-S230 PolarHBondContact O-N 2.92Å; L227-S230 PolarHBondContact O-OG 3.38Å; S230-N232 PolarHBondContact O-N 2.93Å; S230-A233 PolarHBondContact O-N 3.28Å
231D74.5Confident69.9Low100 Ų10093 Ų9354%0.53554%0.539SS..Hα-helixtrans-69.1-23.2179.5-70.9-9.8000113L227L227-D231 PolarHBondContact O-N 3.38Å; L227-D231 VanDerWaalsContact O-N 3.09Å
232N64.3Low67.1Low90 Ų9097.8 Ų97.848%0.48158%0.578SS.*THydrogen-bonded Turntrans-100.21.9178.9-73.1-52.6000113.5W228 S230W228-N232 PolarHBondContact O-N 3.34Å; W228-N232 PolarHBondContact O-ND2 3.42Å; S230-N232 PolarHBondContact O-N 2.93Å
233A55.7Low64.3Low60 Ų6095.3 Ų95.350%0.49659%0.591SS.*SBendtrans-66.6128.417200000108.2T229 S230 E235T229-A233 PolarHBondContact O-N 3.41Å; S230-A233 PolarHBondContact O-N 3.28Å; A233-E235 PolarHBondContact O-N 3.4Å
234P52.5Low61.4Low109 Ų109101.4 Ų101.471%0.70862%0.617SS**  trans-56.1130.8168.822.8-29.1000107.4E236P234-E236 VanDerWaalsContact C-N 3.29Å; P234-E236 PolarHBondContact O-N 3.26Å
235E48.4Very low58.8Low194 Ų194104.1 Ų104.191%0.90764%0.644SS**  trans-52.5103.1164.2-74.2-174.8163.500105.9A233 G237A233-E235 PolarHBondContact O-N 3.4Å; E235-G237 PolarHBondContact O-N 3.18Å
236E43.3Very low56Low188 Ų188106.4 Ų106.488%0.87968%0.675SS**  trans-62.499.5169.1-76.8-169.4166.200105.1P234 E238P234-E236 VanDerWaalsContact C-N 3.29Å; P234-E236 PolarHBondContact O-N 3.26Å; E236-E238 PolarHBondContact O-N 3.29Å
237G40.4Very low53.4Low65 Ų65111.4 Ų111.467%0.6769%0.692SS**  trans-49.5131.3177.600000109E235 G239E235-G237 PolarHBondContact O-N 3.18Å; G237-G239 VanDerWaalsContact C-N 3.34Å; G237-G239 PolarHBondContact O-N 3.38Å
238E40.7Very low50.7Low200 Ų200114.8 Ų114.894%0.93571%0.711SS**  trans-44.9101.6169.7-70.5-178.5150.700108.6E236 G240E236-E238 PolarHBondContact O-N 3.29Å; E238-G240 PolarHBondContact O-N 2.91Å; E238-G240 VanDerWaalsContact O-N 3.08Å
239G37.9Very low47.9Very low76 Ų76123.3 Ų123.378%0.78475%0.751SS**  trans-60.8113.6176.300000107.5G237 E241G237-G239 VanDerWaalsContact C-N 3.34Å; G237-G239 PolarHBondContact O-N 3.38Å; G239-E241 PolarHBondContact O-N 2.87Å
240G36.5Very low45.6Very low72 Ų72130.7 Ų130.774%0.74279%0.787SS**  trans-47.9134.2-176.100000113.2E238 A242E238-G240 PolarHBondContact O-N 2.91Å; E238-G240 VanDerWaalsContact O-N 3.08Å; G240-A242 PolarHBondContact O-N 3.22Å
241E38.6Very low43.6Very low198 Ų198133.7 Ų133.793%0.92580%0.802SS**  trans-54.3103.1160.1-71.9-178.4147.900108.6G239 G243G239-E241 PolarHBondContact O-N 2.87Å; E241-G243 VanDerWaalsContact C-N 3.32Å; E241-G243 PolarHBondContact O-N 3.4Å
242A39.4Very low41.9Very low99 Ų99135.5 Ų135.582%0.81882%0.816SS**  trans-68.597.3159.800000107.1G240 E244G240-A242 PolarHBondContact O-N 3.22Å; A242-E244 PolarHBondContact O-N 2.89Å; A242-E244 VanDerWaalsContact O-N 3.15Å
243G35.9Very low40.7Very low72 Ų72138 Ų13874%0.74284%0.835SS**  trans-61.7109.9170.400000110.7E241 A245E241-G243 VanDerWaalsContact C-N 3.32Å; E241-G243 PolarHBondContact O-N 3.4Å; G243-A245 VanDerWaalsContact C-N 3.34Å; G243-A245 PolarHBondContact O-N 2.73Å; G243-A245 VanDerWaalsContact O-N 3.1Å
244E37.3Very low39.8Very low198 Ų198142.6 Ų142.693%0.92586%0.855SS**  trans-70.793.2158.1-80-173.815300108.3A242 G246A242-E244 PolarHBondContact O-N 2.89Å; A242-E244 VanDerWaalsContact O-N 3.15Å; E244-G246 PolarHBondContact O-N 3.16Å
245A39.5Very low39Very low94 Ų94144.7 Ų144.778%0.77786%0.864SS**  trans-79.5106.5162.800000108.2G243 E247G243-A245 VanDerWaalsContact C-N 3.34Å; G243-A245 PolarHBondContact O-N 2.73Å; G243-A245 VanDerWaalsContact O-N 3.1Å; A245-E247 PolarHBondContact O-N 3.12Å
246G35.4Very low38.4Very low78 Ų78141.4 Ų141.480%0.80486%0.861SS**  trans-65.2117.1167.400000110.6E244E244-G246 PolarHBondContact O-N 3.16Å
247E39.7Very low38Very low193 Ų193138.1 Ų138.190%0.90286%0.86SS**  trans-79.4119.4163.4-73.9-178.3154.600109A245A245-E247 PolarHBondContact O-N 3.12Å
248N37Very low37.8Very low164 Ų164143.7 Ų143.788%0.87788%0.875SS**  trans-145.9102.4160.2-107.1-9.9000107.7
249E36.4Very low37.6Very low186 Ų186139 Ų13987%0.86987%0.87SS**  trans-164.190.4154.4-110.7176.9-17100110
250N37.7Very low37.6Very low238 Ų238144.7 Ų144.7100%1.27388%0.878SS**  175.80125.9-91.4-24.1000111.7

Retrieved 250 of 250 residues in 1677.2 ms (Link to these results)

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