G4VTW5_SCHMA Loading...

Golgi SNAP receptor complex member 1

AlphaFold DB , UniProt , Accession G4VTW5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 293 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
1M40.7Very low70.2Confident239 Ų23988.7 Ų88.7100%1.17747%0.468SS*.  0106.10-74.5176.1160.700106.9P3M1-P3 WeakPolarHBondContact O-CD 3.48Å
2I44.6Very low71.6Confident159 Ų15987.7 Ų87.782%0.81546%0.459SS*.PPolyproline II helixtrans-76.4116.8-176.2-59.3147000106.6S4I2-S4 PolarHBondContact O-N 3.02Å
3P51.1Low72.8Confident89 Ų8980.9 Ų80.958%0.57842%0.424SS*.PPolyproline II helixtrans-58.6116.2173.824.1-29.9000106.8M1 T5M1-P3 WeakPolarHBondContact O-CD 3.48Å; P3-T5 PolarHBondContact O-N 2.83Å
4S62.8Low73.8Confident73 Ų7385.4 Ų85.451%0.5143%0.432SS..PPolyproline II helixtrans-61.6129.4-178.4-47.60000106.4I2 W6 D7I2-S4 PolarHBondContact O-N 3.02Å; S4-W6 CarbonylContact O-C 3.54Å; S4-W6 PolarHBondContact O-N 3Å; S4-D7 WeakPolarHBondContact O-CB 3.25Å; S4-D7 PolarHBondContact O-N 3.22Å
5T76.8Confident74.9Confident72 Ų7285.8 Ų85.844%0.44243%0.434SS..Hα-helixtrans-36.4-39.3-175.551.50000113.9P3 D7 E8 L9 F92P3-T5 PolarHBondContact O-N 2.83Å; T5-D7 PolarHBondContact O-N 3.37Å; T5-E8 WeakPolarHBondContact O-CB 3.49Å; T5-E8 PolarHBondContact O-N 2.83Å; T5-E8 VanDerWaalsContact O-N 3.17Å; T5-L9 WeakPolarHBondContact O-CD1 3.27Å; T5-L9 PolarHBondContact O-N 2.82Å; T5-F92 VanDerWaalsContact OG1-CE1 3.26Å; T5-F92 WeakPolarHBondContact OG1-CE1 3.49Å; T5-F92 WeakPolarHBondContact OG1-CZ 3.06Å
6W77.5Confident75.7Confident13 Ų1381.5 Ų81.55%0.04941%0.413CS..Hα-helixtrans-52.8-43.7173.8-168.886.4000115.6S4 E8 L9 R10 Q123 T126S4-W6 CarbonylContact O-C 3.54Å; S4-W6 PolarHBondContact O-N 3Å; W6-E8 VanDerWaalsContact C-N 3.34Å; W6-L9 PolarHBondContact O-N 2.92Å; W6-R10 WeakPolarHBondContact O-CB 3.28Å; W6-R10 PolarHBondContact O-N 3.23Å; W6-Q123 HydrophobicContact CD2-CB 4.3Å; W6-Q123 HydrophobicContact CD2-CG 3.63Å; W6-Q123 VanDerWaalsContact CE2-CG 3.48Å; W6-Q123 HydrophobicContact CE3-CG 3.93Å; W6-Q123 HydrophobicContact CG-CG 4.19Å; W6-Q123 HydrophobicContact CH2-CB 4.33Å; W6-Q123 HydrophobicContact CH2-CG 3.93Å; W6-Q123 HydrophobicContact CZ2-CB 3.71Å; W6-Q123 HydrophobicContact CZ2-CG 3.69Å; W6-Q123 HydrophobicContact CZ3-CG 4.04Å; W6-T126 HydrophobicContact CH2-CG2 3.79Å; W6-T126 HydrophobicContact CZ2-CG2 3.78Å
7D79.6Confident76.5Confident51 Ų5178 Ų7827%0.27340%0.395SS..Hα-helixtrans-65.7-37.5177.2-77.3-44.2000111.9S4 T5 R10 I11S4-D7 WeakPolarHBondContact O-CB 3.25Å; S4-D7 PolarHBondContact O-N 3.22Å; T5-D7 PolarHBondContact O-N 3.37Å; D7-R10 PolarHBondContact O-N 3.01Å; D7-R10 IonicContact OD1-CZ 2.67Å; D7-R10 IonicContact OD1-NE 3.78Å; D7-R10 IonicContact OD1-NH2 3.24Å; D7-R10 PolarHBondContact OD1-NH2 2.95Å; D7-I11 VanDerWaalsContact O-CG1 3.29Å; D7-I11 WeakPolarHBondContact O-CG1 3.49Å; D7-I11 PolarHBondContact O-N 3.34Å
8E85.3Confident77.2Confident102 Ų10277.7 Ų77.748%0.47740%0.401SS..Hα-helixtrans-65.7-45.9175.7-172.1178.7177.400111T5 W6 R10 I11 Q12T5-E8 WeakPolarHBondContact O-CB 3.49Å; T5-E8 PolarHBondContact O-N 2.83Å; T5-E8 VanDerWaalsContact O-N 3.17Å; W6-E8 VanDerWaalsContact C-N 3.34Å; E8-R10 VanDerWaalsContact C-N 3.29Å; E8-R10 PolarHBondContact O-N 3.05Å; E8-I11 PolarHBondContact O-N 3.45Å; E8-Q12 WeakPolarHBondContact O-CG 3.33Å; E8-Q12 PolarHBondContact O-N 3.37Å
9L82.7Confident77.9Confident19 Ų1978 Ų7810%0.09940%0.4CS..Hα-helixtrans-59.7-40.9175.2-86.184000112.1T5 W6 I11 Q12 A13 I85 R88 M89 F92T5-L9 WeakPolarHBondContact O-CD1 3.27Å; T5-L9 PolarHBondContact O-N 2.82Å; W6-L9 PolarHBondContact O-N 2.92Å; L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 2.89Å; L9-Q12 PolarHBondContact O-N 3.42Å; L9-A13 WeakPolarHBondContact O-CB 3.48Å; L9-A13 PolarHBondContact O-N 3.02Å; L9-I85 HydrophobicContact CB-CG2 4.3Å; L9-I85 WeakPolarHBondContact O-CG2 3.33Å; L9-R88 HydrophobicContact CD2-CB 3.34Å; L9-M89 HydrophobicContact CB-CG 3.63Å; L9-M89 HydrophobicContact CB-SD 4.32Å; L9-M89 HydrophobicContact CD2-CG 3.79Å; L9-M89 HydrophobicContact CG-CG 4.38Å; L9-F92 HydrophobicContact CD1-CE2 3.9Å; L9-F92 HydrophobicContact CD2-CD2 4.1Å; L9-F92 HydrophobicContact CD2-CE2 3.87Å
10R83.8Confident78.4Confident63 Ų6374.1 Ų74.124%0.23838%0.38CS..Hα-helixtrans-64-39.7177.2179.8178.162.3161.3-2.6112W6 D7 E8 R14 M89 T126W6-R10 WeakPolarHBondContact O-CB 3.28Å; W6-R10 PolarHBondContact O-N 3.23Å; D7-R10 PolarHBondContact O-N 3.01Å; D7-R10 IonicContact OD1-CZ 2.67Å; D7-R10 IonicContact OD1-NE 3.78Å; D7-R10 IonicContact OD1-NH2 3.24Å; D7-R10 PolarHBondContact OD1-NH2 2.95Å; E8-R10 VanDerWaalsContact C-N 3.29Å; E8-R10 PolarHBondContact O-N 3.05Å; R10-R14 WeakPolarHBondContact O-CG 3.47Å; R10-R14 PolarHBondContact O-N 2.96Å; R10-R14 VanDerWaalsContact O-N 3.09Å; R10-M89 HydrophobicContact CB-SD 4.45Å; R10-T126 HydrophobicContact CG-CG2 4.2Å
11I86.9Confident78.9Confident96 Ų9674.8 Ų74.849%0.49239%0.385SS..Hα-helixtrans-65.8-45.9176-68164.1000109.9D7 E8 L9 A13 R14 I15D7-I11 VanDerWaalsContact O-CG1 3.29Å; D7-I11 WeakPolarHBondContact O-CG1 3.49Å; D7-I11 PolarHBondContact O-N 3.34Å; E8-I11 PolarHBondContact O-N 3.45Å; L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 2.89Å; I11-A13 VanDerWaalsContact C-N 3.33Å; I11-A13 PolarHBondContact O-N 3.06Å; I11-R14 PolarHBondContact O-N 2.98Å; I11-I15 HydrophobicContact CG2-CD1 3.89Å; I11-I15 WeakPolarHBondContact O-CG1 3.35Å; I11-I15 PolarHBondContact O-N 3.37Å
12Q87.3Confident81.2Confident76 Ų7666.9 Ų66.936%0.35535%0.353SS..Hα-helixtrans-59.9-41.9176.7-69.9-179.91600112.2E8 L9 R14 I15 L16 I85E8-Q12 WeakPolarHBondContact O-CG 3.33Å; E8-Q12 PolarHBondContact O-N 3.37Å; L9-Q12 PolarHBondContact O-N 3.42Å; Q12-R14 PolarHBondContact O-N 2.74Å; Q12-I15 PolarHBondContact O-N 3.46Å; Q12-L16 PolarHBondContact O-N 3.34Å; Q12-I85 HydrophobicContact CB-CD1 4.12Å
13A87.1Confident83.2Confident0 Ų062.4 Ų62.40%033%0.328CS..Hα-helixtrans-59.5-47.2175.100000111.4L9 I11 I15 L16 E17 L82 I85 M89 H130L9-A13 WeakPolarHBondContact O-CB 3.48Å; L9-A13 PolarHBondContact O-N 3.02Å; I11-A13 VanDerWaalsContact C-N 3.33Å; I11-A13 PolarHBondContact O-N 3.06Å; A13-I15 VanDerWaalsContact C-N 3.32Å; A13-I15 PolarHBondContact O-N 3.46Å; A13-L16 PolarHBondContact O-N 3.38Å; A13-E17 VanDerWaalsContact O-CG 3.23Å; A13-E17 WeakPolarHBondContact O-CG 3.01Å; A13-E17 PolarHBondContact O-N 3.11Å; A13-L82 HydrophobicContact CB-CD1 3.94Å; A13-I85 HydrophobicContact CB-CG2 3.94Å; A13-M89 HydrophobicContact CB-CE 3.75Å; A13-M89 HydrophobicContact CB-SD 4.41Å; A13-H130 VanDerWaalsContact CB-CE1 3.45Å; A13-H130 WeakPolarHBondContact CB-CE1 3.3Å
14R87Confident84.9Confident144 Ų14459 Ų5954%0.54331%0.305SS..Hα-helixtrans-61.4-37.5177.5-74.7179.1177.1179.7-1.8113.5R10 I11 Q12 E17 S18R10-R14 WeakPolarHBondContact O-CG 3.47Å; R10-R14 PolarHBondContact O-N 2.96Å; R10-R14 VanDerWaalsContact O-N 3.09Å; I11-R14 PolarHBondContact O-N 2.98Å; Q12-R14 PolarHBondContact O-N 2.74Å; R14-E17 PolarHBondContact O-N 2.98Å; R14-S18 PolarHBondContact O-N 2.84Å; R14-S18 VanDerWaalsContact O-N 3.11Å
15I89.9Confident86Confident91 Ų9158 Ų5847%0.46730%0.301SS..Hα-helixtrans-64.3-49.7176.8-67.9166.2000109.6I11 Q12 A13 E17 S18 E19I11-I15 HydrophobicContact CG2-CD1 3.89Å; I11-I15 WeakPolarHBondContact O-CG1 3.35Å; I11-I15 PolarHBondContact O-N 3.37Å; Q12-I15 PolarHBondContact O-N 3.46Å; A13-I15 VanDerWaalsContact C-N 3.32Å; A13-I15 PolarHBondContact O-N 3.46Å; I15-E17 VanDerWaalsContact C-N 3.32Å; I15-E17 PolarHBondContact O-N 3.48Å; I15-S18 PolarHBondContact O-N 3.04Å; I15-E19 WeakPolarHBondContact O-CG 3.18Å; I15-E19 PolarHBondContact O-N 2.63Å
16L88.3Confident86.3Confident17 Ų1756.7 Ų56.79%0.08930%0.297CS..Hα-helixtrans-61.6-38.9177.2-73.7175.4000112.7Q12 A13 S18 E19 I20 Q78 R81 L82 I85Q12-L16 PolarHBondContact O-N 3.34Å; A13-L16 PolarHBondContact O-N 3.38Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 3.02Å; L16-E19 PolarHBondContact O-N 3.3Å; L16-I20 WeakPolarHBondContact O-CB 3.48Å; L16-I20 WeakPolarHBondContact O-CD1 3.38Å; L16-I20 WeakPolarHBondContact O-CG1 3.44Å; L16-I20 PolarHBondContact O-N 3.3Å; L16-Q78 HydrophobicContact CD2-CG 4.49Å; L16-R81 HydrophobicContact CD1-CB 3.93Å; L16-L82 HydrophobicContact CB-CD1 4.39Å; L16-L82 HydrophobicContact CD1-CB 4.32Å; L16-I85 HydrophobicContact CD1-CD1 3.33Å
17E88.7Confident86.5Confident22 Ų2256 Ų5610%0.10329%0.294CS..Hα-helixtrans-58.5-45.3174.6-71.4174.3166.800111.6A13 R14 I15 E19 I20 D21 L82 H130 I133 Y137A13-E17 VanDerWaalsContact O-CG 3.23Å; A13-E17 WeakPolarHBondContact O-CG 3.01Å; A13-E17 PolarHBondContact O-N 3.11Å; R14-E17 PolarHBondContact O-N 2.98Å; I15-E17 VanDerWaalsContact C-N 3.32Å; I15-E17 PolarHBondContact O-N 3.48Å; E17-E19 VanDerWaalsContact C-N 3.34Å; E17-E19 PolarHBondContact O-N 3.24Å; E17-I20 PolarHBondContact O-N 3.39Å; E17-D21 WeakPolarHBondContact O-CB 3.17Å; E17-D21 PolarHBondContact O-N 3.2Å; E17-L82 HydrophobicContact CG-CD1 4.31Å; E17-L82 HydrophobicContact CG-CD2 4.05Å; E17-H130 IonicContact OE1-CE1 3.66Å; E17-H130 PolarHBondContact OE1-CE1 3.24Å; E17-H130 IonicContact OE1-CG 2.68Å; E17-H130 IonicContact OE1-ND1 3.37Å; E17-H130 PolarHBondContact OE1-ND1 2.93Å; E17-H130 IonicContact OE2-CE1 3.33Å; E17-H130 IonicContact OE2-ND1 2.66Å; E17-I133 HydrophobicContact CG-CG2 4.01Å; E17-I133 WeakPolarHBondContact OE1-CG2 3.49Å; E17-Y137 HydrophobicContact CB-CE2 3.96Å; E17-Y137 HydrophobicContact CG-CE2 3.94Å; E17-Y137 PolarHBondContact O-OH 3.19Å
18S89.3Confident86.6Confident73 Ų7354.9 Ų54.951%0.5129%0.294SS..Hα-helixtrans-65.5-35.8176.9-172.70000112.9R14 I15 L16 S22R14-S18 PolarHBondContact O-N 2.84Å; R14-S18 VanDerWaalsContact O-N 3.11Å; I15-S18 PolarHBondContact O-N 3.04Å; L16-S18 VanDerWaalsContact C-N 3.34Å; L16-S18 PolarHBondContact O-N 3.02Å; S18-S22 PolarHBondContact O-N 3.23Å; S18-S22 VanDerWaalsContact O-N 3.17Å; S18-S22 PolarHBondContact O-OG 2.97Å
19E89.9Confident86.3Confident83 Ų8356.6 Ų56.639%0.38830%0.3SS..Hα-helixtrans-69.4-43.8176.1-70.2-178.6-178.500111.7I15 L16 E17 D21 S22 K23 Q78I15-E19 WeakPolarHBondContact O-CG 3.18Å; I15-E19 PolarHBondContact O-N 2.63Å; L16-E19 PolarHBondContact O-N 3.3Å; E17-E19 VanDerWaalsContact C-N 3.34Å; E17-E19 PolarHBondContact O-N 3.24Å; E19-D21 VanDerWaalsContact C-N 3.33Å; E19-D21 PolarHBondContact O-N 2.67Å; E19-S22 PolarHBondContact O-N 3.47Å; E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.36Å; E19-K23 PolarHBondContact O-N 2.87Å; E19-Q78 PolarHBondContact OE2-NE2 3.43Å
20I89.7Confident85.8Confident0 Ų056.9 Ų56.90%030%0.301CS..Hα-helixtrans-61.6-43.2177.4-69.3162.4000110.1L16 E17 K23 L24 Q78 L79 L82 Y137L16-I20 WeakPolarHBondContact O-CB 3.48Å; L16-I20 WeakPolarHBondContact O-CD1 3.38Å; L16-I20 WeakPolarHBondContact O-CG1 3.44Å; L16-I20 PolarHBondContact O-N 3.3Å; E17-I20 PolarHBondContact O-N 3.39Å; I20-K23 PolarHBondContact O-N 3.07Å; I20-L24 HydrophobicContact CG2-CD1 3.73Å; I20-L24 HydrophobicContact CG2-CG 4.18Å; I20-L24 VanDerWaalsContact O-CB 3.32Å; I20-L24 WeakPolarHBondContact O-CB 3.43Å; I20-L24 VanDerWaalsContact O-CG 3.31Å; I20-L24 WeakPolarHBondContact O-CG 3.49Å; I20-L24 PolarHBondContact O-N 3.44Å; I20-Q78 HydrophobicContact CD1-CB 4.12Å; I20-Q78 HydrophobicContact CG1-CB 3.7Å; I20-L79 HydrophobicContact CD1-CD2 4.18Å; I20-L82 HydrophobicContact CD1-CB 4.34Å; I20-L82 HydrophobicContact CD1-CD2 3.82Å; I20-Y137 HydrophobicContact CG2-CD1 3.81Å; I20-Y137 HydrophobicContact CG2-CD2 4.2Å; I20-Y137 HydrophobicContact CG2-CE1 4.34Å; I20-Y137 HydrophobicContact CG2-CG 3.75Å
21D88.7Confident84.7Confident89 Ų8955.2 Ų55.248%0.47630%0.304SS..Hα-helixtrans-60.1-47.7176.8-170.966.1000111.8E17 E19 K23 L24 A25 Y137E17-D21 WeakPolarHBondContact O-CB 3.17Å; E17-D21 PolarHBondContact O-N 3.2Å; E19-D21 VanDerWaalsContact C-N 3.33Å; E19-D21 PolarHBondContact O-N 2.67Å; D21-K23 VanDerWaalsContact C-N 3.35Å; D21-K23 PolarHBondContact O-N 2.86Å; D21-L24 PolarHBondContact O-N 3.32Å; D21-A25 WeakPolarHBondContact O-CB 3.46Å; D21-A25 PolarHBondContact O-N 2.88Å; D21-Y137 HydrophobicContact CB-CE1 4.28Å
22S88.3Confident83.5Confident73 Ų7355.4 Ų55.451%0.5131%0.31SS..Hα-helixtrans-61.5-42.2177.8-59.70000112S18 E19 A26S18-S22 PolarHBondContact O-N 3.23Å; S18-S22 VanDerWaalsContact O-N 3.17Å; S18-S22 PolarHBondContact O-OG 2.97Å; E19-S22 PolarHBondContact O-N 3.47Å; S22-A26 PolarHBondContact O-N 3.27Å
23K87.2Confident82.1Confident64 Ų6461.3 Ų61.328%0.27833%0.329SS..Hα-helixtrans-72-37.3177.8-72.6-168-167.4-81.50112.5E19 I20 D21 A25 A26 F27 E74 I75 Q78E19-K23 WeakPolarHBondContact O-CB 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.36Å; E19-K23 PolarHBondContact O-N 2.87Å; I20-K23 PolarHBondContact O-N 3.07Å; D21-K23 VanDerWaalsContact C-N 3.35Å; D21-K23 PolarHBondContact O-N 2.86Å; K23-A25 VanDerWaalsContact C-N 3.33Å; K23-A26 PolarHBondContact O-N 3.48Å; K23-F27 WeakPolarHBondContact O-CB 3.49Å; K23-F27 PolarHBondContact O-N 2.91Å; K23-E74 HydrophobicContact CD-CB 4.3Å; K23-E74 IonicContact NZ-OE2 2.73Å; K23-E74 PolarHBondContact NZ-OE2 3.49Å; K23-I75 HydrophobicContact CB-CD1 4.2Å; K23-I75 HydrophobicContact CB-CG1 3.88Å; K23-I75 HydrophobicContact CD-CG1 4.35Å; K23-Q78 VanDerWaalsContact CD-OE1 3.31Å
24L86.3Confident80.3Confident19 Ų1966.7 Ų66.710%0.09936%0.364CS..Hα-helixtrans-63.3-41.4173.5-79.2172.1000111.3I20 D21 A26 F27 G28 I75 Y137 E140 F141I20-L24 HydrophobicContact CG2-CD1 3.73Å; I20-L24 HydrophobicContact CG2-CG 4.18Å; I20-L24 VanDerWaalsContact O-CB 3.32Å; I20-L24 WeakPolarHBondContact O-CB 3.43Å; I20-L24 VanDerWaalsContact O-CG 3.31Å; I20-L24 WeakPolarHBondContact O-CG 3.49Å; I20-L24 PolarHBondContact O-N 3.44Å; D21-L24 PolarHBondContact O-N 3.32Å; L24-A26 VanDerWaalsContact C-N 3.34Å; L24-A26 PolarHBondContact O-N 3.39Å; L24-F27 PolarHBondContact O-N 3Å; L24-G28 PolarHBondContact O-N 3.44Å; L24-I75 HydrophobicContact CD2-CD1 4.21Å; L24-I75 HydrophobicContact CD2-CG2 4.45Å; L24-Y137 HydrophobicContact CD1-CD1 3.66Å; L24-Y137 HydrophobicContact CD1-CE1 4.4Å; L24-Y137 HydrophobicContact CD1-CG 4.47Å; L24-E140 HydrophobicContact CD1-CB 4.38Å; L24-F141 HydrophobicContact CD2-CB 3.84Å; L24-F141 HydrophobicContact CD2-CD2 3.94Å; L24-F141 HydrophobicContact CD2-CG 4.39Å
25A85.6Confident78.6Confident52 Ų5263.4 Ų63.443%0.4336%0.359SS..Hα-helixtrans-63-39.517400000112D21 K23 K29D21-A25 WeakPolarHBondContact O-CB 3.46Å; D21-A25 PolarHBondContact O-N 2.88Å; K23-A25 VanDerWaalsContact C-N 3.33Å; A25-K29 WeakPolarHBondContact O-CD 3.48Å; A25-K29 VanDerWaalsContact O-CG 3.27Å; A25-K29 WeakPolarHBondContact O-CG 3.43Å; A25-K29 PolarHBondContact O-N 3.44Å
26A83.3Confident76.2Confident43 Ų4367.2 Ų67.236%0.35538%0.376SS..Hα-helixtrans-68-43.6173.400000112S22 K23 L24 G28 K29 I30S22-A26 PolarHBondContact O-N 3.27Å; K23-A26 PolarHBondContact O-N 3.48Å; L24-A26 VanDerWaalsContact C-N 3.34Å; L24-A26 PolarHBondContact O-N 3.39Å; A26-G28 PolarHBondContact O-N 3.18Å; A26-K29 WeakPolarHBondContact O-CB 3.48Å; A26-K29 PolarHBondContact O-N 3.19Å; A26-I30 PolarHBondContact O-N 2.98Å
27F82.5Confident74.1Confident0 Ų073.2 Ų73.20%040%0.403CS..Hα-helixtrans-62.1-43.5-179.3-174-106.7000112K23 L24 K29 I30 F68 M71 C72 I75 F141 T144 K145 L148K23-F27 WeakPolarHBondContact O-CB 3.49Å; K23-F27 PolarHBondContact O-N 2.91Å; L24-F27 PolarHBondContact O-N 3Å; F27-K29 VanDerWaalsContact C-N 3.25Å; F27-K29 PolarHBondContact O-N 3.48Å; F27-I30 HydrophobicContact CD2-CD1 3.84Å; F27-I30 HydrophobicContact CE2-CD1 4.48Å; F27-I30 PolarHBondContact O-N 2.91Å; F27-F68 HydrophobicContact CE1-CE2 4.39Å; F27-F68 AromaticContact CE2-CD2 3.68Å; F27-F68 HydrophobicContact CE2-CD2 3.68Å; F27-F68 AromaticContact CE2-CE2 3.84Å; F27-F68 HydrophobicContact CE2-CE2 3.84Å; F27-F68 HydrophobicContact CE2-CG 4.48Å; F27-F68 AromaticContact CZ-CD2 3.76Å; F27-F68 HydrophobicContact CZ-CD2 3.76Å; F27-F68 AromaticContact CZ-CE2 3.39Å; F27-F68 HydrophobicContact CZ-CE2 3.39Å; F27-F68 HydrophobicContact CZ-CZ 4.18Å; F27-M71 HydrophobicContact CD2-CB 3.75Å; F27-M71 HydrophobicContact CE2-CB 4.3Å; F27-C72 WeakPolarHBondContact CE2-SG 3.4Å; F27-C72 WeakPolarHBondContact CZ-SG 3.3Å; F27-I75 HydrophobicContact CB-CD1 3.81Å; F27-I75 HydrophobicContact CD1-CD1 4.45Å; F27-I75 HydrophobicContact CD2-CD1 4.2Å; F27-I75 HydrophobicContact CG-CD1 3.92Å; F27-F141 HydrophobicContact CD1-CD2 4.45Å; F27-F141 HydrophobicContact CD1-CE2 4.41Å; F27-F141 HydrophobicContact CE1-CD2 4.27Å; F27-F141 HydrophobicContact CE1-CE2 4.01Å; F27-F141 HydrophobicContact CZ-CE2 4.06Å; F27-T144 HydrophobicContact CD1-CG2 3.67Å; F27-T144 HydrophobicContact CE1-CG2 4.09Å; F27-K145 HydrophobicContact CE1-CB 4.11Å; F27-K145 HydrophobicContact CZ-CB 4.32Å; F27-K145 HydrophobicContact CZ-CG 4.44Å; F27-L148 HydrophobicContact CD1-CD2 4.39Å; F27-L148 HydrophobicContact CD2-CD2 4.48Å; F27-L148 HydrophobicContact CE1-CD2 4.02Å; F27-L148 HydrophobicContact CE2-CD2 4.12Å; F27-L148 HydrophobicContact CZ-CD2 3.88Å
28G80.3Confident71.8Confident26 Ų2680 Ų8027%0.26843%0.432SS..Hα-helixtrans-60.3-33.8172.800000113L24 A26 I30L24-G28 PolarHBondContact O-N 3.44Å; A26-G28 PolarHBondContact O-N 3.18Å; G28-I30 PolarHBondContact O-N 3.09Å
29K80.4Confident69.4Low139 Ų13984.6 Ų84.660%0.60445%0.445SS*.Hα-helixtrans-69.1-29.8178.6-70.5167.9-173.3179.10113A25 A26 F27 G31 T32 R33A25-K29 WeakPolarHBondContact O-CD 3.48Å; A25-K29 VanDerWaalsContact O-CG 3.27Å; A25-K29 WeakPolarHBondContact O-CG 3.43Å; A25-K29 PolarHBondContact O-N 3.44Å; A26-K29 WeakPolarHBondContact O-CB 3.48Å; A26-K29 PolarHBondContact O-N 3.19Å; F27-K29 VanDerWaalsContact C-N 3.25Å; F27-K29 PolarHBondContact O-N 3.48Å; K29-G31 VanDerWaalsContact C-N 3.3Å; K29-G31 PolarHBondContact O-N 2.74Å; K29-T32 PolarHBondContact O-N 3.3Å; K29-T32 PolarHBondContact O-OG1 3.47Å; K29-R33 WeakPolarHBondContact O-CG 3.35Å; K29-R33 PolarHBondContact O-N 3.27Å
30I70.9Confident67.2Low24 Ų2484.6 Ų84.612%0.12345%0.447CS..Hα-helixtrans-57.7-41.8-173.9-53.4163.5000111.4A26 F27 G28 F64 M71 L148A26-I30 PolarHBondContact O-N 2.98Å; F27-I30 HydrophobicContact CD2-CD1 3.84Å; F27-I30 HydrophobicContact CE2-CD1 4.48Å; F27-I30 PolarHBondContact O-N 2.91Å; G28-I30 PolarHBondContact O-N 3.09Å; I30-F64 HydrophobicContact CG2-CD2 3.67Å; I30-F64 HydrophobicContact CG2-CE2 3.62Å; I30-M71 HydrophobicContact CD1-CB 4.41Å; I30-M71 HydrophobicContact CD1-CE 3.13Å; I30-M71 HydrophobicContact CD1-CG 4.45Å; I30-M71 HydrophobicContact CD1-SD 3.45Å; I30-M71 WeakPolarHBondContact CD1-SD 3.35Å; I30-M71 HydrophobicContact CG1-CE 3.67Å; I30-M71 HydrophobicContact CG1-SD 4.14Å; I30-L148 HydrophobicContact CB-CD2 4.45Å
31G61.7Low64.8Low28 Ų2889.7 Ų89.729%0.28948%0.48SS..THydrogen-bonded Turntrans-104.36.1177.800000116.5K29 R33 L148K29-G31 VanDerWaalsContact C-N 3.3Å; K29-G31 PolarHBondContact O-N 2.74Å; G31-R33 VanDerWaalsContact C-N 3.34Å; G31-L148 VanDerWaalsContact N-CD1 3.34Å
32T60.9Low62.3Low101 Ų10194.7 Ų94.762%0.6249%0.492SS*.THydrogen-bonded Turntrans-92.10.1159.664.40000111.8K29 P34K29-T32 PolarHBondContact O-N 3.3Å; K29-T32 PolarHBondContact O-OG1 3.47Å; T32-P34 WeakPolarHBondContact O-CD 3.43Å
33R57.2Low60.1Low199 Ų199100.7 Ų100.775%0.75151%0.509SS*.  trans-56.1107.7171.4-70.1-175.377.3171.21.4107K29 G31 V35K29-R33 WeakPolarHBondContact O-CG 3.35Å; K29-R33 PolarHBondContact O-N 3.27Å; G31-R33 VanDerWaalsContact C-N 3.34Å; R33-V35 PolarHBondContact O-N 3.32Å; R33-V35 VanDerWaalsContact O-N 3.15Å
34P49.6Very low58.2Low113 Ų113103 Ų10373%0.73453%0.529SS*.  trans-62.7124.9175.9-12.428.4000104.9T32 E36T32-P34 WeakPolarHBondContact O-CD 3.43Å; P34-E36 PolarHBondContact O-N 3.24Å
35V51.1Low56Low75 Ų75110 Ų11046%0.45557%0.566SS.*  trans-63.396.5160.3-169.40000104.2R33 H37R33-V35 PolarHBondContact O-N 3.32Å; R33-V35 VanDerWaalsContact O-N 3.15Å; V35-H37 WeakPolarHBondContact CG1-CE1 3.38Å; V35-H37 VanDerWaalsContact CG1-ND1 3.25Å; V35-H37 WeakPolarHBondContact CG1-ND1 3.37Å; V35-H37 PolarHBondContact O-N 3.33Å; V35-H37 PolarHBondContact O-ND1 2.81Å
36E39.1Very low54Low172 Ų172113.3 Ų113.380%0.80459%0.587SS**  trans-65.677.8175.5-167.8-179.7174.500107P34 K38P34-E36 PolarHBondContact O-N 3.24Å; E36-K38 PolarHBondContact O-N 2.95Å
37H44.6Very low52Low142 Ų142114.5 Ų114.566%0.65760%0.603SS**  trans-69.984166.6-76.385.6000106.2V35 H39V35-H37 WeakPolarHBondContact CG1-CE1 3.38Å; V35-H37 VanDerWaalsContact CG1-ND1 3.25Å; V35-H37 WeakPolarHBondContact CG1-ND1 3.37Å; V35-H37 PolarHBondContact O-N 3.33Å; V35-H37 PolarHBondContact O-ND1 2.81Å; H37-H39 PolarHBondContact O-N 3.44Å
38K40.2Very low50Low165 Ų165122.4 Ų122.472%0.71764%0.643SS**  trans-69.364.6160.9-169179.7179.8179.30108.5E36 I40E36-K38 PolarHBondContact O-N 2.95Å; K38-I40 HydrophobicContact CG-CD1 4.31Å; K38-I40 HydrophobicContact CG-CG1 4.21Å
39H40.4Very low48.6Very low170 Ų170128.5 Ų128.579%0.78767%0.668SS**  trans-101.583.9163.1-136.6-87.7000107.2H37 P41H37-H39 PolarHBondContact O-N 3.44Å; H39-P41 WeakPolarHBondContact O-CD 3.09Å
40I42.5Very low46.6Very low82 Ų82127.4 Ų127.442%0.42168%0.678SS.*  trans-58.7122.1169.1-58.1162.8000106.7K38 R42K38-I40 HydrophobicContact CG-CD1 4.31Å; K38-I40 HydrophobicContact CG-CG1 4.21Å; I40-R42 HydrophobicContact CG2-CB 4.21Å; I40-R42 HydrophobicContact CG2-CG 3.71Å; I40-R42 PolarHBondContact O-N 3.09Å
41P40.4Very low45.5Very low107 Ų107135.2 Ų135.270%0.69571%0.711SS**  trans-76.883.8169.231.8-28.6000107H39 F43H39-P41 WeakPolarHBondContact O-CD 3.09Å; P41-F43 VanDerWaalsContact C-N 3.33Å; P41-F43 HydrophobicContact CB-CD2 4.45Å; P41-F43 HydrophobicContact CB-CE2 4.42Å; P41-F43 PolarHBondContact O-N 3.04Å
42R35.1Very low44.4Very low194 Ų194138.5 Ų138.573%0.73273%0.73SS**  trans-86.281.4173.7-106.2172.5178.5149.40.1109I40 T44I40-R42 HydrophobicContact CG2-CB 4.21Å; I40-R42 HydrophobicContact CG2-CG 3.71Å; I40-R42 PolarHBondContact O-N 3.09Å; R42-T44 PolarHBondContact O-N 3.27Å
43F43.6Very low43.2Very low199 Ų199141.3 Ų141.387%0.87374%0.741SS**  trans-7175.1156.3-71.1-81.3000108.8P41P41-F43 VanDerWaalsContact C-N 3.33Å; P41-F43 HydrophobicContact CB-CD2 4.45Å; P41-F43 HydrophobicContact CB-CE2 4.42Å; P41-F43 PolarHBondContact O-N 3.04Å
44T46.2Very low42.5Very low112 Ų112136.3 Ų136.369%0.68774%0.742SS**  trans-144.5109.716457.10000109R42R42-T44 PolarHBondContact O-N 3.27Å
45N40.3Very low42.5Very low167 Ų167138.4 Ų138.489%0.89375%0.745SS**  trans-55.7149.7172.2-153.913.2000111.1
46S43.9Very low42.3Very low122 Ų122140.5 Ų140.585%0.85376%0.76SS**  trans92.8128.7167.6-157.20000118.3
47G40.5Very low42.5Very low67 Ų67140.8 Ų140.869%0.69176%0.762SS**  trans118.580.7151.100000116.4I49G47-I49 PolarHBondContact O-N 2.93Å
48I41.4Very low42.7Very low167 Ų167140 Ų14086%0.85677%0.767SS**  trans-14.4122.4145.1-58.1167000112.9
49I50.3Low43.2Very low153 Ų153137.4 Ų137.479%0.78577%0.767SS**  trans-171.5113.9139.8-86.6141.1000108.3G47G47-I49 PolarHBondContact O-N 2.93Å
50S38.8Very low43.7Very low116 Ų116131.2 Ų131.281%0.81174%0.743SS**  trans-64.4131.3163.8-54.60000110.4
51K47.3Very low44.3Very low189 Ų189131.1 Ų131.182%0.82274%0.743SS**  trans-164.8100.2152-105.2165.3-168.9-175.30110.1
52S39.4Very low45.3Very low97 Ų97130.6 Ų130.668%0.67874%0.737SS**  trans32.3129.5134.460.90000119.9
53N35.4Very low46.8Very low160 Ų160125.5 Ų125.586%0.85673%0.725SS**  trans67.192.7145.7-6713.1000117.4
54A42.2Very low48.3Very low93 Ų93117.5 Ų117.577%0.76969%0.689SS**  trans170.883.8130.200000107.8P56A54-P56 VanDerWaalsContact O-CD 3.29Å; A54-P56 WeakPolarHBondContact O-CD 3.44Å
55I49Very low49.7Very low157 Ų157115.8 Ų115.881%0.80568%0.676SS**  trans-71.1116.1156.4-56.8171000103.9E57I55-E57 PolarHBondContact O-N 3.34Å
56P47.5Very low51.7Low119 Ų119111.1 Ų111.177%0.77365%0.654SS**  trans-66.2106.2167.3-7.224.2000105.3A54 V58A54-P56 VanDerWaalsContact O-CD 3.29Å; A54-P56 WeakPolarHBondContact O-CD 3.44Å; P56-V58 PolarHBondContact O-N 3.34Å
57E42.6Very low53.4Low179 Ų179109.1 Ų109.184%0.83663%0.633SS**  trans-51.9128.7175-61.4-166.3172.600108.8I55 P59I55-E57 PolarHBondContact O-N 3.34Å; E57-P59 WeakPolarHBondContact O-CD 3.23Å; E57-P59 VanDerWaalsContact O-N 3.12Å
58V50.7Low55.4Low125 Ų125107.3 Ų107.376%0.75861%0.607SS**  trans-45.8117.1174.51770000107.8P56 S60P56-V58 PolarHBondContact O-N 3.34Å; V58-S60 PolarHBondContact O-N 3.47Å
59P49.8Very low57.5Low111 Ų111102.1 Ų102.172%0.72159%0.585SS**  trans-57.2116.9173.9-16.928.3000106.6E57 N61E57-P59 WeakPolarHBondContact O-CD 3.23Å; E57-P59 VanDerWaalsContact O-N 3.12Å; P59-N61 PolarHBondContact O-N 2.83Å
60S51.7Low59.2Low40 Ų4098.2 Ų98.228%0.2857%0.568SS.*  trans-62.5135.9-161.780.70000109.5V58 V62 D63V58-S60 PolarHBondContact O-N 3.47Å; S60-V62 PolarHBondContact O-N 3.14Å; S60-D63 PolarHBondContact O-N 3.41Å; S60-D63 PolarHBondContact OG-N 2.9Å; S60-D63 PolarHBondContact OG-OD1 3.36Å; S60-D63 PolarHBondContact OG-OD2 3.25Å
61N55Low61.3Low80 Ų8094.9 Ų94.943%0.42854%0.54SS..Hα-helixtrans-50.8-29.4175.5-167.6-45.1000111.1P59 D65 R152P59-N61 PolarHBondContact O-N 2.83Å; N61-D65 PolarHBondContact O-N 3.01Å; N61-D65 PolarHBondContact OD1-OD2 3.39Å; N61-R152 VanDerWaalsContact CA-NH2 3.29Å; N61-R152 PolarHBondContact ND2-NH2 2.81Å; N61-R152 PolarHBondContact O-NH2 3.27Å; N61-R152 PolarHBondContact OD1-NH2 3.44Å
62V59.9Low63.2Low96 Ų9686.1 Ų86.158%0.58250%0.503SS*.Hα-helixtrans-67.9-36178.5-137.10000113.8S60 F64 T66S60-V62 PolarHBondContact O-N 3.14Å; V62-F64 VanDerWaalsContact C-N 3.34Å; V62-F64 PolarHBondContact O-N 2.73Å; V62-T66 WeakPolarHBondContact O-CB 3.49Å; V62-T66 VanDerWaalsContact O-CG2 3.26Å; V62-T66 WeakPolarHBondContact O-CG2 3.47Å; V62-T66 PolarHBondContact O-N 3.35Å; V62-T66 PolarHBondContact O-OG1 3.44Å
63D67.8Low65.6Low86 Ų8685.9 Ų85.946%0.4649%0.494SS..Hα-helixtrans-68.7-35.7179.8-66.1-42.6000111.4S60 T66 N67S60-D63 PolarHBondContact O-N 3.41Å; S60-D63 PolarHBondContact OG-N 2.9Å; S60-D63 PolarHBondContact OG-OD1 3.36Å; S60-D63 PolarHBondContact OG-OD2 3.25Å; D63-T66 WeakPolarHBondContact CA-OG1 3.1Å; D63-T66 PolarHBondContact O-OG1 3.1Å; D63-N67 WeakPolarHBondContact O-CB 3.21Å; D63-N67 PolarHBondContact O-N 3.36Å; D63-N67 VanDerWaalsContact O-N 3.09Å; D63-N67 PolarHBondContact O-ND2 3.11Å
64F73.6Confident68.1Low31 Ų3181.5 Ų81.514%0.13647%0.469CS..Hα-helixtrans-67.4-51176.9178.5-89.7000110.8I30 V62 T66 N67 F68 L148 R152I30-F64 HydrophobicContact CG2-CD2 3.67Å; I30-F64 HydrophobicContact CG2-CE2 3.62Å; V62-F64 VanDerWaalsContact C-N 3.34Å; V62-F64 PolarHBondContact O-N 2.73Å; F64-T66 VanDerWaalsContact C-N 3.34Å; F64-T66 PolarHBondContact O-N 3.44Å; F64-N67 PolarHBondContact O-N 3.47Å; F64-F68 HydrophobicContact CD1-CB 4.45Å; F64-F68 HydrophobicContact CE1-CB 4.26Å; F64-F68 HydrophobicContact CE1-CD2 4.47Å; F64-F68 HydrophobicContact CE1-CG 4.41Å; F64-F68 HydrophobicContact CZ-CD2 4.41Å; F64-F68 WeakPolarHBondContact O-CB 3.31Å; F64-F68 PolarHBondContact O-N 3.44Å; F64-L148 HydrophobicContact CE2-CD1 3.82Å; F64-L148 HydrophobicContact CE2-CG 4.44Å; F64-L148 HydrophobicContact CZ-CD1 3.54Å; F64-L148 HydrophobicContact CZ-CD2 4.42Å; F64-L148 HydrophobicContact CZ-CG 3.8Å; F64-R152 HydrophobicContact CD1-CG 4.2Å; F64-R152 HydrophobicContact CE1-CB 4.03Å; F64-R152 HydrophobicContact CE1-CG 3.79Å; F64-R152 HydrophobicContact CZ-CB 4.3Å; F64-R152 HydrophobicContact CZ-CG 4.48Å
65D76.6Confident70.4Confident76 Ų7677.1 Ų77.141%0.40643%0.432SS..Hα-helixtrans-65.3-38.9-174.9-68.6-26.2000111.9N61 S69N61-D65 PolarHBondContact O-N 3.01Å; N61-D65 PolarHBondContact OD1-OD2 3.39Å; D65-S69 WeakPolarHBondContact O-CB 3.45Å; D65-S69 PolarHBondContact O-N 2.91Å
66T81.4Confident72.3Confident70 Ų7073 Ų7343%0.42941%0.41SS..Hα-helixtrans-66.6-51.4175.5520000111.6V62 D63 F64 F68 S69 V70V62-T66 WeakPolarHBondContact O-CB 3.49Å; V62-T66 VanDerWaalsContact O-CG2 3.26Å; V62-T66 WeakPolarHBondContact O-CG2 3.47Å; V62-T66 PolarHBondContact O-N 3.35Å; V62-T66 PolarHBondContact O-OG1 3.44Å; D63-T66 WeakPolarHBondContact CA-OG1 3.1Å; D63-T66 PolarHBondContact O-OG1 3.1Å; F64-T66 VanDerWaalsContact C-N 3.34Å; F64-T66 PolarHBondContact O-N 3.44Å; T66-F68 VanDerWaalsContact C-N 3.32Å; T66-F68 PolarHBondContact O-N 2.88Å; T66-S69 PolarHBondContact O-N 3.11Å; T66-V70 WeakPolarHBondContact O-CB 3.42Å; T66-V70 VanDerWaalsContact O-CG2 3.26Å; T66-V70 WeakPolarHBondContact O-CG2 3.2Å; T66-V70 PolarHBondContact O-N 3.11Å
67N79.8Confident74.4Confident79 Ų7971.5 Ų71.542%0.42239%0.392SS..Hα-helixtrans-62.9-39.1178.3-74.4-50.3000112.2D63 F64 M71D63-N67 WeakPolarHBondContact O-CB 3.21Å; D63-N67 PolarHBondContact O-N 3.36Å; D63-N67 VanDerWaalsContact O-N 3.09Å; D63-N67 PolarHBondContact O-ND2 3.11Å; F64-N67 PolarHBondContact O-N 3.47Å; N67-M71 HydrophobicContact CB-CE 3.87Å; N67-M71 WeakPolarHBondContact O-CB 3.49Å; N67-M71 WeakPolarHBondContact O-CE 3.39Å; N67-M71 WeakPolarHBondContact O-CG 3.34Å; N67-M71 PolarHBondContact O-N 2.97Å
68F84.1Confident76.6Confident30 Ų3063.6 Ų63.613%0.13236%0.355CS..Hα-helixtrans-61.5-47.9175174.8-97.1000111.3F27 F64 T66 C72 K145 L148 I149F27-F68 HydrophobicContact CE1-CE2 4.39Å; F27-F68 AromaticContact CE2-CD2 3.68Å; F27-F68 HydrophobicContact CE2-CD2 3.68Å; F27-F68 AromaticContact CE2-CE2 3.84Å; F27-F68 HydrophobicContact CE2-CE2 3.84Å; F27-F68 HydrophobicContact CE2-CG 4.48Å; F27-F68 AromaticContact CZ-CD2 3.76Å; F27-F68 HydrophobicContact CZ-CD2 3.76Å; F27-F68 AromaticContact CZ-CE2 3.39Å; F27-F68 HydrophobicContact CZ-CE2 3.39Å; F27-F68 HydrophobicContact CZ-CZ 4.18Å; F64-F68 HydrophobicContact CD1-CB 4.45Å; F64-F68 HydrophobicContact CE1-CB 4.26Å; F64-F68 HydrophobicContact CE1-CD2 4.47Å; F64-F68 HydrophobicContact CE1-CG 4.41Å; F64-F68 HydrophobicContact CZ-CD2 4.41Å; F64-F68 WeakPolarHBondContact O-CB 3.31Å; F64-F68 PolarHBondContact O-N 3.44Å; T66-F68 VanDerWaalsContact C-N 3.32Å; T66-F68 PolarHBondContact O-N 2.88Å; F68-C72 WeakPolarHBondContact O-CB 3.08Å; F68-C72 PolarHBondContact O-N 2.98Å; F68-C72 PolarHBondContact O-SG 3.43Å; F68-K145 HydrophobicContact CE2-CG 4.42Å; F68-K145 HydrophobicContact CZ-CG 3.87Å; F68-L148 HydrophobicContact CD2-CD2 3.43Å; F68-L148 VanDerWaalsContact CD2-CD2 3.43Å; F68-L148 HydrophobicContact CD2-CG 3.79Å; F68-L148 HydrophobicContact CE2-CB 4.06Å; F68-L148 HydrophobicContact CE2-CD2 3.53Å; F68-L148 HydrophobicContact CE2-CG 3.64Å; F68-I149 HydrophobicContact CE1-CG1 4.45Å; F68-I149 HydrophobicContact CE2-CG1 4.49Å; F68-I149 HydrophobicContact CZ-CD1 4.09Å; F68-I149 HydrophobicContact CZ-CG1 3.79Å
69S85Confident78.5Confident57 Ų5758.5 Ų58.540%0.39932%0.324SS..Hα-helixtrans-63.5-46.5178.7-176.20000111.6D65 T66 M71 C72 N73D65-S69 WeakPolarHBondContact O-CB 3.45Å; D65-S69 PolarHBondContact O-N 2.91Å; T66-S69 PolarHBondContact O-N 3.11Å; S69-M71 PolarHBondContact O-N 2.98Å; S69-C72 WeakPolarHBondContact O-CB 3.41Å; S69-C72 PolarHBondContact O-N 3.23Å; S69-N73 WeakPolarHBondContact O-CB 3.31Å; S69-N73 PolarHBondContact O-N 3.33Å; S69-N73 PolarHBondContact O-ND2 3.37Å; S69-N73 VanDerWaalsContact O-ND2 3.12Å
70V85.4Confident80.4Confident72 Ų7259.7 Ų59.744%0.43632%0.32SS..Hα-helixtrans-58.1-50.8177.1171.40000110.8T66 C72 N73 E74T66-V70 WeakPolarHBondContact O-CB 3.42Å; T66-V70 VanDerWaalsContact O-CG2 3.26Å; T66-V70 WeakPolarHBondContact O-CG2 3.2Å; T66-V70 PolarHBondContact O-N 3.11Å; V70-C72 PolarHBondContact O-N 3.09Å; V70-N73 PolarHBondContact O-N 2.87Å; V70-E74 WeakPolarHBondContact O-CG 3.32Å; V70-E74 PolarHBondContact O-N 3.43Å
71M84Confident82.1Confident45 Ų4564 Ų6422%0.22233%0.33CS..Hα-helixtrans-69-32179.9-72.3-174.8-10500113.1F27 I30 N67 S69 I75F27-M71 HydrophobicContact CD2-CB 3.75Å; F27-M71 HydrophobicContact CE2-CB 4.3Å; I30-M71 HydrophobicContact CD1-CB 4.41Å; I30-M71 HydrophobicContact CD1-CE 3.13Å; I30-M71 HydrophobicContact CD1-CG 4.45Å; I30-M71 HydrophobicContact CD1-SD 3.45Å; I30-M71 WeakPolarHBondContact CD1-SD 3.35Å; I30-M71 HydrophobicContact CG1-CE 3.67Å; I30-M71 HydrophobicContact CG1-SD 4.14Å; N67-M71 HydrophobicContact CB-CE 3.87Å; N67-M71 WeakPolarHBondContact O-CB 3.49Å; N67-M71 WeakPolarHBondContact O-CE 3.39Å; N67-M71 WeakPolarHBondContact O-CG 3.34Å; N67-M71 PolarHBondContact O-N 2.97Å; S69-M71 PolarHBondContact O-N 2.98Å; M71-I75 WeakPolarHBondContact O-CB 3.48Å; M71-I75 WeakPolarHBondContact O-CD1 3.25Å; M71-I75 VanDerWaalsContact O-CG1 3.26Å; M71-I75 WeakPolarHBondContact O-CG1 3.16Å; M71-I75 PolarHBondContact O-N 3.09Å
72C86.8Confident83.6Confident5 Ų560.2 Ų60.23%0.03431%0.31CS..Hα-helixtrans-60.3-49.4170.5-76.80000111.1F27 F68 S69 V70 E74 I75 E76 F141F27-C72 WeakPolarHBondContact CE2-SG 3.4Å; F27-C72 WeakPolarHBondContact CZ-SG 3.3Å; F68-C72 WeakPolarHBondContact O-CB 3.08Å; F68-C72 PolarHBondContact O-N 2.98Å; F68-C72 PolarHBondContact O-SG 3.43Å; S69-C72 WeakPolarHBondContact O-CB 3.41Å; S69-C72 PolarHBondContact O-N 3.23Å; V70-C72 PolarHBondContact O-N 3.09Å; C72-E74 PolarHBondContact O-N 2.93Å; C72-I75 PolarHBondContact O-N 3.4Å; C72-E76 WeakPolarHBondContact O-CB 3.4Å; C72-E76 VanDerWaalsContact O-CG 3.26Å; C72-E76 WeakPolarHBondContact O-CG 3.36Å; C72-E76 PolarHBondContact O-N 2.85Å; C72-F141 HydrophobicContact CB-CZ 4.13Å
73N88.8Confident85Confident92 Ų9258 Ų5849%0.49230%0.296SS..Hα-helixtrans-63.3-42.3-178.7-68.2-30.8000111.4S69 V70 E76 E77S69-N73 WeakPolarHBondContact O-CB 3.31Å; S69-N73 PolarHBondContact O-N 3.33Å; S69-N73 PolarHBondContact O-ND2 3.37Å; S69-N73 VanDerWaalsContact O-ND2 3.12Å; V70-N73 PolarHBondContact O-N 2.87Å; N73-E76 PolarHBondContact O-N 2.8Å; N73-E77 VanDerWaalsContact O-CB 3.31Å; N73-E77 WeakPolarHBondContact O-CB 3.36Å; N73-E77 PolarHBondContact O-N 2.89Å
74E89.3Confident86Confident69 Ų6958.4 Ų58.432%0.32230%0.295SS..Hα-helixtrans-63.5-43.9177.4-72.7178.7-172.900112.7K23 V70 C72 E77 Q78K23-E74 HydrophobicContact CD-CB 4.3Å; K23-E74 IonicContact NZ-OE2 2.73Å; K23-E74 PolarHBondContact NZ-OE2 3.49Å; V70-E74 WeakPolarHBondContact O-CG 3.32Å; V70-E74 PolarHBondContact O-N 3.43Å; C72-E74 PolarHBondContact O-N 2.93Å; E74-E77 PolarHBondContact O-N 2.94Å; E74-Q78 WeakPolarHBondContact O-CG 3.29Å; E74-Q78 PolarHBondContact O-N 3.17Å
75I89.4Confident86.5Confident1 Ų157.5 Ų57.51%0.00529%0.292CS..Hα-helixtrans-68.1-41.5178.1-65.8165.9000110.2K23 L24 F27 M71 C72 E77 Q78 L79 F141K23-I75 HydrophobicContact CB-CD1 4.2Å; K23-I75 HydrophobicContact CB-CG1 3.88Å; K23-I75 HydrophobicContact CD-CG1 4.35Å; L24-I75 HydrophobicContact CD2-CD1 4.21Å; L24-I75 HydrophobicContact CD2-CG2 4.45Å; F27-I75 HydrophobicContact CB-CD1 3.81Å; F27-I75 HydrophobicContact CD1-CD1 4.45Å; F27-I75 HydrophobicContact CD2-CD1 4.2Å; F27-I75 HydrophobicContact CG-CD1 3.92Å; M71-I75 WeakPolarHBondContact O-CB 3.48Å; M71-I75 WeakPolarHBondContact O-CD1 3.25Å; M71-I75 VanDerWaalsContact O-CG1 3.26Å; M71-I75 WeakPolarHBondContact O-CG1 3.16Å; M71-I75 PolarHBondContact O-N 3.09Å; C72-I75 PolarHBondContact O-N 3.4Å; I75-E77 VanDerWaalsContact C-N 3.34Å; I75-E77 PolarHBondContact O-N 2.76Å; I75-Q78 PolarHBondContact O-N 3.39Å; I75-L79 HydrophobicContact CG2-CD1 3.96Å; I75-L79 HydrophobicContact CG2-CG 4.3Å; I75-L79 WeakPolarHBondContact O-CB 3.41Å; I75-L79 VanDerWaalsContact O-CG 3.23Å; I75-L79 WeakPolarHBondContact O-CG 3.47Å; I75-L79 PolarHBondContact O-N 3.27Å; I75-F141 HydrophobicContact CB-CD2 4.01Å; I75-F141 HydrophobicContact CB-CE2 3.82Å; I75-F141 HydrophobicContact CB-CZ 4.37Å; I75-F141 HydrophobicContact CD1-CD2 3.91Å; I75-F141 HydrophobicContact CD1-CE2 3.84Å; I75-F141 HydrophobicContact CG1-CE2 4.43Å; I75-F141 HydrophobicContact CG2-CB 4.3Å; I75-F141 HydrophobicContact CG2-CD1 4.42Å; I75-F141 HydrophobicContact CG2-CD2 3.45Å; I75-F141 VanDerWaalsContact CG2-CD2 3.45Å; I75-F141 HydrophobicContact CG2-CE2 3.78Å; I75-F141 HydrophobicContact CG2-CG 3.79Å; I75-F141 HydrophobicContact CG2-CZ 4.38Å
76E90.1Very high86.9Confident70 Ų7054.1 Ų54.133%0.32727%0.274SS..Hα-helixtrans-61.7-41.8175.5-73.9177.5-16900111.4C72 N73 L79 Q80 F141 K145C72-E76 WeakPolarHBondContact O-CB 3.4Å; C72-E76 VanDerWaalsContact O-CG 3.26Å; C72-E76 WeakPolarHBondContact O-CG 3.36Å; C72-E76 PolarHBondContact O-N 2.85Å; N73-E76 PolarHBondContact O-N 2.8Å; E76-L79 PolarHBondContact O-N 2.99Å; E76-Q80 WeakPolarHBondContact O-CG 3.36Å; E76-Q80 PolarHBondContact O-N 2.92Å; E76-F141 HydrophobicContact CG-CE1 3.59Å; E76-F141 HydrophobicContact CG-CZ 3.92Å; E76-F141 WeakPolarHBondContact OE1-CE1 3.5Å; E76-K145 IonicContact OE1-NZ 3.85Å; E76-K145 PolarHBondContact OE1-NZ 3.47Å
77E91.4Very high87Confident87 Ų8756.6 Ų56.641%0.40728%0.28SS..Hα-helixtrans-62.7-46.6174.6-174.5-175176.700111.9N73 E74 I75 L79 Q80 R81N73-E77 VanDerWaalsContact O-CB 3.31Å; N73-E77 WeakPolarHBondContact O-CB 3.36Å; N73-E77 PolarHBondContact O-N 2.89Å; E74-E77 PolarHBondContact O-N 2.94Å; I75-E77 VanDerWaalsContact C-N 3.34Å; I75-E77 PolarHBondContact O-N 2.76Å; E77-L79 VanDerWaalsContact C-N 3.34Å; E77-L79 PolarHBondContact O-N 3.44Å; E77-Q80 WeakPolarHBondContact O-CB 3.49Å; E77-Q80 PolarHBondContact O-N 2.75Å; E77-R81 WeakPolarHBondContact O-CG 3.44Å; E77-R81 PolarHBondContact O-N 3.02Å; E77-R81 IonicContact OE1-CZ 2.86Å; E77-R81 VanDerWaalsContact OE1-CZ 3.24Å; E77-R81 IonicContact OE1-NE 3.28Å; E77-R81 PolarHBondContact OE1-NE 3.44Å; E77-R81 IonicContact OE1-NH2 3.82Å; E77-R81 PolarHBondContact OE1-NH2 3.46Å
78Q88.8Confident87.1Confident14 Ų1458.5 Ų58.57%0.06528%0.282CS..Hα-helixtrans-64.3-38.2178.2-75.5-178.6-26.300112.2L16 E19 I20 K23 E74 I75 Q80 R81 L82L16-Q78 HydrophobicContact CD2-CG 4.49Å; E19-Q78 PolarHBondContact OE2-NE2 3.43Å; I20-Q78 HydrophobicContact CD1-CB 4.12Å; I20-Q78 HydrophobicContact CG1-CB 3.7Å; K23-Q78 VanDerWaalsContact CD-OE1 3.31Å; E74-Q78 WeakPolarHBondContact O-CG 3.29Å; E74-Q78 PolarHBondContact O-N 3.17Å; I75-Q78 PolarHBondContact O-N 3.39Å; Q78-Q80 VanDerWaalsContact C-N 3.33Å; Q78-Q80 PolarHBondContact O-N 2.98Å; Q78-R81 PolarHBondContact O-N 3.06Å; Q78-L82 WeakPolarHBondContact O-CB 3.29Å; Q78-L82 PolarHBondContact O-N 3.28Å
79L89.1Confident86.6Confident18 Ų1857 Ų579%0.09428%0.275CS..Hα-helixtrans-63.2-39.2173.6-73.1170.7000111.6I20 I75 E76 E77 T83 L134 F141I20-L79 HydrophobicContact CD1-CD2 4.18Å; I75-L79 HydrophobicContact CG2-CD1 3.96Å; I75-L79 HydrophobicContact CG2-CG 4.3Å; I75-L79 WeakPolarHBondContact O-CB 3.41Å; I75-L79 VanDerWaalsContact O-CG 3.23Å; I75-L79 WeakPolarHBondContact O-CG 3.47Å; I75-L79 PolarHBondContact O-N 3.27Å; E76-L79 PolarHBondContact O-N 2.99Å; E77-L79 VanDerWaalsContact C-N 3.34Å; E77-L79 PolarHBondContact O-N 3.44Å; L79-T83 WeakPolarHBondContact O-CB 3.25Å; L79-T83 PolarHBondContact O-N 3.44Å; L79-T83 PolarHBondContact O-OG1 2.99Å; L79-L134 HydrophobicContact CD2-CD1 3.8Å; L79-F141 HydrophobicContact CD1-CB 4.4Å; L79-F141 HydrophobicContact CD1-CD1 4.28Å; L79-F141 HydrophobicContact CD1-CG 4.46Å
80Q90.2Very high86.1Confident136 Ų13655.4 Ų55.464%0.63627%0.265SS*.Hα-helixtrans-65-44.2174.1-73.11751.400111.8E76 E77 Q78 T83 Q84E76-Q80 WeakPolarHBondContact O-CG 3.36Å; E76-Q80 PolarHBondContact O-N 2.92Å; E77-Q80 WeakPolarHBondContact O-CB 3.49Å; E77-Q80 PolarHBondContact O-N 2.75Å; Q78-Q80 VanDerWaalsContact C-N 3.33Å; Q78-Q80 PolarHBondContact O-N 2.98Å; Q80-T83 WeakPolarHBondContact O-CB 3.3Å; Q80-T83 PolarHBondContact O-N 2.88Å; Q80-Q84 PolarHBondContact O-N 3.17Å
81R88.1Confident85.4Confident131 Ų13157 Ų5749%0.49428%0.275SS..Hα-helixtrans-61.5-44.4176.1-70.4-179.9-176.4-166.91.2111.7L16 E77 Q78 T83 Q84 I85L16-R81 HydrophobicContact CD1-CB 3.93Å; E77-R81 WeakPolarHBondContact O-CG 3.44Å; E77-R81 PolarHBondContact O-N 3.02Å; E77-R81 IonicContact OE1-CZ 2.86Å; E77-R81 VanDerWaalsContact OE1-CZ 3.24Å; E77-R81 IonicContact OE1-NE 3.28Å; E77-R81 PolarHBondContact OE1-NE 3.44Å; E77-R81 IonicContact OE1-NH2 3.82Å; E77-R81 PolarHBondContact OE1-NH2 3.46Å; Q78-R81 PolarHBondContact O-N 3.06Å; R81-T83 VanDerWaalsContact C-N 3.31Å; R81-T83 PolarHBondContact O-N 3.3Å; R81-Q84 PolarHBondContact O-N 3.37Å; R81-I85 WeakPolarHBondContact O-CG1 3.4Å; R81-I85 PolarHBondContact O-N 3.03Å
82L87.1Confident84.6Confident0 Ų058.9 Ų58.90%028%0.282CS..Hα-helixtrans-64-37175.8-176.261.1000111.4A13 L16 E17 I20 Q78 I85 N86 L134A13-L82 HydrophobicContact CB-CD1 3.94Å; L16-L82 HydrophobicContact CB-CD1 4.39Å; L16-L82 HydrophobicContact CD1-CB 4.32Å; E17-L82 HydrophobicContact CG-CD1 4.31Å; E17-L82 HydrophobicContact CG-CD2 4.05Å; I20-L82 HydrophobicContact CD1-CB 4.34Å; I20-L82 HydrophobicContact CD1-CD2 3.82Å; Q78-L82 WeakPolarHBondContact O-CB 3.29Å; Q78-L82 PolarHBondContact O-N 3.28Å; L82-I85 PolarHBondContact O-N 2.83Å; L82-N86 WeakPolarHBondContact O-CB 3.38Å; L82-N86 PolarHBondContact O-N 3.47Å; L82-N86 PolarHBondContact O-ND2 3.49Å; L82-N86 PolarHBondContact O-OD1 2.82Å; L82-L134 HydrophobicContact CB-CD1 4.19Å; L82-L134 HydrophobicContact CD2-CB 4.31Å; L82-L134 HydrophobicContact CD2-CD1 3.87Å; L82-L134 HydrophobicContact CG-CD1 4.07Å
83T88.8Confident83.4Confident50 Ų5059.7 Ų59.731%0.30729%0.287SS..Hα-helixtrans-59.8-49.1173-56.20000111.1L79 Q80 R81 I85 N86 E87 L134L79-T83 WeakPolarHBondContact O-CB 3.25Å; L79-T83 PolarHBondContact O-N 3.44Å; L79-T83 PolarHBondContact O-OG1 2.99Å; Q80-T83 WeakPolarHBondContact O-CB 3.3Å; Q80-T83 PolarHBondContact O-N 2.88Å; R81-T83 VanDerWaalsContact C-N 3.31Å; R81-T83 PolarHBondContact O-N 3.3Å; T83-I85 VanDerWaalsContact C-N 3.34Å; T83-I85 PolarHBondContact O-N 3.43Å; T83-N86 WeakPolarHBondContact O-CB 3.23Å; T83-N86 PolarHBondContact O-N 3.26Å; T83-E87 WeakPolarHBondContact O-CG 3.49Å; T83-E87 PolarHBondContact O-N 3.29Å; T83-L134 HydrophobicContact CG2-CD2 4.36Å; T83-L134 WeakPolarHBondContact OG1-CD2 3.44Å
84Q87.8Confident82Confident94 Ų9459.6 Ų59.644%0.43929%0.291SS..Hα-helixtrans-60.3-42.3177.4-178.1-178.491.600111.9Q80 R81 N86 E87 R88Q80-Q84 PolarHBondContact O-N 3.17Å; R81-Q84 PolarHBondContact O-N 3.37Å; Q84-N86 VanDerWaalsContact C-N 3.35Å; Q84-E87 PolarHBondContact O-N 2.93Å; Q84-R88 WeakPolarHBondContact O-CG 3.44Å; Q84-R88 PolarHBondContact O-N 2.91Å; Q84-R88 VanDerWaalsContact OE1-CZ 3.24Å; Q84-R88 VanDerWaalsContact OE1-NH1 3.14Å
85I84.8Confident80.2Confident11 Ų1163.9 Ų63.96%0.05631%0.311CS..Hα-helixtrans-66.7-39177.7-69.4159.7000110.7L9 Q12 A13 L16 R81 L82 T83 R88 M89L9-I85 HydrophobicContact CB-CG2 4.3Å; L9-I85 WeakPolarHBondContact O-CG2 3.33Å; Q12-I85 HydrophobicContact CB-CD1 4.12Å; A13-I85 HydrophobicContact CB-CG2 3.94Å; L16-I85 HydrophobicContact CD1-CD1 3.33Å; R81-I85 WeakPolarHBondContact O-CG1 3.4Å; R81-I85 PolarHBondContact O-N 3.03Å; L82-I85 PolarHBondContact O-N 2.83Å; T83-I85 VanDerWaalsContact C-N 3.34Å; T83-I85 PolarHBondContact O-N 3.43Å; I85-R88 PolarHBondContact O-N 2.9Å; I85-M89 HydrophobicContact CG2-CE 4Å; I85-M89 HydrophobicContact CG2-CG 4.45Å; I85-M89 WeakPolarHBondContact O-CB 3.26Å; I85-M89 WeakPolarHBondContact O-CG 3.48Å; I85-M89 PolarHBondContact O-N 2.8Å
86N84.9Confident78.3Confident5 Ų570.3 Ų70.33%0.02735%0.351CS..Hα-helixtrans-64.4-39.8175-73.4-9.8000112.7L82 T83 Q84 M89 A90 H130L82-N86 WeakPolarHBondContact O-CB 3.38Å; L82-N86 PolarHBondContact O-N 3.47Å; L82-N86 PolarHBondContact O-ND2 3.49Å; L82-N86 PolarHBondContact O-OD1 2.82Å; T83-N86 WeakPolarHBondContact O-CB 3.23Å; T83-N86 PolarHBondContact O-N 3.26Å; Q84-N86 VanDerWaalsContact C-N 3.35Å; N86-M89 HydrophobicContact CB-CE 4.47Å; N86-M89 PolarHBondContact O-N 2.98Å; N86-M89 WeakPolarHBondContact OD1-CE 3.33Å; N86-A90 WeakPolarHBondContact O-CB 3.3Å; N86-A90 PolarHBondContact O-N 2.84Å; N86-H130 PolarHBondContact ND2-O 3.33Å; N86-H130 VanDerWaalsContact ND2-O 3.08Å; N86-H130 VanDerWaalsContact OD1-CB 3.25Å; N86-H130 WeakPolarHBondContact OD1-CB 3.27Å
87E83.5Confident76Confident122 Ų12274.9 Ų74.957%0.5737%0.372SS*.Hα-helixtrans-62.8-47.6172.5-73.1176.7172.300110.9T83 Q84 M89 A90 T91T83-E87 WeakPolarHBondContact O-CG 3.49Å; T83-E87 PolarHBondContact O-N 3.29Å; Q84-E87 PolarHBondContact O-N 2.93Å; E87-M89 PolarHBondContact O-N 3.44Å; E87-A90 CarbonylContact O-C 3.58Å; E87-A90 WeakPolarHBondContact O-CA 3.39Å; E87-A90 WeakPolarHBondContact O-CB 3.32Å; E87-A90 PolarHBondContact O-N 3.21Å; E87-T91 WeakPolarHBondContact O-CG2 3.5Å; E87-T91 PolarHBondContact O-N 3.44Å
88R81.2Confident73.9Confident119 Ų11974.7 Ų74.745%0.44939%0.385SS..Hα-helixtrans-62.5-41.2176.3-68.4178.6176.7149.65.2111.9L9 Q84 I85 A90 T91 F92L9-R88 HydrophobicContact CD2-CB 3.34Å; Q84-R88 WeakPolarHBondContact O-CG 3.44Å; Q84-R88 PolarHBondContact O-N 2.91Å; Q84-R88 VanDerWaalsContact OE1-CZ 3.24Å; Q84-R88 VanDerWaalsContact OE1-NH1 3.14Å; I85-R88 PolarHBondContact O-N 2.9Å; R88-A90 PolarHBondContact O-N 3.25Å; R88-T91 PolarHBondContact O-N 3.37Å; R88-T91 VanDerWaalsContact O-N 3.09Å; R88-T91 PolarHBondContact O-OG1 3.47Å; R88-F92 WeakPolarHBondContact O-CD2 3.41Å; R88-F92 PolarHBondContact O-N 3.41Å
89M73.6Confident71.4Confident0 Ų079 Ų790%041%0.413CS..Hα-helixtrans-59.2-37.6173.1-77.5-169.5-68.100111.8L9 R10 A13 I85 N86 E87 F92 V93 A127 H130L9-M89 HydrophobicContact CB-CG 3.63Å; L9-M89 HydrophobicContact CB-SD 4.32Å; L9-M89 HydrophobicContact CD2-CG 3.79Å; L9-M89 HydrophobicContact CG-CG 4.38Å; R10-M89 HydrophobicContact CB-SD 4.45Å; A13-M89 HydrophobicContact CB-CE 3.75Å; A13-M89 HydrophobicContact CB-SD 4.41Å; I85-M89 HydrophobicContact CG2-CE 4Å; I85-M89 HydrophobicContact CG2-CG 4.45Å; I85-M89 WeakPolarHBondContact O-CB 3.26Å; I85-M89 WeakPolarHBondContact O-CG 3.48Å; I85-M89 PolarHBondContact O-N 2.8Å; N86-M89 HydrophobicContact CB-CE 4.47Å; N86-M89 PolarHBondContact O-N 2.98Å; N86-M89 WeakPolarHBondContact OD1-CE 3.33Å; E87-M89 PolarHBondContact O-N 3.44Å; M89-F92 PolarHBondContact O-N 3.49Å; M89-V93 WeakPolarHBondContact O-CG2 3.26Å; M89-A127 HydrophobicContact CB-CB 4.5Å; M89-H130 HydrophobicContact CE-CB 3.87Å
90A74.4Confident69.1Low22 Ų2284.5 Ų84.518%0.18245%0.449CS..Hα-helixtrans-69.5-33.4175.300000112.7N86 E87 R88 F92 V93N86-A90 WeakPolarHBondContact O-CB 3.3Å; N86-A90 PolarHBondContact O-N 2.84Å; E87-A90 CarbonylContact O-C 3.58Å; E87-A90 WeakPolarHBondContact O-CA 3.39Å; E87-A90 WeakPolarHBondContact O-CB 3.32Å; E87-A90 PolarHBondContact O-N 3.21Å; R88-A90 PolarHBondContact O-N 3.25Å; A90-F92 VanDerWaalsContact C-N 3.3Å; A90-F92 PolarHBondContact O-N 2.94Å; A90-V93 CarbonylContact O-C 3.56Å; A90-V93 WeakPolarHBondContact O-CA 3.46Å; A90-V93 WeakPolarHBondContact O-CB 3.39Å; A90-V93 PolarHBondContact O-N 2.73Å; A90-V93 VanDerWaalsContact O-O 3.08Å
91T72.3Confident66.7Low105 Ų10583.6 Ų83.664%0.64445%0.453SS*.Hα-helixtrans-65.2-32.2176.263.30000113.1E87 R88 V93E87-T91 WeakPolarHBondContact O-CG2 3.5Å; E87-T91 PolarHBondContact O-N 3.44Å; R88-T91 PolarHBondContact O-N 3.37Å; R88-T91 VanDerWaalsContact O-N 3.09Å; R88-T91 PolarHBondContact O-OG1 3.47Å; T91-V93 PolarHBondContact O-N 3.28Å
92F65.5Low64.5Low85 Ų8582.2 Ų82.237%0.37346%0.464SS..THydrogen-bonded Turntrans-74.5-5.9173.8-69.2-67000113.6T5 L9 R88 M89 A90 P94T5-F92 VanDerWaalsContact OG1-CE1 3.26Å; T5-F92 WeakPolarHBondContact OG1-CE1 3.49Å; T5-F92 WeakPolarHBondContact OG1-CZ 3.06Å; L9-F92 HydrophobicContact CD1-CE2 3.9Å; L9-F92 HydrophobicContact CD2-CD2 4.1Å; L9-F92 HydrophobicContact CD2-CE2 3.87Å; R88-F92 WeakPolarHBondContact O-CD2 3.41Å; R88-F92 PolarHBondContact O-N 3.41Å; M89-F92 PolarHBondContact O-N 3.49Å; A90-F92 VanDerWaalsContact C-N 3.3Å; A90-F92 PolarHBondContact O-N 2.94Å; F92-P94 VanDerWaalsContact C-CD 3.42Å; F92-P94 WeakPolarHBondContact O-CD 3.33Å
93V62.2Low62.5Low23 Ų2391.1 Ų91.114%0.13950%0.503CS..SBendtrans-103.386.9173.7177.30000107.2M89 A90 T91 E95 Q123 L124M89-V93 WeakPolarHBondContact O-CG2 3.26Å; A90-V93 CarbonylContact O-C 3.56Å; A90-V93 WeakPolarHBondContact O-CA 3.46Å; A90-V93 WeakPolarHBondContact O-CB 3.39Å; A90-V93 PolarHBondContact O-N 2.73Å; A90-V93 VanDerWaalsContact O-O 3.08Å; T91-V93 PolarHBondContact O-N 3.28Å; V93-E95 PolarHBondContact O-N 3.02Å; V93-Q123 HydrophobicContact CG2-CB 4.26Å; V93-L124 HydrophobicContact CG1-CD1 4.32Å; V93-L124 HydrophobicContact CG1-CD2 3.21Å; V93-L124 HydrophobicContact CG1-CG 3.39Å
94P58.7Low60.2Low89 Ų8995.9 Ų95.958%0.57853%0.526SS*.  trans-61.4115.917717.9-25.3000109.3F92 T96F92-P94 VanDerWaalsContact C-CD 3.42Å; F92-P94 WeakPolarHBondContact O-CD 3.33Å; P94-T96 VanDerWaalsContact C-N 3.33Å; P94-T96 PolarHBondContact O-N 2.99Å
95E52.6Low58Low160 Ų16096.7 Ų96.775%0.74854%0.543SS*.  trans-61.694.2167.9-166.1146.9-149.800107.2V93 E97V93-E95 PolarHBondContact O-N 3.02Å; E95-E97 HydrophobicContact CG-CB 4.16Å; E95-E97 HydrophobicContact CG-CG 3.96Å; E95-E97 PolarHBondContact O-N 3.41Å
96T49Very low56Low135 Ų135100.6 Ų100.683%0.82858%0.576SS**  trans-7165.9165.728.70000109P94P94-T96 VanDerWaalsContact C-N 3.33Å; P94-T96 PolarHBondContact O-N 2.99Å
97E43.2Very low53.9Low166 Ų166104.2 Ų104.278%0.77661%0.607SS**  trans-109.571.4159-68.7-159.1161.900108E95E95-E97 HydrophobicContact CG-CB 4.16Å; E95-E97 HydrophobicContact CG-CG 3.96Å; E95-E97 PolarHBondContact O-N 3.41Å
98A45.6Very low51.9Low83 Ų83109.9 Ų109.969%0.68662%0.623SS**  trans-145.291.8158.700000108.2
99T37.2Very low50.2Low106 Ų106111.4 Ų111.465%0.6564%0.64SS**  trans63.5111.1134.2-43.20000118.4T101T99-T101 HydrophobicContact CG2-CG2 4.08Å; T99-T101 WeakPolarHBondContact CG2-OG1 3.38Å
100P41.3Very low48.8Very low132 Ų132117 Ų11786%0.85768%0.677SS**  trans-11870.5133.134.3-26.8000109.1S102P100-S102 VanDerWaalsContact C-N 3.27Å; P100-S102 PolarHBondContact O-N 3.07Å
101T39.8Very low47.2Very low117 Ų117123.7 Ų123.772%0.71871%0.709SS**  trans-82.478.2158.856.90000108.1T99T99-T101 HydrophobicContact CG2-CG2 4.08Å; T99-T101 WeakPolarHBondContact CG2-OG1 3.38Å
102S42.2Very low46.1Very low102 Ų102125.5 Ų125.571%0.71372%0.715SS**  trans-177.7111.8149.625.60000108.5P100 D104P100-S102 VanDerWaalsContact C-N 3.27Å; P100-S102 PolarHBondContact O-N 3.07Å; S102-D104 PolarHBondContact O-N 2.95Å; S102-D104 VanDerWaalsContact O-N 3.1Å
103F43.3Very low45.4Very low188 Ų188125.6 Ų125.683%0.82572%0.723SS**  trans-32.6104140.1175.6-93.2000110
104D41.8Very low44.9Very low149 Ų149128.8 Ų128.880%0.79774%0.743SS**  trans-156.2124.7144.4-103.8-22.7000111.5S102S102-D104 PolarHBondContact O-N 2.95Å; S102-D104 VanDerWaalsContact O-N 3.1Å
105S41.5Very low44.4Very low112 Ų112131.7 Ų131.778%0.78375%0.754SS**  trans-96.189.4-173.8-57.80000108.4
106A42.9Very low44.2Very low92 Ų92129.6 Ų129.676%0.7675%0.746SS**  trans-163.9112.416700000111.8
107A40.9Very low44.6Very low82 Ų82126 Ų12668%0.67873%0.729SS**  trans50.6106.213900000118.2
108R40.8Very low45.3Very low240 Ų240121.3 Ų121.391%0.90672%0.719SS**  151.6116.8119.4-78.7152.4178.7179.3-0.9111.5
109N45.1Very low46.3Very low151 Ų151119.2 Ų119.281%0.80771%0.706SS**  trans57112.5159.7-76.9-2.9000120.8
110P44.9Very low47.7Very low117 Ų117120.2 Ų120.276%0.7670%0.697SS**  trans-130.470.5155.738.2-21.3000111.4
111L41.4Very low49Very low163 Ų163119.6 Ų119.685%0.85369%0.686SS**  trans-107.8106.5164.2-62.8165.3000105.7
112N48.7Very low50.6Low144 Ų144117 Ų11777%0.7767%0.673SS**SBendtrans129.345.4165.7-160.433000120.5
113P49.9Very low52.3Low86 Ų86114.6 Ų114.656%0.55865%0.651SS**  trans-114.8-0.7169.736.7-29.5000118.1
114T51.6Low53.9Low91 Ų91110 Ų11056%0.55863%0.634SS**Hα-helixtrans-80-35.9-164.940.90000116.1M116T114-M116 PolarHBondContact O-N 2.71Å
115N48.5Very low55.6Low149 Ų149108.8 Ų108.880%0.79762%0.623SS**Hα-helixtrans-79.8-19.6-175.3-68.4-1.4000113.8
116M48.3Very low57.6Low117 Ų117104.4 Ų104.458%0.57659%0.592SS**Hα-helixtrans-79.2-23.8177.1-129.7-177.3-72.700112.4T114 R120T114-M116 PolarHBondContact O-N 2.71Å; M116-R120 WeakPolarHBondContact O-CB 2.99Å; M116-R120 WeakPolarHBondContact O-CD 3.21Å; M116-R120 WeakPolarHBondContact O-CG 3.41Å; M116-R120 PolarHBondContact O-N 3.35Å; M116-R120 PolarHBondContact SD-NH2 3.17Å
117A56.9Low59.4Low58 Ų58100.4 Ų100.448%0.47956%0.559SS.*Hα-helixtrans-73.8-38.8-176.400000113.2R120 L121A117-R120 PolarHBondContact O-N 3.36Å; A117-L121 WeakPolarHBondContact O-CB 3.22Å; A117-L121 PolarHBondContact O-N 3.5Å
118A59Low61.4Low69 Ų69102.4 Ų102.457%0.5755%0.552SS**Hα-helixtrans-67.5-43.4-178.800000112.6L121 S122A118-L121 PolarHBondContact O-N 3.36Å; A118-S122 PolarHBondContact O-N 3.26Å
119G66.6Low63.5Low39 Ų3998.1 Ų98.140%0.40254%0.536SS..Hα-helixtrans-60.2-47.4173.900000111.7L121 S122 Q123G119-L121 PolarHBondContact O-N 3.1Å; G119-S122 WeakPolarHBondContact O-CB 3.39Å; G119-S122 PolarHBondContact O-N 3.25Å; G119-Q123 VanDerWaalsContact O-CG 3.31Å; G119-Q123 WeakPolarHBondContact O-CG 3.42Å; G119-Q123 PolarHBondContact O-N 3.37Å
120R65.7Low65.4Low126 Ų12691.3 Ų91.348%0.47550%0.499SS..Hα-helixtrans-63.8-38.9178.3-71.3176.7-175.3-157.52.7113.3M116 A117 Q123 L124M116-R120 WeakPolarHBondContact O-CB 2.99Å; M116-R120 WeakPolarHBondContact O-CD 3.21Å; M116-R120 WeakPolarHBondContact O-CG 3.41Å; M116-R120 PolarHBondContact O-N 3.35Å; M116-R120 PolarHBondContact SD-NH2 3.17Å; A117-R120 PolarHBondContact O-N 3.36Å; R120-Q123 PolarHBondContact O-N 2.97Å; R120-L124 PolarHBondContact O-N 3.4Å
121L69Low67.3Low119 Ų11992.5 Ų92.562%0.62349%0.488SS*.Hα-helixtrans-65.9-38.8176-174.464000112A117 A118 G119 Q123 L124 H125A117-L121 WeakPolarHBondContact O-CB 3.22Å; A117-L121 PolarHBondContact O-N 3.5Å; A118-L121 PolarHBondContact O-N 3.36Å; G119-L121 PolarHBondContact O-N 3.1Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; L121-L124 WeakPolarHBondContact O-CB 3.4Å; L121-L124 PolarHBondContact O-N 2.93Å; L121-H125 WeakPolarHBondContact O-CB 3.49Å; L121-H125 PolarHBondContact O-N 3.46Å
122S73.6Confident69.4Low64 Ų6489.3 Ų89.345%0.44847%0.469SS..Hα-helixtrans-63.6-38.6173.3-175.70000112A118 G119 H125 T126A118-S122 PolarHBondContact O-N 3.26Å; G119-S122 WeakPolarHBondContact O-CB 3.39Å; G119-S122 PolarHBondContact O-N 3.25Å; S122-H125 PolarHBondContact O-N 2.8Å; S122-T126 WeakPolarHBondContact O-CB 3.17Å; S122-T126 PolarHBondContact O-N 2.9Å; S122-T126 PolarHBondContact O-OG1 2.99Å
123Q78.3Confident71.3Confident51 Ų5184 Ų8424%0.23844%0.441CS..Hα-helixtrans-64.8-45.9175.8-66.7175.6-0.800112.2W6 V93 G119 R120 L121 T126 A127W6-Q123 HydrophobicContact CD2-CB 4.3Å; W6-Q123 HydrophobicContact CD2-CG 3.63Å; W6-Q123 VanDerWaalsContact CE2-CG 3.48Å; W6-Q123 HydrophobicContact CE3-CG 3.93Å; W6-Q123 HydrophobicContact CG-CG 4.19Å; W6-Q123 HydrophobicContact CH2-CB 4.33Å; W6-Q123 HydrophobicContact CH2-CG 3.93Å; W6-Q123 HydrophobicContact CZ2-CB 3.71Å; W6-Q123 HydrophobicContact CZ2-CG 3.69Å; W6-Q123 HydrophobicContact CZ3-CG 4.04Å; V93-Q123 HydrophobicContact CG2-CB 4.26Å; G119-Q123 VanDerWaalsContact O-CG 3.31Å; G119-Q123 WeakPolarHBondContact O-CG 3.42Å; G119-Q123 PolarHBondContact O-N 3.37Å; R120-Q123 PolarHBondContact O-N 2.97Å; L121-Q123 VanDerWaalsContact C-N 3.33Å; Q123-T126 PolarHBondContact O-N 2.86Å; Q123-A127 WeakPolarHBondContact O-CB 3.45Å; Q123-A127 PolarHBondContact O-N 3.16Å
124L75.9Confident73Confident90 Ų9081.1 Ų81.147%0.47142%0.42SS..Hα-helixtrans-54.8-51.2172.7-89.6161.8000112.2V93 R120 L121 T126 A127 K128V93-L124 HydrophobicContact CG1-CD1 4.32Å; V93-L124 HydrophobicContact CG1-CD2 3.21Å; V93-L124 HydrophobicContact CG1-CG 3.39Å; R120-L124 PolarHBondContact O-N 3.4Å; L121-L124 WeakPolarHBondContact O-CB 3.4Å; L121-L124 PolarHBondContact O-N 2.93Å; L124-T126 VanDerWaalsContact C-N 3.32Å; L124-T126 PolarHBondContact O-N 3.15Å; L124-A127 PolarHBondContact O-N 3.22Å; L124-K128 WeakPolarHBondContact O-CB 3.18Å; L124-K128 PolarHBondContact O-N 2.7Å
125H77.6Confident74.7Confident125 Ų12584.5 Ų84.558%0.57942%0.423SS*.Hα-helixtrans-62.2-41.4-179.7-177.3-89.9000111.6L121 S122 K128 R129L121-H125 WeakPolarHBondContact O-CB 3.49Å; L121-H125 PolarHBondContact O-N 3.46Å; S122-H125 PolarHBondContact O-N 2.8Å; H125-K128 PolarHBondContact O-N 2.97Å; H125-R129 WeakPolarHBondContact O-CB 3.27Å; H125-R129 PolarHBondContact O-N 2.99Å
126T84.8Confident76.6Confident20 Ų2081.8 Ų81.812%0.12341%0.408CS..Hα-helixtrans-66.9-45.2178.7-58.80000111.6W6 R10 S122 Q123 L124 K128 R129 H130W6-T126 HydrophobicContact CH2-CG2 3.79Å; W6-T126 HydrophobicContact CZ2-CG2 3.78Å; R10-T126 HydrophobicContact CG-CG2 4.2Å; S122-T126 WeakPolarHBondContact O-CB 3.17Å; S122-T126 PolarHBondContact O-N 2.9Å; S122-T126 PolarHBondContact O-OG1 2.99Å; Q123-T126 PolarHBondContact O-N 2.86Å; L124-T126 VanDerWaalsContact C-N 3.32Å; L124-T126 PolarHBondContact O-N 3.15Å; T126-K128 VanDerWaalsContact C-N 3.31Å; T126-K128 PolarHBondContact O-N 3.26Å; T126-R129 PolarHBondContact O-N 3.27Å; T126-H130 PolarHBondContact O-CD2 2.79Å; T126-H130 PolarHBondContact O-N 2.97Å
127A80.2Confident78.6Confident7 Ų778.3 Ų78.36%0.05839%0.389CS..Hα-helixtrans-61.7-39.7175.500000111.9M89 Q123 L124 H130 R131M89-A127 HydrophobicContact CB-CB 4.5Å; Q123-A127 WeakPolarHBondContact O-CB 3.45Å; Q123-A127 PolarHBondContact O-N 3.16Å; L124-A127 PolarHBondContact O-N 3.22Å; A127-H130 PolarHBondContact O-N 3.44Å; A127-R131 PolarHBondContact O-N 2.82Å
128K82.4Confident80.1Confident124 Ų12476.5 Ų76.554%0.53937%0.374SS..Hα-helixtrans-61.9-47173.4-174.1-173.6175.6-162.40111.6L124 H125 T126 H130 R131 E132L124-K128 WeakPolarHBondContact O-CB 3.18Å; L124-K128 PolarHBondContact O-N 2.7Å; H125-K128 PolarHBondContact O-N 2.97Å; T126-K128 VanDerWaalsContact C-N 3.31Å; T126-K128 PolarHBondContact O-N 3.26Å; K128-H130 VanDerWaalsContact C-N 3.34Å; K128-H130 PolarHBondContact O-N 2.8Å; K128-R131 WeakPolarHBondContact O-CB 3.45Å; K128-R131 PolarHBondContact O-N 3.41Å; K128-R131 VanDerWaalsContact O-N 3.12Å; K128-E132 VanDerWaalsContact CE-OE1 3.24Å; K128-E132 WeakPolarHBondContact CE-OE1 3.3Å; K128-E132 IonicContact NZ-OE1 3.86Å; K128-E132 PolarHBondContact O-N 2.86Å; K128-E132 VanDerWaalsContact O-N 3.09Å
129R84.1Confident81.6Confident151 Ų15177.9 Ų77.957%0.5737%0.369SS*.Hα-helixtrans-58.5-44.1177179.6179.2175.21660.4111.7H125 T126 R131 E132 I133H125-R129 WeakPolarHBondContact O-CB 3.27Å; H125-R129 PolarHBondContact O-N 2.99Å; T126-R129 PolarHBondContact O-N 3.27Å; R129-R131 VanDerWaalsContact C-N 3.27Å; R129-R131 PolarHBondContact O-N 3.37Å; R129-E132 PolarHBondContact O-N 3.29Å; R129-E132 VanDerWaalsContact O-N 3.14Å; R129-I133 HydrophobicContact CG-CD1 3.8Å; R129-I133 HydrophobicContact CG-CG1 4.36Å; R129-I133 WeakPolarHBondContact O-CG1 3.45Å; R129-I133 PolarHBondContact O-N 3.45Å
130H86.1Confident82.6Confident8 Ų880.3 Ų80.34%0.03737%0.37CS..Hα-helixtrans-63.2-31.9177-78.5-69.5000113A13 E17 N86 M89 T126 A127 K128 L134A13-H130 VanDerWaalsContact CB-CE1 3.45Å; A13-H130 WeakPolarHBondContact CB-CE1 3.3Å; E17-H130 IonicContact OE1-CE1 3.66Å; E17-H130 PolarHBondContact OE1-CE1 3.24Å; E17-H130 IonicContact OE1-CG 2.68Å; E17-H130 IonicContact OE1-ND1 3.37Å; E17-H130 PolarHBondContact OE1-ND1 2.93Å; E17-H130 IonicContact OE2-CE1 3.33Å; E17-H130 IonicContact OE2-ND1 2.66Å; N86-H130 PolarHBondContact ND2-O 3.33Å; N86-H130 VanDerWaalsContact ND2-O 3.08Å; N86-H130 VanDerWaalsContact OD1-CB 3.25Å; N86-H130 WeakPolarHBondContact OD1-CB 3.27Å; M89-H130 HydrophobicContact CE-CB 3.87Å; T126-H130 PolarHBondContact O-CD2 2.79Å; T126-H130 PolarHBondContact O-N 2.97Å; A127-H130 PolarHBondContact O-N 3.44Å; K128-H130 VanDerWaalsContact C-N 3.34Å; K128-H130 PolarHBondContact O-N 2.8Å; H130-L134 WeakPolarHBondContact O-CB 3.32Å; H130-L134 PolarHBondContact O-N 2.89Å
131R84Confident83.7Confident141 Ų14174.7 Ų74.753%0.53235%0.349SS..Hα-helixtrans-68.4-38.4172.3-72.6177.2173.2160.3-4.4112.7A127 K128 R129 R135A127-R131 PolarHBondContact O-N 2.82Å; K128-R131 WeakPolarHBondContact O-CB 3.45Å; K128-R131 PolarHBondContact O-N 3.41Å; K128-R131 VanDerWaalsContact O-N 3.12Å; R129-R131 VanDerWaalsContact C-N 3.27Å; R129-R131 PolarHBondContact O-N 3.37Å; R131-R135 PolarHBondContact O-N 2.97Å; R131-R135 VanDerWaalsContact O-N 3.15Å
132E86.6Confident84.6Confident97 Ų9776.2 Ų76.245%0.45335%0.346SS..Hα-helixtrans-65.4-47.9175-69.6171-17900110.4K128 R129 L134 R135 D136K128-E132 VanDerWaalsContact CE-OE1 3.24Å; K128-E132 WeakPolarHBondContact CE-OE1 3.3Å; K128-E132 IonicContact NZ-OE1 3.86Å; K128-E132 PolarHBondContact O-N 2.86Å; K128-E132 VanDerWaalsContact O-N 3.09Å; R129-E132 PolarHBondContact O-N 3.29Å; R129-E132 VanDerWaalsContact O-N 3.14Å; E132-L134 PolarHBondContact O-N 3.38Å; E132-R135 WeakPolarHBondContact O-CA 3.49Å; E132-R135 VanDerWaalsContact O-CB 3.3Å; E132-R135 WeakPolarHBondContact O-CB 3.44Å; E132-R135 PolarHBondContact O-N 2.71Å; E132-D136 PolarHBondContact O-N 2.69Å
133I87.3Confident85.3Confident32 Ų3277.2 Ų77.216%0.16434%0.344CS..Hα-helixtrans-59.1-45.6177.5-68.3169.2000111.7E17 R129 R135 D136 Y137E17-I133 HydrophobicContact CG-CG2 4.01Å; E17-I133 WeakPolarHBondContact OE1-CG2 3.49Å; R129-I133 HydrophobicContact CG-CD1 3.8Å; R129-I133 HydrophobicContact CG-CG1 4.36Å; R129-I133 WeakPolarHBondContact O-CG1 3.45Å; R129-I133 PolarHBondContact O-N 3.45Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 3.33Å; I133-D136 PolarHBondContact O-N 3.38Å; I133-Y137 HydrophobicContact CG2-CD2 3.47Å; I133-Y137 VanDerWaalsContact CG2-CD2 3.47Å; I133-Y137 HydrophobicContact CG2-CE2 3.11Å; I133-Y137 WeakPolarHBondContact O-CD2 3.49Å; I133-Y137 PolarHBondContact O-N 3.47Å
134L86.9Confident85.6Confident25 Ų2576 Ų7613%0.13134%0.34CS..Hα-helixtrans-58.5-40.4175.317568.6000111.8L79 L82 T83 H130 E132 D136 A138L79-L134 HydrophobicContact CD2-CD1 3.8Å; L82-L134 HydrophobicContact CB-CD1 4.19Å; L82-L134 HydrophobicContact CD2-CB 4.31Å; L82-L134 HydrophobicContact CD2-CD1 3.87Å; L82-L134 HydrophobicContact CG-CD1 4.07Å; T83-L134 HydrophobicContact CG2-CD2 4.36Å; T83-L134 WeakPolarHBondContact OG1-CD2 3.44Å; H130-L134 WeakPolarHBondContact O-CB 3.32Å; H130-L134 PolarHBondContact O-N 2.89Å; E132-L134 PolarHBondContact O-N 3.38Å; L134-D136 VanDerWaalsContact C-N 3.34Å; L134-A138 VanDerWaalsContact O-CB 3.3Å; L134-A138 WeakPolarHBondContact O-CB 3.26Å; L134-A138 PolarHBondContact O-N 2.77Å
135R87.6Confident86.2Confident163 Ų16374.5 Ų74.562%0.61533%0.33SS*.Hα-helixtrans-64-42.3178-175.2-176-178.2124.10.8111R131 E132 I133 Q139R131-R135 PolarHBondContact O-N 2.97Å; R131-R135 VanDerWaalsContact O-N 3.15Å; E132-R135 WeakPolarHBondContact O-CA 3.49Å; E132-R135 VanDerWaalsContact O-CB 3.3Å; E132-R135 WeakPolarHBondContact O-CB 3.44Å; E132-R135 PolarHBondContact O-N 2.71Å; I133-R135 VanDerWaalsContact C-N 3.27Å; I133-R135 PolarHBondContact O-N 3.33Å; R135-Q139 WeakPolarHBondContact O-CB 3.34Å; R135-Q139 PolarHBondContact O-N 2.89Å
136D88.8Confident86.6Confident92 Ų9271.4 Ų71.449%0.49233%0.325SS..Hα-helixtrans-65.6-48.8178.4-65.5-16.8000110.6E132 I133 L134 A138 Q139 E140E132-D136 PolarHBondContact O-N 2.69Å; I133-D136 PolarHBondContact O-N 3.38Å; L134-D136 VanDerWaalsContact C-N 3.34Å; D136-A138 VanDerWaalsContact C-N 3.35Å; D136-A138 PolarHBondContact O-N 3.29Å; D136-Q139 WeakPolarHBondContact O-CB 3.5Å; D136-Q139 PolarHBondContact O-N 2.88Å; D136-E140 WeakPolarHBondContact O-CB 3.48Å; D136-E140 WeakPolarHBondContact O-CG 3.49Å; D136-E140 PolarHBondContact O-N 3.42Å
137Y89.2Confident86.7Confident43 Ų4376.4 Ų76.417%0.16935%0.345CS..Hα-helixtrans-60.4-41.4176-73-49.5000113.1E17 I20 D21 L24 I133 Q139 E140 F141E17-Y137 HydrophobicContact CB-CE2 3.96Å; E17-Y137 HydrophobicContact CG-CE2 3.94Å; E17-Y137 PolarHBondContact O-OH 3.19Å; I20-Y137 HydrophobicContact CG2-CD1 3.81Å; I20-Y137 HydrophobicContact CG2-CD2 4.2Å; I20-Y137 HydrophobicContact CG2-CE1 4.34Å; I20-Y137 HydrophobicContact CG2-CG 3.75Å; D21-Y137 HydrophobicContact CB-CE1 4.28Å; L24-Y137 HydrophobicContact CD1-CD1 3.66Å; L24-Y137 HydrophobicContact CD1-CE1 4.4Å; L24-Y137 HydrophobicContact CD1-CG 4.47Å; I133-Y137 HydrophobicContact CG2-CD2 3.47Å; I133-Y137 VanDerWaalsContact CG2-CD2 3.47Å; I133-Y137 HydrophobicContact CG2-CE2 3.11Å; I133-Y137 WeakPolarHBondContact O-CD2 3.49Å; I133-Y137 PolarHBondContact O-N 3.47Å; Y137-Q139 VanDerWaalsContact C-N 3.3Å; Y137-Q139 PolarHBondContact O-N 3.26Å; Y137-E140 PolarHBondContact O-N 3.06Å; Y137-F141 VanDerWaalsContact O-CB 3.3Å; Y137-F141 WeakPolarHBondContact O-CB 3.19Å; Y137-F141 PolarHBondContact O-N 3.45Å
138A88.6Confident86.8Confident20 Ų2076.4 Ų76.417%0.16535%0.345CS..Hα-helixtrans-65.5-34.2175.600000112.2L134 D136 R142L134-A138 VanDerWaalsContact O-CB 3.3Å; L134-A138 WeakPolarHBondContact O-CB 3.26Å; L134-A138 PolarHBondContact O-N 2.77Å; D136-A138 VanDerWaalsContact C-N 3.35Å; D136-A138 PolarHBondContact O-N 3.29Å; A138-R142 WeakPolarHBondContact O-CB 3.27Å; A138-R142 WeakPolarHBondContact O-CG 3.35Å; A138-R142 PolarHBondContact O-N 2.82Å; A138-R142 PolarHBondContact O-NE 3.4Å
139Q89.7Confident86.9Confident98 Ų9873.7 Ų73.746%0.45834%0.335SS..Hα-helixtrans-69.9-48.3174.5178.8175.2-4100111.5R135 D136 Y137 F141 R142 Q143R135-Q139 WeakPolarHBondContact O-CB 3.34Å; R135-Q139 PolarHBondContact O-N 2.89Å; D136-Q139 WeakPolarHBondContact O-CB 3.5Å; D136-Q139 PolarHBondContact O-N 2.88Å; Y137-Q139 VanDerWaalsContact C-N 3.3Å; Y137-Q139 PolarHBondContact O-N 3.26Å; Q139-F141 VanDerWaalsContact C-N 3.34Å; Q139-F141 PolarHBondContact O-N 3.44Å; Q139-R142 PolarHBondContact O-N 3.38Å; Q139-Q143 WeakPolarHBondContact O-CB 3.41Å; Q139-Q143 PolarHBondContact O-N 2.78Å
140E88.1Confident86.9Confident90 Ų9069.1 Ų69.142%0.42133%0.33SS..Hα-helixtrans-59.7-43177.2-74-62151.300111.6L24 D136 Y137 Q143 T144L24-E140 HydrophobicContact CD1-CB 4.38Å; D136-E140 WeakPolarHBondContact O-CB 3.48Å; D136-E140 WeakPolarHBondContact O-CG 3.49Å; D136-E140 PolarHBondContact O-N 3.42Å; Y137-E140 PolarHBondContact O-N 3.06Å; E140-Q143 PolarHBondContact O-N 3.5Å; E140-T144 VanDerWaalsContact O-CB 3.27Å; E140-T144 WeakPolarHBondContact O-CB 3.4Å; E140-T144 PolarHBondContact O-N 2.96Å; E140-T144 PolarHBondContact O-OG1 2.98Å
141F88.4Confident86.6Confident9 Ų970.9 Ų70.94%0.03935%0.345CS..Hα-helixtrans-59.1-50.8174.1178.2-116000111.6L24 F27 C72 I75 E76 L79 Y137 Q139 Q143 T144 K145L24-F141 HydrophobicContact CD2-CB 3.84Å; L24-F141 HydrophobicContact CD2-CD2 3.94Å; L24-F141 HydrophobicContact CD2-CG 4.39Å; F27-F141 HydrophobicContact CD1-CD2 4.45Å; F27-F141 HydrophobicContact CD1-CE2 4.41Å; F27-F141 HydrophobicContact CE1-CD2 4.27Å; F27-F141 HydrophobicContact CE1-CE2 4.01Å; F27-F141 HydrophobicContact CZ-CE2 4.06Å; C72-F141 HydrophobicContact CB-CZ 4.13Å; I75-F141 HydrophobicContact CB-CD2 4.01Å; I75-F141 HydrophobicContact CB-CE2 3.82Å; I75-F141 HydrophobicContact CB-CZ 4.37Å; I75-F141 HydrophobicContact CD1-CD2 3.91Å; I75-F141 HydrophobicContact CD1-CE2 3.84Å; I75-F141 HydrophobicContact CG1-CE2 4.43Å; I75-F141 HydrophobicContact CG2-CB 4.3Å; I75-F141 HydrophobicContact CG2-CD1 4.42Å; I75-F141 HydrophobicContact CG2-CD2 3.45Å; I75-F141 VanDerWaalsContact CG2-CD2 3.45Å; I75-F141 HydrophobicContact CG2-CE2 3.78Å; I75-F141 HydrophobicContact CG2-CG 3.79Å; I75-F141 HydrophobicContact CG2-CZ 4.38Å; E76-F141 HydrophobicContact CG-CE1 3.59Å; E76-F141 HydrophobicContact CG-CZ 3.92Å; E76-F141 WeakPolarHBondContact OE1-CE1 3.5Å; L79-F141 HydrophobicContact CD1-CB 4.4Å; L79-F141 HydrophobicContact CD1-CD1 4.28Å; L79-F141 HydrophobicContact CD1-CG 4.46Å; Y137-F141 VanDerWaalsContact O-CB 3.3Å; Y137-F141 WeakPolarHBondContact O-CB 3.19Å; Y137-F141 PolarHBondContact O-N 3.45Å; Q139-F141 VanDerWaalsContact C-N 3.34Å; Q139-F141 PolarHBondContact O-N 3.44Å; F141-Q143 VanDerWaalsContact C-N 3.33Å; F141-Q143 PolarHBondContact O-N 3.18Å; F141-T144 PolarHBondContact O-N 2.73Å; F141-K145 HydrophobicContact CE1-CD 4.06Å; F141-K145 HydrophobicContact CZ-CD 4.03Å; F141-K145 WeakPolarHBondContact O-CB 3.26Å; F141-K145 PolarHBondContact O-N 2.65Å
142R89Confident86.3Confident151 Ų15165.2 Ų65.257%0.5732%0.324SS*.Hα-helixtrans-60.7-42.8178.4-77.5-173.5-65.4-107.3-3.3112A138 Q139 A146A138-R142 WeakPolarHBondContact O-CB 3.27Å; A138-R142 WeakPolarHBondContact O-CG 3.35Å; A138-R142 PolarHBondContact O-N 2.82Å; A138-R142 PolarHBondContact O-NE 3.4Å; Q139-R142 PolarHBondContact O-N 3.38Å; R142-A146 WeakPolarHBondContact O-CB 3.24Å; R142-A146 PolarHBondContact O-N 2.99Å
143Q88.3Confident86.1Confident85 Ų8566 Ų6640%0.39733%0.328SS..Hα-helixtrans-65.6-44.6179.4-171-178.816.300111.1Q139 E140 F141 A146 K147Q139-Q143 WeakPolarHBondContact O-CB 3.41Å; Q139-Q143 PolarHBondContact O-N 2.78Å; E140-Q143 PolarHBondContact O-N 3.5Å; F141-Q143 VanDerWaalsContact C-N 3.33Å; F141-Q143 PolarHBondContact O-N 3.18Å; Q143-A146 PolarHBondContact O-N 2.71Å; Q143-K147 HydrophobicContact CG-CD 4.45Å; Q143-K147 VanDerWaalsContact O-CG 3.3Å; Q143-K147 WeakPolarHBondContact O-CG 3.32Å; Q143-K147 PolarHBondContact O-N 2.93Å
144T84.8Confident85.8Confident25 Ų2572.9 Ų72.915%0.15335%0.351CS..Hα-helixtrans-66.7-43.2178.6-560000111F27 E140 F141 A146 K147 L148F27-T144 HydrophobicContact CD1-CG2 3.67Å; F27-T144 HydrophobicContact CE1-CG2 4.09Å; E140-T144 VanDerWaalsContact O-CB 3.27Å; E140-T144 WeakPolarHBondContact O-CB 3.4Å; E140-T144 PolarHBondContact O-N 2.96Å; E140-T144 PolarHBondContact O-OG1 2.98Å; F141-T144 PolarHBondContact O-N 2.73Å; T144-A146 PolarHBondContact O-N 2.85Å; T144-K147 PolarHBondContact O-N 3.32Å; T144-L148 VanDerWaalsContact O-CB 3.23Å; T144-L148 WeakPolarHBondContact O-CB 3.37Å; T144-L148 PolarHBondContact O-N 3.28Å
145K88.5Confident85.3Confident59 Ų5975.6 Ų75.626%0.25736%0.364SS..Hα-helixtrans-57.6-46.6174.7-171.9176.9-171.2172.40111.4F27 F68 E76 F141 L148 I149F27-K145 HydrophobicContact CE1-CB 4.11Å; F27-K145 HydrophobicContact CZ-CB 4.32Å; F27-K145 HydrophobicContact CZ-CG 4.44Å; F68-K145 HydrophobicContact CE2-CG 4.42Å; F68-K145 HydrophobicContact CZ-CG 3.87Å; E76-K145 IonicContact OE1-NZ 3.85Å; E76-K145 PolarHBondContact OE1-NZ 3.47Å; F141-K145 HydrophobicContact CE1-CD 4.06Å; F141-K145 HydrophobicContact CZ-CD 4.03Å; F141-K145 WeakPolarHBondContact O-CB 3.26Å; F141-K145 PolarHBondContact O-N 2.65Å; K145-L148 PolarHBondContact O-N 3.47Å; K145-I149 HydrophobicContact CG-CD1 4.09Å; K145-I149 WeakPolarHBondContact O-CG1 3.33Å; K145-I149 PolarHBondContact O-N 3.34Å
146A85.4Confident84.8Confident59 Ų5971.6 Ų71.649%0.48835%0.354SS..Hα-helixtrans-64.3-43.7177.300000112.6R142 Q143 T144 L148 A150R142-A146 WeakPolarHBondContact O-CB 3.24Å; R142-A146 PolarHBondContact O-N 2.99Å; Q143-A146 PolarHBondContact O-N 2.71Å; T144-A146 PolarHBondContact O-N 2.85Å; A146-L148 VanDerWaalsContact C-N 3.27Å; A146-L148 PolarHBondContact O-N 2.86Å; A146-A150 WeakPolarHBondContact O-CB 3.5Å; A146-A150 PolarHBondContact O-N 3.24Å
147K86Confident84.4Confident125 Ų12573.2 Ų73.254%0.54336%0.362SS..Hα-helixtrans-58.8-41.7174.5-74.4170.8-179.3169.20111.5Q143 T144 A150 A151Q143-K147 HydrophobicContact CG-CD 4.45Å; Q143-K147 VanDerWaalsContact O-CG 3.3Å; Q143-K147 WeakPolarHBondContact O-CG 3.32Å; Q143-K147 PolarHBondContact O-N 2.93Å; T144-K147 PolarHBondContact O-N 3.32Å; K147-A150 PolarHBondContact O-N 3.24Å; K147-A151 WeakPolarHBondContact O-CB 3.31Å; K147-A151 PolarHBondContact O-N 3.17Å
148L83.3Confident83.8Confident8 Ų874.9 Ų74.94%0.04237%0.374CS..Hα-helixtrans-69.3-43.3-176.4-171.347000112.1F27 I30 G31 F64 F68 T144 K145 A146 A151 R152F27-L148 HydrophobicContact CD1-CD2 4.39Å; F27-L148 HydrophobicContact CD2-CD2 4.48Å; F27-L148 HydrophobicContact CE1-CD2 4.02Å; F27-L148 HydrophobicContact CE2-CD2 4.12Å; F27-L148 HydrophobicContact CZ-CD2 3.88Å; I30-L148 HydrophobicContact CB-CD2 4.45Å; G31-L148 VanDerWaalsContact N-CD1 3.34Å; F64-L148 HydrophobicContact CE2-CD1 3.82Å; F64-L148 HydrophobicContact CE2-CG 4.44Å; F64-L148 HydrophobicContact CZ-CD1 3.54Å; F64-L148 HydrophobicContact CZ-CD2 4.42Å; F64-L148 HydrophobicContact CZ-CG 3.8Å; F68-L148 HydrophobicContact CD2-CD2 3.43Å; F68-L148 VanDerWaalsContact CD2-CD2 3.43Å; F68-L148 HydrophobicContact CD2-CG 3.79Å; F68-L148 HydrophobicContact CE2-CB 4.06Å; F68-L148 HydrophobicContact CE2-CD2 3.53Å; F68-L148 HydrophobicContact CE2-CG 3.64Å; T144-L148 VanDerWaalsContact O-CB 3.23Å; T144-L148 WeakPolarHBondContact O-CB 3.37Å; T144-L148 PolarHBondContact O-N 3.28Å; K145-L148 PolarHBondContact O-N 3.47Å; A146-L148 VanDerWaalsContact C-N 3.27Å; A146-L148 PolarHBondContact O-N 2.86Å; L148-A151 PolarHBondContact O-N 3.04Å; L148-R152 WeakPolarHBondContact O-CB 3.41Å; L148-R152 PolarHBondContact O-N 3.42Å
149I84.5Confident83Confident67 Ų6775.4 Ų75.434%0.34438%0.381SS..Hα-helixtrans-63.1-46.9173.6-67.2166000110.7F68 K145 A151 R152 E153F68-I149 HydrophobicContact CE1-CG1 4.45Å; F68-I149 HydrophobicContact CE2-CG1 4.49Å; F68-I149 HydrophobicContact CZ-CD1 4.09Å; F68-I149 HydrophobicContact CZ-CG1 3.79Å; K145-I149 HydrophobicContact CG-CD1 4.09Å; K145-I149 WeakPolarHBondContact O-CG1 3.33Å; K145-I149 PolarHBondContact O-N 3.34Å; I149-A151 VanDerWaalsContact C-N 3.31Å; I149-A151 PolarHBondContact O-N 3.34Å; I149-R152 WeakPolarHBondContact O-CB 3.47Å; I149-R152 PolarHBondContact O-N 3.32Å; I149-R152 VanDerWaalsContact O-N 3.07Å; I149-E153 HydrophobicContact CG2-CG 4.34Å; I149-E153 WeakPolarHBondContact CG2-OE1 3.49Å; I149-E153 WeakPolarHBondContact O-CG 3.3Å; I149-E153 PolarHBondContact O-N 3.25Å
150A83.4Confident82Confident55 Ų5573.6 Ų73.646%0.45538%0.379SS..Hα-helixtrans-62.3-37.9178.300000112.6A146 K147 R152 R154A146-A150 WeakPolarHBondContact O-CB 3.5Å; A146-A150 PolarHBondContact O-N 3.24Å; K147-A150 PolarHBondContact O-N 3.24Å; A150-R152 VanDerWaalsContact C-N 3.35Å; A150-R154 WeakPolarHBondContact O-CB 3.34Å; A150-R154 PolarHBondContact O-N 3.07Å
151A80.4Confident81.3Confident44 Ų4473.3 Ų73.336%0.36438%0.383SS..Hα-helixtrans-64.8-40.1173.400000111.5K147 L148 I149 R154 E155K147-A151 WeakPolarHBondContact O-CB 3.31Å; K147-A151 PolarHBondContact O-N 3.17Å; L148-A151 PolarHBondContact O-N 3.04Å; I149-A151 VanDerWaalsContact C-N 3.31Å; I149-A151 PolarHBondContact O-N 3.34Å; A151-R154 WeakPolarHBondContact O-CB 3.32Å; A151-R154 PolarHBondContact O-N 3.37Å; A151-E155 PolarHBondContact O-N 2.86Å
152R78.3Confident80.2Confident23 Ų2380.3 Ų80.39%0.08741%0.411CS..Hα-helixtrans-67.8-44178-17655.8172.6-179.6-4.2112.7N61 F64 L148 I149 A150 R154 E155 N156N61-R152 VanDerWaalsContact CA-NH2 3.29Å; N61-R152 PolarHBondContact ND2-NH2 2.81Å; N61-R152 PolarHBondContact O-NH2 3.27Å; N61-R152 PolarHBondContact OD1-NH2 3.44Å; F64-R152 HydrophobicContact CD1-CG 4.2Å; F64-R152 HydrophobicContact CE1-CB 4.03Å; F64-R152 HydrophobicContact CE1-CG 3.79Å; F64-R152 HydrophobicContact CZ-CB 4.3Å; F64-R152 HydrophobicContact CZ-CG 4.48Å; L148-R152 WeakPolarHBondContact O-CB 3.41Å; L148-R152 PolarHBondContact O-N 3.42Å; I149-R152 WeakPolarHBondContact O-CB 3.47Å; I149-R152 PolarHBondContact O-N 3.32Å; I149-R152 VanDerWaalsContact O-N 3.07Å; A150-R152 VanDerWaalsContact C-N 3.35Å; R152-R154 VanDerWaalsContact C-N 3.29Å; R152-R154 PolarHBondContact O-N 2.81Å; R152-E155 IonicContact CZ-OE2 3.24Å; R152-E155 IonicContact NH1-OE1 3.74Å; R152-E155 PolarHBondContact NH1-OE1 3.32Å; R152-E155 IonicContact NH1-OE2 2.64Å; R152-E155 PolarHBondContact NH1-OE2 3.41Å; R152-E155 PolarHBondContact O-N 2.89Å; R152-E155 VanDerWaalsContact O-N 3.17Å; R152-N156 PolarHBondContact O-N 3.12Å; R152-N156 PolarHBondContact O-ND2 3.33Å
153E81.4Confident79.2Confident113 Ų11382.5 Ų82.553%0.52842%0.419SS..Hα-helixtrans-58-44.3173.4-73.2173.5-175.700110.6I149 E155 N156 L157I149-E153 HydrophobicContact CG2-CG 4.34Å; I149-E153 WeakPolarHBondContact CG2-OE1 3.49Å; I149-E153 WeakPolarHBondContact O-CG 3.3Å; I149-E153 PolarHBondContact O-N 3.25Å; E153-E155 VanDerWaalsContact C-N 3.35Å; E153-E155 PolarHBondContact O-N 3.48Å; E153-N156 PolarHBondContact O-N 3.47Å; E153-L157 WeakPolarHBondContact O-CB 3.48Å; E153-L157 VanDerWaalsContact O-CG 3.23Å; E153-L157 WeakPolarHBondContact O-CG 3.26Å; E153-L157 PolarHBondContact O-N 3.3Å
154R80.4Confident77.9Confident176 Ų17682.6 Ų82.666%0.66442%0.422SS*.Hα-helixtrans-59.3-43.9174.4-179.2-175.1174.31170.8112.1A150 A151 R152 L157 L158A150-R154 WeakPolarHBondContact O-CB 3.34Å; A150-R154 PolarHBondContact O-N 3.07Å; A151-R154 WeakPolarHBondContact O-CB 3.32Å; A151-R154 PolarHBondContact O-N 3.37Å; R152-R154 VanDerWaalsContact C-N 3.29Å; R152-R154 PolarHBondContact O-N 2.81Å; R154-L157 PolarHBondContact O-N 2.83Å; R154-L158 HydrophobicContact CG-CD1 4.2Å; R154-L158 VanDerWaalsContact O-CG 3.31Å; R154-L158 WeakPolarHBondContact O-CG 3.49Å; R154-L158 PolarHBondContact O-N 3.05Å
155E76.1Confident76.8Confident83 Ų8385.1 Ų85.139%0.38844%0.438SS..Hα-helixtrans-64.2-43.4177.1-170.3-169.8168.100111.7A151 R152 E153 L157 L158 G159A151-E155 PolarHBondContact O-N 2.86Å; R152-E155 IonicContact CZ-OE2 3.24Å; R152-E155 IonicContact NH1-OE1 3.74Å; R152-E155 PolarHBondContact NH1-OE1 3.32Å; R152-E155 IonicContact NH1-OE2 2.64Å; R152-E155 PolarHBondContact NH1-OE2 3.41Å; R152-E155 PolarHBondContact O-N 2.89Å; R152-E155 VanDerWaalsContact O-N 3.17Å; E153-E155 VanDerWaalsContact C-N 3.35Å; E153-E155 PolarHBondContact O-N 3.48Å; E155-L157 VanDerWaalsContact C-N 3.33Å; E155-L157 PolarHBondContact O-N 3.27Å; E155-L158 PolarHBondContact O-N 3.31Å; E155-G159 PolarHBondContact O-N 2.66Å
156N77.9Confident75.5Confident78 Ų7887.3 Ų87.342%0.41745%0.452SS..Hα-helixtrans-61.8-41176.8-74-26.3000111.8R152 E153 G159 S160R152-N156 PolarHBondContact O-N 3.12Å; R152-N156 PolarHBondContact O-ND2 3.33Å; E153-N156 PolarHBondContact O-N 3.47Å; N156-G159 PolarHBondContact O-N 3.5Å; N156-S160 PolarHBondContact O-N 2.97Å; N156-S160 VanDerWaalsContact O-N 3.11Å
157L80.5Confident74.3Confident126 Ų12687 Ų8766%0.6645%0.447SS*.Hα-helixtrans-63.7-45.5175-69.5171.7000111.7E153 R154 E155 S160 V161E153-L157 WeakPolarHBondContact O-CB 3.48Å; E153-L157 VanDerWaalsContact O-CG 3.23Å; E153-L157 WeakPolarHBondContact O-CG 3.26Å; E153-L157 PolarHBondContact O-N 3.3Å; R154-L157 PolarHBondContact O-N 2.83Å; E155-L157 VanDerWaalsContact C-N 3.33Å; E155-L157 PolarHBondContact O-N 3.27Å; L157-S160 PolarHBondContact O-N 3.03Å; L157-V161 PolarHBondContact O-N 3.46Å
158L76.6Confident73Confident79 Ų7985.3 Ų85.341%0.41445%0.447SS..Hα-helixtrans-67.1-39.6176.9-69.3175000111.9R154 E155 S160 V161 Y162R154-L158 HydrophobicContact CG-CD1 4.2Å; R154-L158 VanDerWaalsContact O-CG 3.31Å; R154-L158 WeakPolarHBondContact O-CG 3.49Å; R154-L158 PolarHBondContact O-N 3.05Å; E155-L158 PolarHBondContact O-N 3.31Å; L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.44Å; L158-V161 PolarHBondContact O-N 3.14Å; L158-V161 VanDerWaalsContact O-N 3.11Å; L158-Y162 HydrophobicContact CB-CD2 4.45Å; L158-Y162 HydrophobicContact CB-CE2 4.28Å; L158-Y162 WeakPolarHBondContact O-CD2 3.23Å; L158-Y162 PolarHBondContact O-N 3.28Å
159G71Confident71.7Confident30 Ų3088.1 Ų88.131%0.30947%0.465SS..Hα-helixtrans-59.6-37.9177.200000112.5E155 N156 R163E155-G159 PolarHBondContact O-N 2.66Å; N156-G159 PolarHBondContact O-N 3.5Å; G159-R163 WeakPolarHBondContact O-CB 3.43Å; G159-R163 WeakPolarHBondContact O-CG 3.49Å; G159-R163 PolarHBondContact O-N 3.41Å; G159-R163 VanDerWaalsContact O-N 3.09Å
160S70.5Confident70.5Confident61 Ų6189.5 Ų89.543%0.42748%0.476SS..Hα-helixtrans-62.4-48.5171.9-164.90000111.3N156 L157 L158 Y162 R163 D164N156-S160 PolarHBondContact O-N 2.97Å; N156-S160 VanDerWaalsContact O-N 3.11Å; L157-S160 PolarHBondContact O-N 3.03Å; L158-S160 VanDerWaalsContact C-N 3.29Å; L158-S160 PolarHBondContact O-N 3.44Å; S160-Y162 VanDerWaalsContact C-N 3.34Å; S160-Y162 PolarHBondContact O-N 2.87Å; S160-R163 PolarHBondContact O-N 3.18Å; S160-R163 VanDerWaalsContact O-N 3.11Å; S160-D164 WeakPolarHBondContact O-CB 3.41Å; S160-D164 PolarHBondContact O-N 2.96Å; S160-D164 PolarHBondContact OG-OD2 3.09Å
161V71.6Confident69Low84 Ų8493.4 Ų93.451%0.50949%0.489SS..Hα-helixtrans-60.3-41.9-179.1175.90000111.9L157 L158 D164 T165L157-V161 PolarHBondContact O-N 3.46Å; L158-V161 PolarHBondContact O-N 3.14Å; L158-V161 VanDerWaalsContact O-N 3.11Å; V161-D164 PolarHBondContact O-N 3.45Å; V161-T165 WeakPolarHBondContact O-CB 3.36Å; V161-T165 PolarHBondContact O-N 3.18Å; V161-T165 PolarHBondContact O-OG1 3.49Å
162Y66.6Low67.9Low155 Ų15598.6 Ų98.661%0.60851%0.51SS*.Hα-helixtrans-66.4-38.5176.2-75.4-70.5000112.4L158 S160 N166L158-Y162 HydrophobicContact CB-CD2 4.45Å; L158-Y162 HydrophobicContact CB-CE2 4.28Å; L158-Y162 WeakPolarHBondContact O-CD2 3.23Å; L158-Y162 PolarHBondContact O-N 3.28Å; S160-Y162 VanDerWaalsContact C-N 3.34Å; S160-Y162 PolarHBondContact O-N 2.87Å; Y162-N166 WeakPolarHBondContact O-CB 3.39Å; Y162-N166 PolarHBondContact O-N 2.91Å
163R67.1Low66.6Low197 Ų197102 Ų10274%0.74354%0.538SS*.Hα-helixtrans-66.1-41.4176.5-72.5174.375.9142.75.9111.9G159 S160 N166 S167G159-R163 WeakPolarHBondContact O-CB 3.43Å; G159-R163 WeakPolarHBondContact O-CG 3.49Å; G159-R163 PolarHBondContact O-N 3.41Å; G159-R163 VanDerWaalsContact O-N 3.09Å; S160-R163 PolarHBondContact O-N 3.18Å; S160-R163 VanDerWaalsContact O-N 3.11Å; R163-N166 PolarHBondContact O-N 3.48Å; R163-S167 WeakPolarHBondContact O-CB 3.38Å; R163-S167 PolarHBondContact O-N 2.98Å; R163-S167 PolarHBondContact O-OG 3.12Å
164D61.1Low65.3Low88 Ų8899.7 Ų99.747%0.47154%0.543SS..Hα-helixtrans-71.3-35.2179.3-64.3-27.8000111.9S160 V161 S167 T168S160-D164 WeakPolarHBondContact O-CB 3.41Å; S160-D164 PolarHBondContact O-N 2.96Å; S160-D164 PolarHBondContact OG-OD2 3.09Å; V161-D164 PolarHBondContact O-N 3.45Å; D164-S167 WeakPolarHBondContact CA-OG 3.41Å; D164-S167 PolarHBondContact O-OG 3.27Å; D164-T168 WeakPolarHBondContact O-CB 3.35Å; D164-T168 PolarHBondContact O-N 2.72Å; D164-T168 VanDerWaalsContact O-N 3.09Å; D164-T168 PolarHBondContact O-OG1 2.97Å
165T62.4Low63.5Low78 Ų7897.4 Ų97.448%0.47954%0.544SS..Hα-helixtrans-65.9-46.1173.7-54.90000110.3V161 S167 T168 T169V161-T165 WeakPolarHBondContact O-CB 3.36Å; V161-T165 PolarHBondContact O-N 3.18Å; V161-T165 PolarHBondContact O-OG1 3.49Å; T165-S167 PolarHBondContact O-N 2.81Å; T165-T168 PolarHBondContact O-N 3.24Å; T165-T169 WeakPolarHBondContact O-CG2 3.32Å; T165-T169 PolarHBondContact O-N 2.92Å; T165-T169 PolarHBondContact O-OG1 3.39Å
166N61.8Low62.4Low104 Ų104103.2 Ų103.256%0.55657%0.569SS**Hα-helixtrans-64.6-41.7179.7-164.752.4000111.7Y162 R163 T168 T169 V170Y162-N166 WeakPolarHBondContact O-CB 3.39Å; Y162-N166 PolarHBondContact O-N 2.91Å; R163-N166 PolarHBondContact O-N 3.48Å; N166-T168 VanDerWaalsContact C-N 3.28Å; N166-T168 PolarHBondContact O-N 2.9Å; N166-T169 WeakPolarHBondContact CA-OG1 3.45Å; N166-T169 PolarHBondContact O-N 2.9Å; N166-T169 PolarHBondContact O-OG1 3.24Å; N166-V170 WeakPolarHBondContact O-CG2 3.31Å; N166-V170 PolarHBondContact O-N 3.03Å; N166-V170 VanDerWaalsContact O-N 3.09Å
167S60Low61.2Low54 Ų54104.7 Ų104.738%0.37858%0.581SS.*Hα-helixtrans-64.6-31.9177.571.50000112.8R163 D164 T165 N171R163-S167 WeakPolarHBondContact O-CB 3.38Å; R163-S167 PolarHBondContact O-N 2.98Å; R163-S167 PolarHBondContact O-OG 3.12Å; D164-S167 WeakPolarHBondContact CA-OG 3.41Å; D164-S167 PolarHBondContact O-OG 3.27Å; T165-S167 PolarHBondContact O-N 2.81Å; S167-N171 PolarHBondContact O-ND2 2.93Å
168T57.9Low59.6Low88 Ų88103.6 Ų103.654%0.5458%0.584SS.*Hα-helixtrans-75.3-38175.3-53.50000111.2D164 T165 N166 N171 L172D164-T168 WeakPolarHBondContact O-CB 3.35Å; D164-T168 PolarHBondContact O-N 2.72Å; D164-T168 VanDerWaalsContact O-N 3.09Å; D164-T168 PolarHBondContact O-OG1 2.97Å; T165-T168 PolarHBondContact O-N 3.24Å; N166-T168 VanDerWaalsContact C-N 3.28Å; N166-T168 PolarHBondContact O-N 2.9Å; T168-N171 PolarHBondContact O-N 3.19Å; T168-L172 PolarHBondContact O-N 3.33Å
169T57.2Low58.2Low68 Ų68109.4 Ų109.442%0.41761%0.606SS.*Hα-helixtrans-71.1-33.3179.752.20000114.1T165 N166 N171 L172 S173T165-T169 WeakPolarHBondContact O-CG2 3.32Å; T165-T169 PolarHBondContact O-N 2.92Å; T165-T169 PolarHBondContact O-OG1 3.39Å; N166-T169 WeakPolarHBondContact CA-OG1 3.45Å; N166-T169 PolarHBondContact O-N 2.9Å; N166-T169 PolarHBondContact O-OG1 3.24Å; T169-N171 VanDerWaalsContact C-N 3.3Å; T169-N171 PolarHBondContact O-N 3.31Å; T169-L172 PolarHBondContact O-N 2.79Å; T169-S173 PolarHBondContact O-N 2.74Å; T169-S173 PolarHBondContact O-OG 3.49Å
170V57.4Low56.9Low96 Ų96112.9 Ų112.958%0.58262%0.623SS**Hα-helixtrans-69.1-28.3172.9-95.30000112.8N166N166-V170 WeakPolarHBondContact O-CG2 3.31Å; N166-V170 PolarHBondContact O-N 3.03Å; N166-V170 VanDerWaalsContact O-N 3.09Å
171N53.2Low55.6Low137 Ų137118.5 Ų118.573%0.73364%0.642SS**Hα-helixtrans-83.5-19.4175.8-71.6-41.4000113.5S167 T168 T169S167-N171 PolarHBondContact O-ND2 2.93Å; T168-N171 PolarHBondContact O-N 3.19Å; T169-N171 VanDerWaalsContact C-N 3.3Å; T169-N171 PolarHBondContact O-N 3.31Å
172L57.6Low54.4Low152 Ų152118.3 Ų118.380%0.79665%0.645SS**THydrogen-bonded Turntrans-87.7-4.7173.3-144.372.4000113.4T168 T169T168-L172 PolarHBondContact O-N 3.33Å; T169-L172 PolarHBondContact O-N 2.79Å
173S50.6Low53.7Low96 Ų96117.3 Ų117.367%0.67165%0.65SS**THydrogen-bonded Turntrans-93.67.9177.1-53.40000113.2T169 D175T169-S173 PolarHBondContact O-N 2.74Å; T169-S173 PolarHBondContact O-OG 3.49Å; S173-D175 PolarHBondContact O-N 3Å
174G53.2Low53.4Low63 Ų63113.6 Ų113.665%0.64965%0.649SS**SBendtrans-78.193.2172.500000111.5
175D43.4Very low52.9Low128 Ų128116 Ų11668%0.68466%0.662SS**  trans62.976145.3-157.515.3000117.2S173 T177S173-D175 PolarHBondContact O-N 3Å; D175-T177 PolarHBondContact OD1-N 3.03Å; D175-T177 PolarHBondContact OD1-OG1 3.05Å
176F53.3Low52.6Low205 Ų205117.4 Ų117.490%0.89968%0.675SS**  trans-104.556.5150.6-167-99000108.5
177T52Low52.3Low110 Ų110118.8 Ų118.868%0.67569%0.693SS**  trans-98.293.41661.40000108.3D175 K179D175-T177 PolarHBondContact OD1-N 3.03Å; D175-T177 PolarHBondContact OD1-OG1 3.05Å; T177-K179 PolarHBondContact O-N 2.99Å
178S46.4Very low51.8Low103 Ų103119.9 Ų119.972%0.7271%0.712SS**  trans-44.2105.2164.950.20000110.8P180S178-P180 WeakPolarHBondContact O-CD 3.42Å
179K48.8Very low51.7Low200 Ų200119.6 Ų119.687%0.8773%0.727SS**  trans-104.7104.3167.2-159.2179-174.8-175.60107.9T177T177-K179 PolarHBondContact O-N 2.99Å
180P43Very low51.6Low104 Ų104123.5 Ų123.568%0.67575%0.745SS**  trans-80.1150.8166.432.6-28.6000109.3S178S178-P180 WeakPolarHBondContact O-CD 3.42Å
181Q42.3Very low51.3Low178 Ų178128.8 Ų128.883%0.83276%0.763SS**  trans103.4121142.5-150.6168.7-62.500118.9
182S47.1Very low51.2Low80 Ų80133 Ų13356%0.55977%0.769SS**  trans68.5113.1143.7700000120
183D51.4Low51Low135 Ų135130.9 Ų130.972%0.72277%0.767SS**  138.9106123-63.3-41.7000112.1
184V61.4Low51.3Low119 Ų119129 Ų12972%0.72176%0.762SS**  58.9100.5109.2-163.30000110.7
185D50.5Low51.3Low139 Ų139133.1 Ų133.174%0.74377%0.769SS**  -179.9142.569.7-117-32000112.6
186S56.6Low51.9Low107 Ų107134.2 Ų134.275%0.74877%0.77SS**  trans47118.7137.6-59.10000124.2
187S54Low52.1Low133 Ų133127.5 Ų127.593%0.9375%0.748SS**  trans78.8104.2136.3-165.80000120.3
188G50.9Low52.3Low76 Ų76127.5 Ų127.578%0.78474%0.744SS**  trans172115.9161.500000112.9
189G55.1Low53.2Low82 Ų82128 Ų12885%0.84574%0.737SS**  trans-76.2-170.2-16400000118.4
190N55.5Low54.2Low151 Ų151121.3 Ų121.381%0.80772%0.716SS**  trans85.971.8178-84.920000118.2R192N190-R192 VanDerWaalsContact C-N 3.3Å; N190-R192 PolarHBondContact O-N 3.14Å
191Q51.7Low55.5Low206 Ų206119.9 Ų119.996%0.96371%0.708SS**  trans-69.182.4153.4-62.6-173.565.500110.1
192R50.1Low57Low225 Ų225114.6 Ų114.685%0.84969%0.691SS**  trans-156.648.3174-121.8178.3170.4-164.7-3.9112.6N190N190-R192 VanDerWaalsContact C-N 3.3Å; N190-R192 PolarHBondContact O-N 3.14Å
193S54.9Low58.6Low109 Ų109114.3 Ų114.376%0.76269%0.686SS**  trans-135.735.3179.567.80000114.1
194G56.5Low59.6Low55 Ų55117 Ų11757%0.56769%0.686SS**SBendtrans-108.1-22-179.100000116.8
195L52.8Low60.4Low151 Ų151116.6 Ų116.679%0.79168%0.68SS**SBendtrans-110.6-13.8-176.7-90.183.1000114.4
196Q55.1Low61.9Low150 Ų150115.2 Ų115.270%0.70167%0.671SS**Hα-helixtrans-82.3-22.3-174.7-132.6169.574.200113S200Q196-S200 WeakPolarHBondContact O-CB 3.5Å; Q196-S200 PolarHBondContact O-N 3.04Å; Q196-S200 PolarHBondContact O-OG 3.5Å
197S57.5Low63.1Low64 Ų64115.2 Ų115.245%0.44866%0.662SS.*Hα-helixtrans-68.9-40.817854.30000112.3S200 S201S197-S200 PolarHBondContact O-N 2.71Å; S197-S201 PolarHBondContact O-N 3.09Å; S197-S201 PolarHBondContact O-OG 3.2Å; S197-S201 VanDerWaalsContact O-OG 3.05Å
198N57.6Low64.4Low111 Ų111112.4 Ų112.459%0.59464%0.637SS**Hα-helixtrans-71.2-35.7-178.6-73.4-21.3000113.3S202N198-S202 WeakPolarHBondContact O-CB 3.42Å; N198-S202 PolarHBondContact O-N 3.35Å; N198-S202 PolarHBondContact O-OG 3.42Å
199I64.8Low65.6Low112 Ų112112.2 Ų112.257%0.57462%0.616SS**Hα-helixtrans-67.3-45175-62.9168.7000109.3S201 S202 T203I199-S201 VanDerWaalsContact C-N 3.31Å; I199-S201 PolarHBondContact O-N 3.05Å; I199-S202 PolarHBondContact O-N 3.15Å; I199-T203 PolarHBondContact O-N 3.4Å; I199-T203 PolarHBondContact O-OG1 2.98Å
200S69.2Low66.9Low61 Ų61113.3 Ų113.343%0.42760%0.599SS.*Hα-helixtrans-61.5-39178.3-56.60000112.4Q196 S197 R204Q196-S200 WeakPolarHBondContact O-CB 3.5Å; Q196-S200 PolarHBondContact O-N 3.04Å; Q196-S200 PolarHBondContact O-OG 3.5Å; S197-S200 PolarHBondContact O-N 2.71Å; S200-R204 WeakPolarHBondContact O-CB 3.48Å; S200-R204 VanDerWaalsContact O-CG 3.27Å; S200-R204 WeakPolarHBondContact O-CG 3.33Å; S200-R204 PolarHBondContact O-N 2.9Å
201S70.3Confident68.2Low73 Ų73113 Ų11351%0.5159%0.592SS.*Hα-helixtrans-67.2-42.9175.3-62.30000112.3S197 I199 R204 L205S197-S201 PolarHBondContact O-N 3.09Å; S197-S201 PolarHBondContact O-OG 3.2Å; S197-S201 VanDerWaalsContact O-OG 3.05Å; I199-S201 VanDerWaalsContact C-N 3.31Å; I199-S201 PolarHBondContact O-N 3.05Å; S201-R204 PolarHBondContact O-N 3.45Å; S201-L205 WeakPolarHBondContact O-CB 3.32Å; S201-L205 PolarHBondContact O-N 3.34Å
202S74.6Confident69.6Low68 Ų68109.3 Ų109.348%0.47657%0.573SS.*Hα-helixtrans-64.7-44.8178.4-55.80000111.2N198 I199 R204 L205 L206N198-S202 WeakPolarHBondContact O-CB 3.42Å; N198-S202 PolarHBondContact O-N 3.35Å; N198-S202 PolarHBondContact O-OG 3.42Å; I199-S202 PolarHBondContact O-N 3.15Å; S202-R204 VanDerWaalsContact C-N 3.34Å; S202-R204 PolarHBondContact O-N 3Å; S202-L205 PolarHBondContact O-N 2.91Å; S202-L206 WeakPolarHBondContact O-CB 3.38Å; S202-L206 VanDerWaalsContact O-CG 3.25Å; S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 2.85Å
203T79.3Confident71.1Confident73 Ų73105.4 Ų105.445%0.44856%0.56SS.*Hα-helixtrans-65.7-37177.7-40.70000111.8I199 L207I199-T203 PolarHBondContact O-N 3.4Å; I199-T203 PolarHBondContact O-OG1 2.98Å; T203-L207 VanDerWaalsContact O-CG 3.28Å; T203-L207 WeakPolarHBondContact O-CG 3.25Å; T203-L207 PolarHBondContact O-N 2.96Å
204R73.4Confident72.6Confident193 Ų193105.7 Ų105.773%0.72855%0.549SS*.Hα-helixtrans-68.2-40.3175.2-79.6-179.3164.2179.4-3.7112.8S200 S201 S202 L207 D208S200-R204 WeakPolarHBondContact O-CB 3.48Å; S200-R204 VanDerWaalsContact O-CG 3.27Å; S200-R204 WeakPolarHBondContact O-CG 3.33Å; S200-R204 PolarHBondContact O-N 2.9Å; S201-R204 PolarHBondContact O-N 3.45Å; S202-R204 VanDerWaalsContact C-N 3.34Å; S202-R204 PolarHBondContact O-N 3Å; R204-L207 PolarHBondContact O-N 2.95Å; R204-D208 WeakPolarHBondContact O-CB 3.23Å; R204-D208 PolarHBondContact O-N 2.92Å
205L78.5Confident73.6Confident110 Ų110112.2 Ų112.258%0.57656%0.556SS**Hα-helixtrans-64.1-43.3176.3-164.5159.9000110.3S201 S202 L207 D208 E209S201-L205 WeakPolarHBondContact O-CB 3.32Å; S201-L205 PolarHBondContact O-N 3.34Å; S202-L205 PolarHBondContact O-N 2.91Å; L205-L207 PolarHBondContact O-N 2.94Å; L205-D208 PolarHBondContact O-N 3.49Å; L205-E209 WeakPolarHBondContact O-CB 3.44Å; L205-E209 PolarHBondContact O-N 3.43Å
206L81.6Confident75Confident109 Ų109107.7 Ų107.757%0.57154%0.537SS*.Hα-helixtrans-63.8-38.1176.6-69.8171.7000112.9S202 Q210S202-L206 WeakPolarHBondContact O-CB 3.38Å; S202-L206 VanDerWaalsContact O-CG 3.25Å; S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 2.85Å; L206-Q210 WeakPolarHBondContact O-CB 3.4Å; L206-Q210 PolarHBondContact O-N 3.43Å
207L81.4Confident76.6Confident107 Ų107105 Ų10556%0.5653%0.527SS*.Hα-helixtrans-69.3-42.4176.2-71.5172.2000112.2T203 R204 L205 E209 Q210 E211T203-L207 VanDerWaalsContact O-CG 3.28Å; T203-L207 WeakPolarHBondContact O-CG 3.25Å; T203-L207 PolarHBondContact O-N 2.96Å; R204-L207 PolarHBondContact O-N 2.95Å; L205-L207 PolarHBondContact O-N 2.94Å; L207-E209 VanDerWaalsContact C-N 3.34Å; L207-Q210 PolarHBondContact O-N 2.9Å; L207-E211 PolarHBondContact O-N 3.17Å
208D82.4Confident77.9Confident74 Ų74111.6 Ų111.640%0.39654%0.543SS..Hα-helixtrans-63.6-39.5173.9179.256.7000111.5R204 L205 Q210 E211 K212R204-D208 WeakPolarHBondContact O-CB 3.23Å; R204-D208 PolarHBondContact O-N 2.92Å; L205-D208 PolarHBondContact O-N 3.49Å; D208-Q210 VanDerWaalsContact C-N 3.33Å; D208-Q210 PolarHBondContact O-N 3.32Å; D208-E211 PolarHBondContact O-N 3.31Å; D208-K212 WeakPolarHBondContact O-CG 3.45Å; D208-K212 PolarHBondContact O-N 3.21Å; D208-K212 IonicContact OD1-NZ 3.98Å; D208-K212 WeakPolarHBondContact OD2-CE 3.44Å; D208-K212 IonicContact OD2-NZ 2.67Å; D208-K212 PolarHBondContact OD2-NZ 3.34Å
209E75.7Confident79.2Confident73 Ų73110.1 Ų110.134%0.34153%0.534SS..Hα-helixtrans-62.1-42173.5-152.9-170.8153.700110.9L205 L207 E211 K212 Y213L205-E209 WeakPolarHBondContact O-CB 3.44Å; L205-E209 PolarHBondContact O-N 3.43Å; L207-E209 VanDerWaalsContact C-N 3.34Å; E209-E211 PolarHBondContact O-N 3.41Å; E209-K212 WeakPolarHBondContact O-CB 3.2Å; E209-K212 PolarHBondContact O-N 3.01Å; E209-Y213 HydrophobicContact CB-CE2 4.37Å; E209-Y213 HydrophobicContact CG-CD2 4.13Å; E209-Y213 HydrophobicContact CG-CE2 3.5Å; E209-Y213 WeakPolarHBondContact O-CD2 3.34Å; E209-Y213 PolarHBondContact O-N 3.47Å; E209-Y213 WeakPolarHBondContact OE1-CE2 3.48Å; E209-Y213 PolarHBondContact OE1-OH 3.04Å
210Q82.6Confident80.2Confident105 Ų105109.7 Ų109.749%0.49153%0.533SS..Hα-helixtrans-63.6-40177.4-145.7-164.5-2.500112.5L206 L207 D208 Y213 H214L206-Q210 WeakPolarHBondContact O-CB 3.4Å; L206-Q210 PolarHBondContact O-N 3.43Å; L207-Q210 PolarHBondContact O-N 2.9Å; D208-Q210 VanDerWaalsContact C-N 3.33Å; D208-Q210 PolarHBondContact O-N 3.32Å; Q210-Y213 PolarHBondContact O-N 3.25Å; Q210-H214 PolarHBondContact O-CD2 3.42Å; Q210-H214 PolarHBondContact O-N 3.42Å
211E82Confident81.2Confident143 Ų143111.1 Ų111.167%0.66854%0.536SS*.Hα-helixtrans-64.5-40.4175.4-169.6174.8174.100111.6L207 D208 E209 H214 R215L207-E211 PolarHBondContact O-N 3.17Å; D208-E211 PolarHBondContact O-N 3.31Å; E209-E211 PolarHBondContact O-N 3.41Å; E211-H214 PolarHBondContact O-N 3.35Å; E211-R215 WeakPolarHBondContact O-CB 3.42Å; E211-R215 PolarHBondContact O-N 3Å
212K81.6Confident82.1Confident129 Ų129114 Ų11456%0.56154%0.541SS*.Hα-helixtrans-62.1-41.8173.4-71.5171.6-171.6164.50112.2D208 E209 R215 S216D208-K212 WeakPolarHBondContact O-CG 3.45Å; D208-K212 PolarHBondContact O-N 3.21Å; D208-K212 IonicContact OD1-NZ 3.98Å; D208-K212 WeakPolarHBondContact OD2-CE 3.44Å; D208-K212 IonicContact OD2-NZ 2.67Å; D208-K212 PolarHBondContact OD2-NZ 3.34Å; E209-K212 WeakPolarHBondContact O-CB 3.2Å; E209-K212 PolarHBondContact O-N 3.01Å; K212-R215 PolarHBondContact O-N 3.48Å; K212-S216 WeakPolarHBondContact O-CB 3.37Å; K212-S216 PolarHBondContact O-N 3.12Å
213Y80.5Confident82.7Confident144 Ų144116.8 Ų116.857%0.56555%0.546SS*.Hα-helixtrans-61.9-43.9174-75.9-66.6000111.8E209 Q210 R215 S216 N217E209-Y213 HydrophobicContact CB-CE2 4.37Å; E209-Y213 HydrophobicContact CG-CD2 4.13Å; E209-Y213 HydrophobicContact CG-CE2 3.5Å; E209-Y213 WeakPolarHBondContact O-CD2 3.34Å; E209-Y213 PolarHBondContact O-N 3.47Å; E209-Y213 WeakPolarHBondContact OE1-CE2 3.48Å; E209-Y213 PolarHBondContact OE1-OH 3.04Å; Q210-Y213 PolarHBondContact O-N 3.25Å; Y213-R215 PolarHBondContact O-N 2.9Å; Y213-S216 PolarHBondContact O-N 3.18Å; Y213-N217 WeakPolarHBondContact O-CB 2.93Å; Y213-N217 PolarHBondContact O-N 2.92Å
214H87Confident83Confident115 Ų115119.4 Ų119.453%0.53256%0.557SS.*Hα-helixtrans-64.8-39.2178-77.7-59.8000112.7Q210 E211 N217 R218Q210-H214 PolarHBondContact O-CD2 3.42Å; Q210-H214 PolarHBondContact O-N 3.42Å; E211-H214 PolarHBondContact O-N 3.35Å; H214-N217 PolarHBondContact O-N 3.21Å; H214-R218 PolarHBondContact O-N 2.94Å
215R77.6Confident83.8Confident191 Ų191112.8 Ų112.872%0.72154%0.543SS*.Hα-helixtrans-65.5-43.5174.3-171174.8-177.6174.40.1111.5E211 K212 Y213 N217 R218 L219E211-R215 WeakPolarHBondContact O-CB 3.42Å; E211-R215 PolarHBondContact O-N 3Å; K212-R215 PolarHBondContact O-N 3.48Å; Y213-R215 PolarHBondContact O-N 2.9Å; R215-N217 VanDerWaalsContact C-N 3.33Å; R215-N217 PolarHBondContact O-N 2.89Å; R215-R218 PolarHBondContact O-N 3.08Å; R215-L219 HydrophobicContact CG-CD1 4.35Å; R215-L219 WeakPolarHBondContact O-CG 3.45Å; R215-L219 PolarHBondContact O-N 3.33Å; R215-L219 VanDerWaalsContact O-N 3.1Å
216S82.5Confident84.2Confident57 Ų57109.7 Ų109.740%0.39953%0.534SS..Hα-helixtrans-61.6-41.8175.8-1790000111.6K212 Y213 R218 L219 L220K212-S216 WeakPolarHBondContact O-CB 3.37Å; K212-S216 PolarHBondContact O-N 3.12Å; Y213-S216 PolarHBondContact O-N 3.18Å; S216-R218 PolarHBondContact O-N 3.44Å; S216-L219 PolarHBondContact O-N 2.95Å; S216-L220 WeakPolarHBondContact O-CG 3.46Å; S216-L220 PolarHBondContact O-N 3.45Å
217N88.3Confident84.6Confident92 Ų92107.2 Ų107.249%0.49253%0.529SS..Hα-helixtrans-63.3-44-180-157.568.1000112Y213 H214 R215 L219 L220 D221Y213-N217 WeakPolarHBondContact O-CB 2.93Å; Y213-N217 PolarHBondContact O-N 2.92Å; H214-N217 PolarHBondContact O-N 3.21Å; R215-N217 VanDerWaalsContact C-N 3.33Å; R215-N217 PolarHBondContact O-N 2.89Å; N217-L219 VanDerWaalsContact C-N 3.34Å; N217-L219 PolarHBondContact O-N 3.42Å; N217-L220 PolarHBondContact O-N 3.4Å; N217-D221 PolarHBondContact O-N 3.42Å
218R84.7Confident84.9Confident204 Ų204105.4 Ų105.477%0.7753%0.525SS*.Hα-helixtrans-62.3-39.5174.9-76.1-177.1166174.8-2.7112.8H214 R215 S216 D221 E222H214-R218 PolarHBondContact O-N 2.94Å; R215-R218 PolarHBondContact O-N 3.08Å; S216-R218 PolarHBondContact O-N 3.44Å; R218-D221 PolarHBondContact O-N 3.47Å; R218-E222 PolarHBondContact O-N 3.47Å; R218-E222 VanDerWaalsContact O-N 3.14Å
219L84.3Confident85.2Confident80 Ų80106.4 Ų106.442%0.41953%0.534SS..Hα-helixtrans-66.8-41.1176-70.7170.8000111.5R215 S216 N217 D221 E222 H223R215-L219 HydrophobicContact CG-CD1 4.35Å; R215-L219 WeakPolarHBondContact O-CG 3.45Å; R215-L219 PolarHBondContact O-N 3.33Å; R215-L219 VanDerWaalsContact O-N 3.1Å; S216-L219 PolarHBondContact O-N 2.95Å; N217-L219 VanDerWaalsContact C-N 3.34Å; N217-L219 PolarHBondContact O-N 3.42Å; L219-D221 VanDerWaalsContact C-N 3.3Å; L219-D221 PolarHBondContact O-N 3.26Å; L219-E222 PolarHBondContact O-N 2.67Å; L219-H223 PolarHBondContact O-CD2 3.47Å; L219-H223 PolarHBondContact O-N 2.66Å
220L86.2Confident85.8Confident102 Ų102107.7 Ų107.753%0.53454%0.542SS..Hα-helixtrans-61.4-39.4175.3-72.1174.1000111.6S216 N217 H223 L224S216-L220 WeakPolarHBondContact O-CG 3.46Å; S216-L220 PolarHBondContact O-N 3.45Å; N217-L220 PolarHBondContact O-N 3.4Å; L220-H223 PolarHBondContact O-N 2.87Å; L220-L224 WeakPolarHBondContact O-CB 3.34Å; L220-L224 PolarHBondContact O-N 3.5Å
221D91.3Very high86.3Confident92 Ų92111.4 Ų111.449%0.49255%0.552SS.*Hα-helixtrans-63.2-42.1175.6-68.8-35.8000111.7N217 R218 L219 L224 A225N217-D221 PolarHBondContact O-N 3.42Å; R218-D221 PolarHBondContact O-N 3.47Å; L219-D221 VanDerWaalsContact C-N 3.3Å; L219-D221 PolarHBondContact O-N 3.26Å; D221-L224 PolarHBondContact O-N 2.87Å; D221-A225 WeakPolarHBondContact O-CB 3.44Å; D221-A225 PolarHBondContact O-N 3.21Å
222E88.4Confident86.7Confident133 Ų133107.6 Ų107.662%0.62154%0.544SS*.Hα-helixtrans-64-44175.1-173.4175.2179.300111.8R218 L219 L224 A225 A226R218-E222 PolarHBondContact O-N 3.47Å; R218-E222 VanDerWaalsContact O-N 3.14Å; L219-E222 PolarHBondContact O-N 2.67Å; E222-L224 VanDerWaalsContact C-N 3.34Å; E222-L224 PolarHBondContact O-N 3.36Å; E222-A225 PolarHBondContact O-N 2.88Å; E222-A226 WeakPolarHBondContact O-CB 3.46Å; E222-A226 PolarHBondContact O-N 2.8Å
223H88.2Confident86.9Confident126 Ų126103.9 Ų103.958%0.58354%0.538SS*.Hα-helixtrans-64.6-37.2175-72.1-59.7000112.4L219 L220 A227L219-H223 PolarHBondContact O-CD2 3.47Å; L219-H223 PolarHBondContact O-N 2.66Å; L220-H223 PolarHBondContact O-N 2.87Å; H223-A227 WeakPolarHBondContact O-CB 3.02Å; H223-A227 PolarHBondContact O-N 2.93Å
224L85.2Confident87.4Confident129 Ų129101.8 Ų101.868%0.67554%0.536SS*.Hα-helixtrans-67.6-41.4177-157.1100.2000110.8L220 D221 E222 A227 S228L220-L224 WeakPolarHBondContact O-CB 3.34Å; L220-L224 PolarHBondContact O-N 3.5Å; D221-L224 PolarHBondContact O-N 2.87Å; E222-L224 VanDerWaalsContact C-N 3.34Å; E222-L224 PolarHBondContact O-N 3.36Å; L224-A227 PolarHBondContact O-N 3.45Å; L224-S228 WeakPolarHBondContact O-CB 3.39Å; L224-S228 PolarHBondContact O-N 3.44Å
225A89.9Confident87.6Confident53 Ų53105.2 Ų105.244%0.43854%0.544SS..Hα-helixtrans-63.2-47.5175.200000111.4D221 E222 S228 T229D221-A225 WeakPolarHBondContact O-CB 3.44Å; D221-A225 PolarHBondContact O-N 3.21Å; E222-A225 PolarHBondContact O-N 2.88Å; A225-S228 PolarHBondContact O-N 2.97Å; A225-S228 PolarHBondContact O-OG 3.32Å; A225-T229 PolarHBondContact O-N 3.39Å; A225-T229 VanDerWaalsContact O-N 3.09Å; A225-T229 PolarHBondContact O-OG1 2.81Å
226A87.2Confident88Confident46 Ų4699.1 Ų99.138%0.3854%0.535SS..Hα-helixtrans-61.4-45.2175.100000111.8E222 S228 T229 I230E222-A226 WeakPolarHBondContact O-CB 3.46Å; E222-A226 PolarHBondContact O-N 2.8Å; A226-S228 VanDerWaalsContact C-N 3.34Å; A226-S228 PolarHBondContact O-N 3.47Å; A226-T229 PolarHBondContact O-N 2.88Å; A226-I230 VanDerWaalsContact O-CG1 3.32Å; A226-I230 WeakPolarHBondContact O-CG1 3.4Å; A226-I230 PolarHBondContact O-N 3.19Å
227A90Very high88.4Confident57 Ų57101.9 Ų101.947%0.47154%0.541SS..Hα-helixtrans-63.1-38.9177.800000112.2H223 L224 T229 R231H223-A227 WeakPolarHBondContact O-CB 3.02Å; H223-A227 PolarHBondContact O-N 2.93Å; L224-A227 PolarHBondContact O-N 3.45Å; A227-T229 VanDerWaalsContact C-N 3.33Å; A227-R231 WeakPolarHBondContact O-CB 3.5Å; A227-R231 PolarHBondContact O-N 3.06Å
228S88Confident88.6Confident69 Ų69105.9 Ų105.948%0.48355%0.55SS..Hα-helixtrans-64.4-39.5176.377.70000111.8L224 A225 A226 R231 A232L224-S228 WeakPolarHBondContact O-CB 3.39Å; L224-S228 PolarHBondContact O-N 3.44Å; A225-S228 PolarHBondContact O-N 2.97Å; A225-S228 PolarHBondContact O-OG 3.32Å; A226-S228 VanDerWaalsContact C-N 3.34Å; A226-S228 PolarHBondContact O-N 3.47Å; S228-R231 PolarHBondContact O-N 2.92Å; S228-A232 WeakPolarHBondContact O-CB 3.42Å; S228-A232 PolarHBondContact O-N 3.31Å
229T87Confident88.8Confident94 Ų94103.3 Ų103.358%0.57754%0.544SS*.Hα-helixtrans-68.1-46.3178-55.40000111.2A225 A226 A227 R231 A232 A233A225-T229 PolarHBondContact O-N 3.39Å; A225-T229 VanDerWaalsContact O-N 3.09Å; A225-T229 PolarHBondContact O-OG1 2.81Å; A226-T229 PolarHBondContact O-N 2.88Å; A227-T229 VanDerWaalsContact C-N 3.33Å; T229-R231 VanDerWaalsContact C-N 3.32Å; T229-R231 PolarHBondContact O-N 3.41Å; T229-A232 PolarHBondContact O-N 2.97Å; T229-A233 PolarHBondContact O-N 3.24Å
230I89.7Confident88.6Confident101 Ų101102.3 Ų102.352%0.51855%0.547SS..Hα-helixtrans-61.8-42.4175.4-66.6165.4000110.2A226 A232 A233 L234A226-I230 VanDerWaalsContact O-CG1 3.32Å; A226-I230 WeakPolarHBondContact O-CG1 3.4Å; A226-I230 PolarHBondContact O-N 3.19Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 3.26Å; I230-A233 PolarHBondContact O-N 2.64Å; I230-L234 HydrophobicContact CG2-CD1 3.77Å; I230-L234 HydrophobicContact CG2-CG 4.13Å; I230-L234 WeakPolarHBondContact O-CB 3.46Å; I230-L234 VanDerWaalsContact O-CG 3.31Å; I230-L234 WeakPolarHBondContact O-CG 3.34Å; I230-L234 PolarHBondContact O-N 3.26Å
231R93.2Very high88.8Confident183 Ų183102.1 Ų102.169%0.69155%0.546SS*.Hα-helixtrans-61.4-41.1176.2-179.1175.9176.4158-1.6111.8A227 S228 T229 R235A227-R231 WeakPolarHBondContact O-CB 3.5Å; A227-R231 PolarHBondContact O-N 3.06Å; S228-R231 PolarHBondContact O-N 2.92Å; T229-R231 VanDerWaalsContact C-N 3.32Å; T229-R231 PolarHBondContact O-N 3.41Å; R231-R235 VanDerWaalsContact O-CB 3.29Å; R231-R235 WeakPolarHBondContact O-CB 3.45Å; R231-R235 PolarHBondContact O-N 3.25Å
232A89.1Confident88.7Confident62 Ų62105.7 Ų105.751%0.51255%0.553SS.*Hα-helixtrans-63.7-46.8175.400000111.4S228 T229 I230 R235 A236S228-A232 WeakPolarHBondContact O-CB 3.42Å; S228-A232 PolarHBondContact O-N 3.31Å; T229-A232 PolarHBondContact O-N 2.97Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 3.26Å; A232-R235 PolarHBondContact O-N 3.08Å; A232-A236 PolarHBondContact O-N 3.44Å
233A85.6Confident88.5Confident51 Ų51103 Ų10342%0.42155%0.546SS..Hα-helixtrans-62-46177.500000112.5T229 I230 R235 A236 Q237T229-A233 PolarHBondContact O-N 3.24Å; I230-A233 PolarHBondContact O-N 2.64Å; A233-R235 VanDerWaalsContact C-N 3.32Å; A233-R235 PolarHBondContact O-N 2.78Å; A233-A236 PolarHBondContact O-N 2.95Å; A233-Q237 WeakPolarHBondContact O-CG 3.47Å; A233-Q237 PolarHBondContact O-N 3.3Å
234L91.1Very high88.4Confident101 Ų10199.8 Ų99.853%0.52954%0.541SS..Hα-helixtrans-63.9-36176.3-73175.7000112I230 Q237 R238I230-L234 HydrophobicContact CG2-CD1 3.77Å; I230-L234 HydrophobicContact CG2-CG 4.13Å; I230-L234 WeakPolarHBondContact O-CB 3.46Å; I230-L234 VanDerWaalsContact O-CG 3.31Å; I230-L234 WeakPolarHBondContact O-CG 3.34Å; I230-L234 PolarHBondContact O-N 3.26Å; L234-Q237 PolarHBondContact O-N 3.26Å; L234-R238 VanDerWaalsContact O-CB 3.3Å; L234-R238 WeakPolarHBondContact O-CB 3.45Å; L234-R238 PolarHBondContact O-N 3.26Å
235R91Very high88.4Confident186 Ų18696.8 Ų96.870%0.70253%0.531SS*.Hα-helixtrans-67.1-42.3176.1-167.5-179.3-176.1100.3-4.1111.4R231 A232 A233 R238 F239R231-R235 VanDerWaalsContact O-CB 3.29Å; R231-R235 WeakPolarHBondContact O-CB 3.45Å; R231-R235 PolarHBondContact O-N 3.25Å; A232-R235 PolarHBondContact O-N 3.08Å; A233-R235 VanDerWaalsContact C-N 3.32Å; A233-R235 PolarHBondContact O-N 2.78Å; R235-R238 PolarHBondContact O-N 3.2Å; R235-F239 PolarHBondContact O-N 2.9Å
236A88.1Confident88Confident63 Ų6398.2 Ų98.252%0.52153%0.534SS..Hα-helixtrans-63.1-45174.200000111.6A232 A233 R238 F239 A240A232-A236 PolarHBondContact O-N 3.44Å; A233-A236 PolarHBondContact O-N 2.95Å; A236-R238 PolarHBondContact O-N 3.46Å; A236-F239 WeakPolarHBondContact O-CB 3.37Å; A236-F239 PolarHBondContact O-N 3.41Å; A236-A240 PolarHBondContact O-N 2.89Å
237Q90.2Very high88Confident115 Ų11597.8 Ų97.854%0.53753%0.534SS..Hα-helixtrans-61.5-42.1174.4-74-179.66.300112A233 L234 F239 A240 L241A233-Q237 WeakPolarHBondContact O-CG 3.47Å; A233-Q237 PolarHBondContact O-N 3.3Å; L234-Q237 PolarHBondContact O-N 3.26Å; Q237-F239 VanDerWaalsContact C-N 3.29Å; Q237-F239 PolarHBondContact O-N 3.44Å; Q237-A240 PolarHBondContact O-N 3.4Å; Q237-L241 WeakPolarHBondContact O-CB 3.42Å; Q237-L241 VanDerWaalsContact O-CG 3.3Å; Q237-L241 WeakPolarHBondContact O-CG 3.03Å; Q237-L241 PolarHBondContact O-N 2.99Å
238R91.3Very high87.7Confident177 Ų177100.4 Ų100.467%0.66854%0.54SS*.Hα-helixtrans-63.1-36.9177-169.7173.3-172.7162.81.8111.7L234 R235 A236 R242L234-R238 VanDerWaalsContact O-CB 3.3Å; L234-R238 WeakPolarHBondContact O-CB 3.45Å; L234-R238 PolarHBondContact O-N 3.26Å; R235-R238 PolarHBondContact O-N 3.2Å; A236-R238 PolarHBondContact O-N 3.46Å; R238-R242 WeakPolarHBondContact O-CB 3.47Å; R238-R242 VanDerWaalsContact O-CG 3.25Å; R238-R242 WeakPolarHBondContact O-CG 3.4Å; R238-R242 PolarHBondContact O-N 3.01Å
239F88.7Confident87.3Confident150 Ų150100.6 Ų100.666%0.65854%0.541SS*.Hα-helixtrans-64.6-49.2173.3-177.3-98.3000111.2R235 A236 Q237 L241 R242 T243R235-F239 PolarHBondContact O-N 2.9Å; A236-F239 WeakPolarHBondContact O-CB 3.37Å; A236-F239 PolarHBondContact O-N 3.41Å; Q237-F239 VanDerWaalsContact C-N 3.29Å; Q237-F239 PolarHBondContact O-N 3.44Å; F239-L241 VanDerWaalsContact C-N 3.32Å; F239-L241 PolarHBondContact O-N 3.17Å; F239-R242 PolarHBondContact O-N 3.31Å; F239-R242 VanDerWaalsContact O-N 3.1Å; F239-T243 PolarHBondContact O-N 3.5Å; F239-T243 PolarHBondContact O-OG1 3.49Å
240A81.8Confident86.7Confident58 Ų5899.2 Ų99.248%0.47954%0.535SS..Hα-helixtrans-58.7-41.6176.100000112.6A236 Q237 T243 A244A236-A240 PolarHBondContact O-N 2.89Å; Q237-A240 PolarHBondContact O-N 3.4Å; A240-T243 PolarHBondContact O-N 3.09Å; A240-A244 WeakPolarHBondContact O-CB 3.5Å; A240-A244 PolarHBondContact O-N 3.27Å
241L90.3Very high85.8Confident98 Ų9898.7 Ų98.751%0.51353%0.533SS..Hα-helixtrans-66.9-36175.3-72.7175.2000112.3Q237 F239 A244 S245Q237-L241 WeakPolarHBondContact O-CB 3.42Å; Q237-L241 VanDerWaalsContact O-CG 3.3Å; Q237-L241 WeakPolarHBondContact O-CG 3.03Å; Q237-L241 PolarHBondContact O-N 2.99Å; F239-L241 VanDerWaalsContact C-N 3.32Å; F239-L241 PolarHBondContact O-N 3.17Å; L241-A244 PolarHBondContact O-N 3.37Å; L241-S245 VanDerWaalsContact O-CB 3.26Å; L241-S245 WeakPolarHBondContact O-CB 3.08Å; L241-S245 PolarHBondContact O-N 3.04Å; L241-S245 PolarHBondContact O-OG 2.94Å
242R87.7Confident84.9Confident167 Ų16793.7 Ų93.763%0.6353%0.526SS*.Hα-helixtrans-64.8-44.5173.7-75.2178.393.61597110.6R238 F239 A244 S245 T246R238-R242 WeakPolarHBondContact O-CB 3.47Å; R238-R242 VanDerWaalsContact O-CG 3.25Å; R238-R242 WeakPolarHBondContact O-CG 3.4Å; R238-R242 PolarHBondContact O-N 3.01Å; F239-R242 PolarHBondContact O-N 3.31Å; F239-R242 VanDerWaalsContact O-N 3.1Å; R242-A244 PolarHBondContact O-N 3.11Å; R242-S245 WeakPolarHBondContact CA-OG 3.35Å; R242-S245 PolarHBondContact O-N 2.98Å; R242-S245 PolarHBondContact O-OG 3.03Å; R242-T246 PolarHBondContact O-N 3.03Å; R242-T246 PolarHBondContact O-OG1 3.2Å
243T86Confident84Confident77 Ų7794.3 Ų94.347%0.47253%0.527SS..Hα-helixtrans-61.1-44.3174.5-53.40000111.9F239 A240 S245 T246 G247F239-T243 PolarHBondContact O-N 3.5Å; F239-T243 PolarHBondContact O-OG1 3.49Å; A240-T243 PolarHBondContact O-N 3.09Å; T243-S245 VanDerWaalsContact C-N 3.34Å; T243-S245 PolarHBondContact O-N 2.89Å; T243-T246 WeakPolarHBondContact CA-OG1 3.35Å; T243-T246 PolarHBondContact O-N 3.3Å; T243-T246 PolarHBondContact O-OG1 3.4Å; T243-G247 PolarHBondContact O-N 3.49Å
244A84.3Confident83.2Confident59 Ų5999 Ų9949%0.48853%0.533SS..Hα-helixtrans-63.5-39.5174.600000111.9A240 L241 R242 G247 L248A240-A244 WeakPolarHBondContact O-CB 3.5Å; A240-A244 PolarHBondContact O-N 3.27Å; L241-A244 PolarHBondContact O-N 3.37Å; R242-A244 PolarHBondContact O-N 3.11Å; A244-G247 CarbonylContact O-C 3.6Å; A244-G247 PolarHBondContact O-N 3Å; A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 PolarHBondContact O-N 3.18Å
245S85.4Confident82Confident65 Ų6599.6 Ų99.646%0.45553%0.532SS..Hα-helixtrans-66.7-37.1177.275.50000112.1L241 R242 T243 L248 S249L241-S245 VanDerWaalsContact O-CB 3.26Å; L241-S245 WeakPolarHBondContact O-CB 3.08Å; L241-S245 PolarHBondContact O-N 3.04Å; L241-S245 PolarHBondContact O-OG 2.94Å; R242-S245 WeakPolarHBondContact CA-OG 3.35Å; R242-S245 PolarHBondContact O-N 2.98Å; R242-S245 PolarHBondContact O-OG 3.03Å; T243-S245 VanDerWaalsContact C-N 3.34Å; T243-S245 PolarHBondContact O-N 2.89Å; S245-L248 PolarHBondContact O-N 3.42Å; S245-S249 WeakPolarHBondContact O-CB 3.45Å; S245-S249 PolarHBondContact O-N 2.86Å
246T83.2Confident80.8Confident84 Ų8494.4 Ų94.452%0.51552%0.522SS..Hα-helixtrans-66.5-39.9173.347.50000111R242 T243 L248 S249 S250R242-T246 PolarHBondContact O-N 3.03Å; R242-T246 PolarHBondContact O-OG1 3.2Å; T243-T246 WeakPolarHBondContact CA-OG1 3.35Å; T243-T246 PolarHBondContact O-N 3.3Å; T243-T246 PolarHBondContact O-OG1 3.4Å; T246-L248 PolarHBondContact O-N 3.3Å; T246-S249 WeakPolarHBondContact CA-OG 3.41Å; T246-S249 PolarHBondContact O-N 3.09Å; T246-S249 PolarHBondContact O-OG 3.33Å; T246-S250 PolarHBondContact O-N 2.78Å
247G86.1Confident79.7Confident37 Ų3796.3 Ų96.338%0.38152%0.52SS..Hα-helixtrans-64.4-36.417200000113.4T243 A244 S250 L251T243-G247 PolarHBondContact O-N 3.49Å; A244-G247 CarbonylContact O-C 3.6Å; A244-G247 PolarHBondContact O-N 3Å; G247-S250 PolarHBondContact O-N 2.64Å; G247-S250 PolarHBondContact O-OG 3.28Å; G247-L251 PolarHBondContact O-N 3.04Å
248L83Confident78.4Confident112 Ų11294.6 Ų94.659%0.58652%0.517SS*.Hα-helixtrans-70.2-36.6175.1-174.962.1000111.8A244 S245 T246 S250 L251 S252A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 PolarHBondContact O-N 3.18Å; S245-L248 PolarHBondContact O-N 3.42Å; T246-L248 PolarHBondContact O-N 3.3Å; L248-S250 VanDerWaalsContact C-N 3.35Å; L248-L251 HydrophobicContact CD1-CD2 4.36Å; L248-L251 PolarHBondContact O-N 2.93Å; L248-S252 PolarHBondContact O-N 3.09Å
249S79.5Confident76.8Confident73 Ų7393.2 Ų93.251%0.5152%0.516SS..Hα-helixtrans-66.2-36.8175.6730000112.1S245 T246 S252 S253S245-S249 WeakPolarHBondContact O-CB 3.45Å; S245-S249 PolarHBondContact O-N 2.86Å; T246-S249 WeakPolarHBondContact CA-OG 3.41Å; T246-S249 PolarHBondContact O-N 3.09Å; T246-S249 PolarHBondContact O-OG 3.33Å; S249-S252 WeakPolarHBondContact O-CB 3.2Å; S249-S252 PolarHBondContact O-N 3.44Å; S249-S253 PolarHBondContact O-N 3.27Å; S249-S253 VanDerWaalsContact O-N 3.12Å
250S75.6Confident75.6Confident64 Ų6494.4 Ų94.445%0.44852%0.521SS..Hα-helixtrans-69-36.3173.1670000111.3T246 G247 L248 S253 R254T246-S250 PolarHBondContact O-N 2.78Å; G247-S250 PolarHBondContact O-N 2.64Å; G247-S250 PolarHBondContact O-OG 3.28Å; L248-S250 VanDerWaalsContact C-N 3.35Å; S250-S253 PolarHBondContact O-N 2.91Å; S250-S253 PolarHBondContact O-OG 3.27Å; S250-R254 VanDerWaalsContact O-CG 3.27Å; S250-R254 WeakPolarHBondContact O-CG 3.37Å; S250-R254 PolarHBondContact O-N 3.1Å
251L70.7Confident74.8Confident91 Ų9197.4 Ų97.448%0.47653%0.529SS..Hα-helixtrans-65.4-37.7171.4-171.863000112.5G247 L248 S253 R254 F255G247-L251 PolarHBondContact O-N 3.04Å; L248-L251 HydrophobicContact CD1-CD2 4.36Å; L248-L251 PolarHBondContact O-N 2.93Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 3.47Å; L251-R254 WeakPolarHBondContact O-CA 3.31Å; L251-R254 WeakPolarHBondContact O-CB 3.43Å; L251-R254 PolarHBondContact O-N 3.44Å; L251-F255 HydrophobicContact CD2-CE2 4.21Å; L251-F255 HydrophobicContact CG-CD2 4.31Å; L251-F255 HydrophobicContact CG-CE2 3.93Å; L251-F255 WeakPolarHBondContact O-CD2 3.41Å; L251-F255 PolarHBondContact O-N 3.02Å
252S74.2Confident73.5Confident77 Ų7796.8 Ų96.854%0.53853%0.525SS..Hα-helixtrans-58.8-41.6174-1720000111.8L248 S249 R254 F255 P256L248-S252 PolarHBondContact O-N 3.09Å; S249-S252 WeakPolarHBondContact O-CB 3.2Å; S249-S252 PolarHBondContact O-N 3.44Å; S252-R254 PolarHBondContact O-N 3.06Å; S252-F255 PolarHBondContact O-N 2.8Å; S252-P256 VanDerWaalsContact O-CD 3.22Å; S252-P256 WeakPolarHBondContact O-CD 3.48Å
253S70.2Confident72.2Confident76 Ų7694.6 Ų94.653%0.53153%0.526SS..Hα-helixtrans-65.6-22.6174.678.10000113.7S249 S250 L251 P256S249-S253 PolarHBondContact O-N 3.27Å; S249-S253 VanDerWaalsContact O-N 3.12Å; S250-S253 PolarHBondContact O-N 2.91Å; S250-S253 PolarHBondContact O-OG 3.27Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 3.47Å; S253-P256 WeakPolarHBondContact O-CD 3.44Å; S253-P256 WeakPolarHBondContact O-CG 2.95Å
254R68.3Low71.1Confident148 Ų14898.5 Ų98.556%0.55854%0.536SS*.Hα-helixtrans-88-25.8178.6-60.6-84.3-178.4-1792112.8S250 L251 S252 Q257 V258S250-R254 VanDerWaalsContact O-CG 3.27Å; S250-R254 WeakPolarHBondContact O-CG 3.37Å; S250-R254 PolarHBondContact O-N 3.1Å; L251-R254 WeakPolarHBondContact O-CA 3.31Å; L251-R254 WeakPolarHBondContact O-CB 3.43Å; L251-R254 PolarHBondContact O-N 3.44Å; S252-R254 PolarHBondContact O-N 3.06Å; R254-Q257 WeakPolarHBondContact O-CA 3.43Å; R254-Q257 WeakPolarHBondContact O-CB 3.29Å; R254-Q257 PolarHBondContact O-N 3.18Å; R254-V258 PolarHBondContact O-N 3.34Å
255F67.2Low70Confident115 Ų115100.4 Ų100.450%0.50454%0.537SS..Hα-helixtrans-53.1-40176.6-92.4-72.1000115.4L251 S252 Q257 V258 K259L251-F255 HydrophobicContact CD2-CE2 4.21Å; L251-F255 HydrophobicContact CG-CD2 4.31Å; L251-F255 HydrophobicContact CG-CE2 3.93Å; L251-F255 WeakPolarHBondContact O-CD2 3.41Å; L251-F255 PolarHBondContact O-N 3.02Å; S252-F255 PolarHBondContact O-N 2.8Å; F255-Q257 VanDerWaalsContact C-N 3.3Å; F255-Q257 PolarHBondContact O-N 3.5Å; F255-V258 PolarHBondContact O-N 3.03Å; F255-K259 PolarHBondContact O-N 3.38Å
256P65.7Low69Low76 Ų76101.3 Ų101.349%0.49454%0.537SS..Hα-helixtrans-68.7-25.6175.223.1-31.4000113.5S252 S253 K260S252-P256 VanDerWaalsContact O-CD 3.22Å; S252-P256 WeakPolarHBondContact O-CD 3.48Å; S253-P256 WeakPolarHBondContact O-CD 3.44Å; S253-P256 WeakPolarHBondContact O-CG 2.95Å; P256-K260 PolarHBondContact O-N 3.42Å
257Q64.1Low68.1Low104 Ų104105.6 Ų105.649%0.48654%0.544SS..Hα-helixtrans-70.5-44.7170.4-63.1179.3-18.400109.9R254 F255 K259 K260 L261R254-Q257 WeakPolarHBondContact O-CA 3.43Å; R254-Q257 WeakPolarHBondContact O-CB 3.29Å; R254-Q257 PolarHBondContact O-N 3.18Å; F255-Q257 VanDerWaalsContact C-N 3.3Å; F255-Q257 PolarHBondContact O-N 3.5Å; Q257-K259 VanDerWaalsContact C-N 3.27Å; Q257-K259 PolarHBondContact O-N 3.34Å; Q257-K260 WeakPolarHBondContact O-CB 3.26Å; Q257-K260 PolarHBondContact O-N 2.93Å; Q257-L261 VanDerWaalsContact O-CD1 3.32Å; Q257-L261 WeakPolarHBondContact O-CD1 3.45Å; Q257-L261 PolarHBondContact O-N 3.39Å
258V63Low67.1Low78 Ų78112.1 Ų112.147%0.47356%0.557SS.*Hα-helixtrans-58.5-37.8173.5-179.90000111.4R254 F255 K260 L261 I262R254-V258 PolarHBondContact O-N 3.34Å; F255-V258 PolarHBondContact O-N 3.03Å; V258-K260 PolarHBondContact O-N 2.8Å; V258-L261 CarbonylContact O-C 3.57Å; V258-L261 PolarHBondContact O-N 2.98Å; V258-I262 PolarHBondContact O-N 3.01Å
259K57.5Low66.2Low149 Ų149112.6 Ų112.665%0.64856%0.556SS**Hα-helixtrans-65.2-33.1173.2-76.5-167.8176-1690113.8F255 Q257 I262 N263F255-K259 PolarHBondContact O-N 3.38Å; Q257-K259 VanDerWaalsContact C-N 3.27Å; Q257-K259 PolarHBondContact O-N 3.34Å; K259-I262 WeakPolarHBondContact O-CG2 3.43Å; K259-N263 PolarHBondContact O-N 3.36Å; K259-N263 VanDerWaalsContact O-N 3.08Å
260K63.8Low66.1Low174 Ų174115.4 Ų115.476%0.75756%0.559SS**Hα-helixtrans-69.1-36.1171.9-75.9-173.5178.2-179.20111.7P256 Q257 V258 K264P256-K260 PolarHBondContact O-N 3.42Å; Q257-K260 WeakPolarHBondContact O-CB 3.26Å; Q257-K260 PolarHBondContact O-N 2.93Å; V258-K260 PolarHBondContact O-N 2.8Å; K260-K264 WeakPolarHBondContact O-CB 3.45Å; K260-K264 PolarHBondContact O-N 3.38Å
261L65.4Low66.1Low122 Ų122116.2 Ų116.264%0.63956%0.556SS**Hα-helixtrans-70-39.8174.4-80.7124.4000112.1Q257 V258 K264 I265Q257-L261 VanDerWaalsContact O-CD1 3.32Å; Q257-L261 WeakPolarHBondContact O-CD1 3.45Å; Q257-L261 PolarHBondContact O-N 3.39Å; V258-L261 CarbonylContact O-C 3.57Å; V258-L261 PolarHBondContact O-N 2.98Å; L261-K264 PolarHBondContact O-N 3.48Å; L261-I265 PolarHBondContact O-N 2.68Å
262I62.8Low66.8Low84 Ų84117.2 Ų117.243%0.43156%0.561SS.*Hα-helixtrans-68.2-42.8178.9-149.575.2000111.5V258 K259 K264 I265 D266V258-I262 PolarHBondContact O-N 3.01Å; K259-I262 WeakPolarHBondContact O-CG2 3.43Å; I262-K264 PolarHBondContact O-N 3.44Å; I262-I265 HydrophobicContact CD1-CG2 4.02Å; I262-I265 HydrophobicContact CG1-CG2 4.37Å; I262-I265 WeakPolarHBondContact O-CG2 3.49Å; I262-I265 PolarHBondContact O-N 3.48Å; I262-I265 VanDerWaalsContact O-N 3.09Å; I262-D266 PolarHBondContact O-N 3.17Å
263N59.4Low67.4Low122 Ų122117.6 Ų117.665%0.65256%0.564SS**Hα-helixtrans-65.9-27.3175.6-82.512.4000112.2K259K259-N263 PolarHBondContact O-N 3.36Å; K259-N263 VanDerWaalsContact O-N 3.08Å
264K64.6Low68.2Low158 Ų158119.6 Ų119.669%0.68757%0.568SS**Hα-helixtrans-79.2-25.8174.6-169.4162.7175171.30112.7K260 L261 I262K260-K264 WeakPolarHBondContact O-CB 3.45Å; K260-K264 PolarHBondContact O-N 3.38Å; L261-K264 PolarHBondContact O-N 3.48Å; I262-K264 PolarHBondContact O-N 3.44Å
265I60.9Low69.2Low100 Ų100116.9 Ų116.951%0.51357%0.567SS.*Hα-helixtrans-77.7-40.6176.7-139.480.9000111.5L261 I262 W267 R268L261-I265 PolarHBondContact O-N 2.68Å; I262-I265 HydrophobicContact CD1-CG2 4.02Å; I262-I265 HydrophobicContact CG1-CG2 4.37Å; I262-I265 WeakPolarHBondContact O-CG2 3.49Å; I262-I265 PolarHBondContact O-N 3.48Å; I262-I265 VanDerWaalsContact O-N 3.09Å; I265-W267 VanDerWaalsContact C-N 3.26Å; I265-W267 PolarHBondContact O-N 2.73Å; I265-R268 PolarHBondContact O-N 3.38Å
266D63.6Low70.3Confident84 Ų84116.8 Ų116.845%0.44957%0.571SS.*Hα-helixtrans-69-23.3-177.4-86.5-1.9000113.4I262 R268 K270I262-D266 PolarHBondContact O-N 3.17Å; D266-R268 PolarHBondContact O-N 3.26Å; D266-K270 WeakPolarHBondContact O-CG 3.39Å; D266-K270 PolarHBondContact O-N 3.3Å
267W63.6Low71.6Confident174 Ų174115.2 Ų115.266%0.65957%0.569SS**Hα-helixtrans-72.5-28.4-177.2-162.560.9000113.1I265 Q271I265-W267 VanDerWaalsContact C-N 3.26Å; I265-W267 PolarHBondContact O-N 2.73Å; W267-Q271 PolarHBondContact O-N 3.17Å
268R65.3Low73.1Confident174 Ų174116 Ų11666%0.65758%0.576SS**Hα-helixtrans-74.4-42.5179.2-69.8-176.1178.6-1071112.2I265 D266 K270 Q271 D272I265-R268 PolarHBondContact O-N 3.38Å; D266-R268 PolarHBondContact O-N 3.26Å; R268-K270 VanDerWaalsContact C-N 3.29Å; R268-K270 PolarHBondContact O-N 3.02Å; R268-Q271 PolarHBondContact O-N 3Å; R268-D272 PolarHBondContact O-N 3.37Å
269H64.3Low74.7Confident121 Ų121116.5 Ų116.556%0.5658%0.579SS**Hα-helixtrans-64.8-32.7176.6-84.8-78.7000113S273H269-S273 PolarHBondContact O-N 3.06Å
270K77.6Confident76.4Confident133 Ų133114 Ų11458%0.57857%0.571SS**Hα-helixtrans-67.8-35.4175.2-72.6-179.8-179.4-177.70112.5D266 R268 I274D266-K270 WeakPolarHBondContact O-CG 3.39Å; D266-K270 PolarHBondContact O-N 3.3Å; R268-K270 VanDerWaalsContact C-N 3.29Å; R268-K270 PolarHBondContact O-N 3.02Å; K270-I274 WeakPolarHBondContact O-CB 3.38Å; K270-I274 WeakPolarHBondContact O-CD1 3.43Å; K270-I274 WeakPolarHBondContact O-CG1 3.44Å; K270-I274 PolarHBondContact O-N 3.41Å
271Q76.6Confident78Confident81 Ų81107.4 Ų107.438%0.37955%0.553SS.*Hα-helixtrans-67.7-46.3177.3-73.5-178.5-23.300111.7W267 R268 S273 I274 V275W267-Q271 PolarHBondContact O-N 3.17Å; R268-Q271 PolarHBondContact O-N 3Å; Q271-S273 VanDerWaalsContact C-N 3.34Å; Q271-S273 PolarHBondContact O-N 3.25Å; Q271-I274 PolarHBondContact O-N 3.22Å; Q271-V275 WeakPolarHBondContact O-CG2 3.21Å; Q271-V275 PolarHBondContact O-N 3.2Å
272D84Confident79.4Confident111 Ų111104.7 Ų104.759%0.59454%0.543SS*.Hα-helixtrans-62.6-41.4179.5-65.4-16.6000111.7R268 V275 L276R268-D272 PolarHBondContact O-N 3.37Å; D272-V275 PolarHBondContact O-N 3.06Å; D272-L276 WeakPolarHBondContact O-CB 3.49Å; D272-L276 PolarHBondContact O-N 3.44Å
273S86.7Confident80.9Confident85 Ų85104.3 Ų104.359%0.59455%0.547SS*.Hα-helixtrans-68.9-33.1177.5-166.90000113.1H269 Q271 G277H269-S273 PolarHBondContact O-N 3.06Å; Q271-S273 VanDerWaalsContact C-N 3.34Å; Q271-S273 PolarHBondContact O-N 3.25Å; S273-G277 PolarHBondContact O-N 3.03Å
274I87.9Confident82.6Confident119 Ų119102.3 Ų102.361%0.6154%0.539SS*.Hα-helixtrans-67.7-44.4175.4-78.3166.8000110.5K270 Q271 G277 L278K270-I274 WeakPolarHBondContact O-CB 3.38Å; K270-I274 WeakPolarHBondContact O-CD1 3.43Å; K270-I274 WeakPolarHBondContact O-CG1 3.44Å; K270-I274 PolarHBondContact O-N 3.41Å; Q271-I274 PolarHBondContact O-N 3.22Å; I274-G277 PolarHBondContact O-N 3.44Å; I274-L278 WeakPolarHBondContact O-CB 3.39Å; I274-L278 PolarHBondContact O-N 3.37Å
275V89.9Confident84.1Confident91 Ų9198.6 Ų98.655%0.55253%0.529SS*.Hα-helixtrans-64.1-45.1179174.20000110.7Q271 D272 G277 L278 V279Q271-V275 WeakPolarHBondContact O-CG2 3.21Å; Q271-V275 PolarHBondContact O-N 3.2Å; D272-V275 PolarHBondContact O-N 3.06Å; V275-G277 VanDerWaalsContact C-N 3.34Å; V275-G277 PolarHBondContact O-N 2.96Å; V275-L278 PolarHBondContact O-N 3.4Å; V275-V279 WeakPolarHBondContact O-CG2 3.47Å; V275-V279 PolarHBondContact O-N 3.09Å
276L89.9Confident85.8Confident113 Ų113100.6 Ų100.659%0.59254%0.535SS*.Hα-helixtrans-61.8-42178-164.1124.6000111.6D272 L278 V279 I280D272-L276 WeakPolarHBondContact O-CB 3.49Å; D272-L276 PolarHBondContact O-N 3.44Å; L276-L278 PolarHBondContact O-N 2.95Å; L276-V279 PolarHBondContact O-N 3.39Å; L276-I280 HydrophobicContact CD2-CD1 3.53Å; L276-I280 HydrophobicContact CG-CD1 4.07Å; L276-I280 WeakPolarHBondContact O-CD1 3.4Å; L276-I280 WeakPolarHBondContact O-CG1 3.32Å; L276-I280 PolarHBondContact O-N 3.01Å; L276-I280 VanDerWaalsContact O-N 3.09Å
277G93.6Very high87.2Confident42 Ų42102.1 Ų102.143%0.43354%0.542SS..Hα-helixtrans-61.9-40174.200000113.5S273 I274 V275 G281S273-G277 PolarHBondContact O-N 3.03Å; I274-G277 PolarHBondContact O-N 3.44Å; V275-G277 VanDerWaalsContact C-N 3.34Å; V275-G277 PolarHBondContact O-N 2.96Å; G277-G281 PolarHBondContact O-N 3.5Å
278L94.5Very high88.7Confident122 Ų12299.2 Ų99.264%0.63954%0.539SS*.Hα-helixtrans-65.4-42.8177-172.7151.8000111.8I274 V275 L276 G281 C282I274-L278 WeakPolarHBondContact O-CB 3.39Å; I274-L278 PolarHBondContact O-N 3.37Å; V275-L278 PolarHBondContact O-N 3.4Å; L276-L278 PolarHBondContact O-N 2.95Å; L278-G281 PolarHBondContact O-N 3.2Å; L278-C282 VanDerWaalsContact O-CB 3.32Å; L278-C282 WeakPolarHBondContact O-CB 3.38Å; L278-C282 PolarHBondContact O-N 2.9Å
279V96.2Very high90.1Very high88 Ų8895.6 Ų95.653%0.53353%0.532SS..Hα-helixtrans-62.6-46.2177.9172.20000110.9V275 L276 C282 C283V275-V279 WeakPolarHBondContact O-CG2 3.47Å; V275-V279 PolarHBondContact O-N 3.09Å; L276-V279 PolarHBondContact O-N 3.39Å; V279-C282 PolarHBondContact O-N 3.04Å; V279-C283 WeakPolarHBondContact O-CB 3.35Å; V279-C283 PolarHBondContact O-N 3.49Å
280I94.8Very high91.6Very high96 Ų9699 Ų9949%0.49254%0.541SS..Hα-helixtrans-62.9-44.7178.1-74.4155.5000111L276 C283 V284L276-I280 HydrophobicContact CD2-CD1 3.53Å; L276-I280 HydrophobicContact CG-CD1 4.07Å; L276-I280 WeakPolarHBondContact O-CD1 3.4Å; L276-I280 WeakPolarHBondContact O-CG1 3.32Å; L276-I280 PolarHBondContact O-N 3.01Å; L276-I280 VanDerWaalsContact O-N 3.09Å; I280-C283 PolarHBondContact O-N 3.3Å; I280-V284 WeakPolarHBondContact O-CG2 3.39Å; I280-V284 PolarHBondContact O-N 3.43Å
281G95.8Very high92.3Very high35 Ų35103 Ų10336%0.36155%0.552SS.*Hα-helixtrans-61.3-45.8176.600000112.9G277 L278 C283 V284 V285G277-G281 PolarHBondContact O-N 3.5Å; L278-G281 PolarHBondContact O-N 3.2Å; G281-C283 VanDerWaalsContact C-N 3.32Å; G281-C283 PolarHBondContact O-N 3.05Å; G281-V284 PolarHBondContact O-N 3.34Å; G281-V285 WeakPolarHBondContact O-CG2 3.37Å; G281-V285 PolarHBondContact O-N 3.41Å
282C96Very high93.1Very high65 Ų65108.2 Ų108.244%0.43957%0.574SS.*Hα-helixtrans-60.7-42.4177.3-169.60000111.6L278 V279 V284 V285 F286L278-C282 VanDerWaalsContact O-CB 3.32Å; L278-C282 WeakPolarHBondContact O-CB 3.38Å; L278-C282 PolarHBondContact O-N 2.9Å; V279-C282 PolarHBondContact O-N 3.04Å; C282-V284 PolarHBondContact O-N 3.3Å; C282-V285 PolarHBondContact O-N 2.98Å; C282-F286 PolarHBondContact O-N 2.97Å
283C94.2Very high93.3Very high77 Ų77113.7 Ų113.752%0.5259%0.593SS.*Hα-helixtrans-63.6-41.9178.4-152.80000112V279 I280 G281 F286 L287V279-C283 WeakPolarHBondContact O-CB 3.35Å; V279-C283 PolarHBondContact O-N 3.49Å; I280-C283 PolarHBondContact O-N 3.3Å; G281-C283 VanDerWaalsContact C-N 3.32Å; G281-C283 PolarHBondContact O-N 3.05Å; C283-F286 PolarHBondContact O-N 3.36Å; C283-L287 WeakPolarHBondContact O-CG 3.49Å; C283-L287 PolarHBondContact O-N 3.41Å
284V95.4Very high93.6Very high79 Ų79115.1 Ų115.148%0.47959%0.593SS.*Hα-helixtrans-64.3-40.9175.8173.50000111.7I280 G281 C282 L287 L288I280-V284 WeakPolarHBondContact O-CG2 3.39Å; I280-V284 PolarHBondContact O-N 3.43Å; G281-V284 PolarHBondContact O-N 3.34Å; C282-V284 PolarHBondContact O-N 3.3Å; V284-L287 PolarHBondContact O-N 2.98Å; V284-L288 HydrophobicContact CG1-CD1 4.42Å; V284-L288 WeakPolarHBondContact O-CG 3.41Å; V284-L288 PolarHBondContact O-N 3.03Å
285V95.6Very high93.9Very high80 Ų80114.9 Ų114.949%0.48559%0.592SS.*Hα-helixtrans-64.3-44.2176.7171.90000111.3G281 C282 L287 L288 I289G281-V285 WeakPolarHBondContact O-CG2 3.37Å; G281-V285 PolarHBondContact O-N 3.41Å; C282-V285 PolarHBondContact O-N 2.98Å; V285-L287 VanDerWaalsContact C-N 3.34Å; V285-L287 PolarHBondContact O-N 3.44Å; V285-L288 PolarHBondContact O-N 3.22Å; V285-I289 HydrophobicContact CG1-CD1 3.88Å; V285-I289 WeakPolarHBondContact O-CG1 3.36Å; V285-I289 PolarHBondContact O-N 3.02Å
286F95.5Very high94.2Very high142 Ų142116.2 Ų116.262%0.62359%0.594SS**Hα-helixtrans-61-40.3175.6-100-83.2000112.5C282 C283 I289 Y290C282-F286 PolarHBondContact O-N 2.97Å; C283-F286 PolarHBondContact O-N 3.36Å; F286-I289 PolarHBondContact O-N 2.91Å; F286-Y290 WeakPolarHBondContact O-CB 3.39Å; F286-Y290 PolarHBondContact O-N 3.04Å
287L94Very high94.4Very high116 Ų116116.4 Ų116.461%0.60760%0.595SS**Hα-helixtrans-66.5-35.6175.6-72.7180000112.8C283 V284 V285 R291C283-L287 WeakPolarHBondContact O-CG 3.49Å; C283-L287 PolarHBondContact O-N 3.41Å; V284-L287 PolarHBondContact O-N 2.98Å; V285-L287 VanDerWaalsContact C-N 3.34Å; V285-L287 PolarHBondContact O-N 3.44Å; L287-R291 VanDerWaalsContact O-CB 3.3Å; L287-R291 WeakPolarHBondContact O-CB 3.3Å; L287-R291 PolarHBondContact O-N 3.39Å
288L94.1Very high94.5Very high113 Ų113121.1 Ų121.159%0.59261%0.605SS**Hα-helixtrans-67.2-40.8174.4-76.6173.5000111.8V284 V285 R291 F292V284-L288 HydrophobicContact CG1-CD1 4.42Å; V284-L288 WeakPolarHBondContact O-CG 3.41Å; V284-L288 PolarHBondContact O-N 3.03Å; V285-L288 PolarHBondContact O-N 3.22Å; L288-R291 PolarHBondContact O-N 3Å; L288-F292 WeakPolarHBondContact O-CB 3.4Å; L288-F292 PolarHBondContact O-N 3.37Å
289I95.3Very high94.5Very high99 Ų99121 Ų12151%0.50860%0.602SS.*Hα-helixtrans-64.4-46.7175.5-67.3164.4000110.3V285 F286 R291 F292 F293V285-I289 HydrophobicContact CG1-CD1 3.88Å; V285-I289 WeakPolarHBondContact O-CG1 3.36Å; V285-I289 PolarHBondContact O-N 3.02Å; F286-I289 PolarHBondContact O-N 2.91Å; I289-R291 PolarHBondContact O-N 2.97Å; I289-F292 PolarHBondContact O-N 3.21Å; I289-F293 WeakPolarHBondContact O-CB 3.37Å; I289-F293 PolarHBondContact O-N 3.31Å
290Y95.4Very high94.3Very high191 Ų191123.4 Ų123.475%0.74961%0.607SS**Hα-helixtrans-66.1-24.5178.8-174.9-95.8000113.7F286 F293F286-Y290 WeakPolarHBondContact O-CB 3.39Å; F286-Y290 PolarHBondContact O-N 3.04Å; Y290-F293 VanDerWaalsContact O-OXT 3.08Å
291R93Very high94.3Very high218 Ų218125.5 Ų125.582%0.82362%0.616SS**Hα-helixtrans-83.9-29.3175.4-179.3174.3168.582.22.7112.5L287 L288 I289L287-R291 VanDerWaalsContact O-CB 3.3Å; L287-R291 WeakPolarHBondContact O-CB 3.3Å; L287-R291 PolarHBondContact O-N 3.39Å; L288-R291 PolarHBondContact O-N 3Å; I289-R291 PolarHBondContact O-N 2.97Å
292F93.4Very high94.2Very high191 Ų191133 Ų13384%0.83864%0.637SS**Hα-helixtrans-83.6-30.2-179.4-174.1-97.1000112.5L288 I289L288-F292 WeakPolarHBondContact O-CB 3.4Å; L288-F292 PolarHBondContact O-N 3.37Å; I289-F292 PolarHBondContact O-N 3.21Å
293F88.1Confident94Very high225 Ų225139.2 Ų139.299%0.98766%0.655SS**  trans-95.70178.5-142.5-83000111.5I289 Y290I289-F293 WeakPolarHBondContact O-CB 3.37Å; I289-F293 PolarHBondContact O-N 3.31Å; Y290-F293 VanDerWaalsContact O-OXT 3.08Å

Retrieved 293 of 293 residues in 86.4 ms (Link to these results)