A0A5K4FCD1_SCHMA Loading...

Polymorphic mucin variant C-r2/1 AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCD1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 252 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
1M54.9Low63.7Low199 Ų199109.4 Ų109.498%0.9854%0.543SS*.  0119.50-153.4155.888.200108.3K3 I6M1-K3 PolarHBondContact O-N 2.95Å; M1-I6 HydrophobicContact CB-CD1 4.39Å; M1-I6 HydrophobicContact CE-CD1 3.59Å; M1-I6 HydrophobicContact CE-CG1 3.57Å; M1-I6 HydrophobicContact CG-CD1 4.33Å; M1-I6 HydrophobicContact CG-CG1 4.19Å
2N64.8Low63.8Low101 Ų101104.8 Ų104.854%0.5452%0.516SS..  trans-68.8126-170.5-165.2-15.4000110.1K4 I5 I6N2-K4 PolarHBondContact O-N 3.12Å; N2-I5 HydrophobicContact CB-CD1 3.89Å; N2-I5 HydrophobicContact CB-CG1 4.06Å; N2-I5 WeakPolarHBondContact O-CB 3.29Å; N2-I5 PolarHBondContact O-N 3.13Å; N2-I6 PolarHBondContact O-N 3.48Å
3K63.4Low64.1Low185 Ų185104.2 Ų104.280%0.80452%0.515SS*.Hα-helixtrans-52.5-31.6-177.7-75.4-175.2177.9-179.40112.5M1 L7M1-K3 PolarHBondContact O-N 2.95Å; K3-L7 PolarHBondContact O-N 3.28Å; K3-L7 VanDerWaalsContact O-N 3.15Å
4K63.9Low64.5Low157 Ų15799.7 Ų99.768%0.68350%0.503SS*.Hα-helixtrans-63.7-41.1174.3-73.4-173.2177.5-178.20113.3N2 L7 L8N2-K4 PolarHBondContact O-N 3.12Å; K4-L7 PolarHBondContact O-N 3.5Å; K4-L8 WeakPolarHBondContact O-CB 3.34Å; K4-L8 WeakPolarHBondContact O-CD1 3.29Å; K4-L8 VanDerWaalsContact O-CG 3.27Å; K4-L8 WeakPolarHBondContact O-CG 3.33Å; K4-L8 PolarHBondContact O-N 2.76Å
5I63.7Low64.6Low95 Ų9593.9 Ų93.949%0.48747%0.473SS..Hα-helixtrans-65.1-45.5179.4-65.2172.5000109.8N2 L7 L8 T9N2-I5 HydrophobicContact CB-CD1 3.89Å; N2-I5 HydrophobicContact CB-CG1 4.06Å; N2-I5 WeakPolarHBondContact O-CB 3.29Å; N2-I5 PolarHBondContact O-N 3.13Å; I5-L7 VanDerWaalsContact C-N 3.31Å; I5-L7 PolarHBondContact O-N 3.01Å; I5-L8 PolarHBondContact O-N 2.71Å; I5-T9 PolarHBondContact O-N 3.41Å; I5-T9 PolarHBondContact O-OG1 3.05Å
6I64Low64.5Low64 Ų6490.8 Ų90.833%0.32846%0.457SS..Hα-helixtrans-58-46.7178.1-60176.1000110.5M1 N2 T9 I10M1-I6 HydrophobicContact CB-CD1 4.39Å; M1-I6 HydrophobicContact CE-CD1 3.59Å; M1-I6 HydrophobicContact CE-CG1 3.57Å; M1-I6 HydrophobicContact CG-CD1 4.33Å; M1-I6 HydrophobicContact CG-CG1 4.19Å; N2-I6 PolarHBondContact O-N 3.48Å; I6-T9 PolarHBondContact O-N 2.99Å; I6-I10 HydrophobicContact CG2-CD1 3.78Å; I6-I10 HydrophobicContact CG2-CG1 4.46Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.38Å; I6-I10 PolarHBondContact O-N 3.43Å
7L63Low64.5Low107 Ų10793.6 Ų93.656%0.5647%0.472SS*.Hα-helixtrans-63.6-43.3179.7-169.369.3000111.8K3 K4 I5 I10 I11K3-L7 PolarHBondContact O-N 3.28Å; K3-L7 VanDerWaalsContact O-N 3.15Å; K4-L7 PolarHBondContact O-N 3.5Å; I5-L7 VanDerWaalsContact C-N 3.31Å; I5-L7 PolarHBondContact O-N 3.01Å; L7-I10 PolarHBondContact O-N 3.16Å; L7-I11 HydrophobicContact CG-CD1 3.97Å; L7-I11 WeakPolarHBondContact O-CB 3.33Å; L7-I11 VanDerWaalsContact O-CG1 3.26Å; L7-I11 WeakPolarHBondContact O-CG1 3.24Å; L7-I11 PolarHBondContact O-N 3.08Å
8L62.9Low64.9Low61 Ų6195.4 Ų95.432%0.31947%0.473SS..Hα-helixtrans-60-45.1175.4-75.2164.5000111.7K4 I5 I11 Y12 E153 Q157K4-L8 WeakPolarHBondContact O-CB 3.34Å; K4-L8 WeakPolarHBondContact O-CD1 3.29Å; K4-L8 VanDerWaalsContact O-CG 3.27Å; K4-L8 WeakPolarHBondContact O-CG 3.33Å; K4-L8 PolarHBondContact O-N 2.76Å; I5-L8 PolarHBondContact O-N 2.71Å; L8-I11 PolarHBondContact O-N 3.3Å; L8-Y12 VanDerWaalsContact O-CB 3.31Å; L8-Y12 WeakPolarHBondContact O-CB 3.33Å; L8-Y12 PolarHBondContact O-N 2.96Å; L8-E153 WeakPolarHBondContact CD2-OE1 3.31Å; L8-Q157 HydrophobicContact CD2-CG 4.17Å
9T66.2Low65.6Low69 Ų6990.5 Ų90.542%0.42345%0.448SS..Hα-helixtrans-64.5-41.1177.9-51.70000112.1I5 I6 Y12 L13I5-T9 PolarHBondContact O-N 3.41Å; I5-T9 PolarHBondContact O-OG1 3.05Å; I6-T9 PolarHBondContact O-N 2.99Å; T9-Y12 PolarHBondContact O-N 3.49Å; T9-L13 HydrophobicContact CG2-CD1 4.14Å; T9-L13 WeakPolarHBondContact O-CB 3.42Å; T9-L13 VanDerWaalsContact O-CG 3.31Å; T9-L13 WeakPolarHBondContact O-CG 3.46Å; T9-L13 PolarHBondContact O-N 3.14Å
10I68.4Low66.6Low103 Ų10387.9 Ų87.953%0.52844%0.438SS..Hα-helixtrans-64.8-44.8177-69.2168.5000110.8I6 L7 Y12 L13 A14I6-I10 HydrophobicContact CG2-CD1 3.78Å; I6-I10 HydrophobicContact CG2-CG1 4.46Å; I6-I10 VanDerWaalsContact O-CG1 3.3Å; I6-I10 WeakPolarHBondContact O-CG1 3.38Å; I6-I10 PolarHBondContact O-N 3.43Å; L7-I10 PolarHBondContact O-N 3.16Å; I10-Y12 VanDerWaalsContact C-N 3.34Å; I10-L13 PolarHBondContact O-N 3.35Å; I10-A14 WeakPolarHBondContact O-CB 3.28Å; I10-A14 PolarHBondContact O-N 2.63Å
11I65.1Low67.6Low62 Ų6289.6 Ų89.632%0.31845%0.445SS..Hα-helixtrans-61.7-45.5177.3-70167.3000110.1L7 L8 A14 L15L7-I11 HydrophobicContact CG-CD1 3.97Å; L7-I11 WeakPolarHBondContact O-CB 3.33Å; L7-I11 VanDerWaalsContact O-CG1 3.26Å; L7-I11 WeakPolarHBondContact O-CG1 3.24Å; L7-I11 PolarHBondContact O-N 3.08Å; L8-I11 PolarHBondContact O-N 3.3Å; I11-A14 PolarHBondContact O-N 3.08Å; I11-L15 HydrophobicContact CG2-CD1 3.88Å; I11-L15 HydrophobicContact CG2-CG 4.39Å; I11-L15 WeakPolarHBondContact O-CB 3.33Å; I11-L15 VanDerWaalsContact O-CG 3.29Å; I11-L15 WeakPolarHBondContact O-CG 3.28Å; I11-L15 PolarHBondContact O-N 3.18Å
12Y65.9Low69.3Low55 Ų5585.1 Ų85.122%0.21642%0.422CS..Hα-helixtrans-58.5-49.1176.4168.5-103.9000112.2L8 T9 I10 A14 L15 M16 E219L8-Y12 VanDerWaalsContact O-CB 3.31Å; L8-Y12 WeakPolarHBondContact O-CB 3.33Å; L8-Y12 PolarHBondContact O-N 2.96Å; T9-Y12 PolarHBondContact O-N 3.49Å; I10-Y12 VanDerWaalsContact C-N 3.34Å; Y12-A14 VanDerWaalsContact C-N 3.31Å; Y12-A14 PolarHBondContact O-N 2.92Å; Y12-L15 PolarHBondContact O-N 3.36Å; Y12-L15 VanDerWaalsContact O-N 3.13Å; Y12-M16 HydrophobicContact CD1-CG 4.46Å; Y12-M16 HydrophobicContact CD2-CG 4.2Å; Y12-M16 HydrophobicContact CE1-CG 3.81Å; Y12-M16 HydrophobicContact CE2-CG 3.47Å; Y12-M16 VanDerWaalsContact CE2-CG 3.47Å; Y12-M16 HydrophobicContact CE2-SD 4.24Å; Y12-M16 PolarHBondContact O-N 2.88Å; Y12-M16 WeakPolarHBondContact OH-CE 3.32Å; Y12-M16 WeakPolarHBondContact OH-CG 3.42Å; Y12-E219 WeakPolarHBondContact CD2-OE1 3.06Å; Y12-E219 WeakPolarHBondContact CE2-OE1 3.3Å; Y12-E219 WeakPolarHBondContact CE2-OE2 3.45Å; Y12-E219 PolarHBondContact OH-OE2 3.32Å
13L67.7Low70.6Confident96 Ų9680.3 Ų80.350%0.50340%0.396SS..Hα-helixtrans-60.1-42176.7-74.1168000111.7T9 I10 L15 M16 I17T9-L13 HydrophobicContact CG2-CD1 4.14Å; T9-L13 WeakPolarHBondContact O-CB 3.42Å; T9-L13 VanDerWaalsContact O-CG 3.31Å; T9-L13 WeakPolarHBondContact O-CG 3.46Å; T9-L13 PolarHBondContact O-N 3.14Å; I10-L13 PolarHBondContact O-N 3.35Å; L13-L15 VanDerWaalsContact C-N 3.29Å; L13-L15 PolarHBondContact O-N 3.45Å; L13-M16 PolarHBondContact O-N 3.19Å; L13-I17 WeakPolarHBondContact O-CG1 3.19Å; L13-I17 PolarHBondContact O-N 3.23Å; L13-I17 VanDerWaalsContact O-N 3.13Å
14A68.7Low72Confident42 Ų4273.5 Ų73.535%0.34737%0.366SS..Hα-helixtrans-64.2-34.1176.800000112.6I10 I11 Y12I10-A14 WeakPolarHBondContact O-CB 3.28Å; I10-A14 PolarHBondContact O-N 2.63Å; I11-A14 PolarHBondContact O-N 3.08Å; Y12-A14 VanDerWaalsContact C-N 3.31Å; Y12-A14 PolarHBondContact O-N 2.92Å
15L66.3Low73.5Confident12 Ų1269 Ų696%0.06335%0.352CS..Hα-helixtrans-74.5-40.8175.2-72.5171.9000111.9I11 Y12 L13 I17 R18 V149 L154 L226I11-L15 HydrophobicContact CG2-CD1 3.88Å; I11-L15 HydrophobicContact CG2-CG 4.39Å; I11-L15 WeakPolarHBondContact O-CB 3.33Å; I11-L15 VanDerWaalsContact O-CG 3.29Å; I11-L15 WeakPolarHBondContact O-CG 3.28Å; I11-L15 PolarHBondContact O-N 3.18Å; Y12-L15 PolarHBondContact O-N 3.36Å; Y12-L15 VanDerWaalsContact O-N 3.13Å; L13-L15 VanDerWaalsContact C-N 3.29Å; L13-L15 PolarHBondContact O-N 3.45Å; L15-I17 VanDerWaalsContact C-N 3.28Å; L15-I17 PolarHBondContact O-N 3.4Å; L15-R18 WeakPolarHBondContact O-CB 3.37Å; L15-R18 PolarHBondContact O-N 3.04Å; L15-V149 HydrophobicContact CD2-CG1 4.45Å; L15-V149 HydrophobicContact CD2-CG2 4.39Å; L15-L154 HydrophobicContact CD1-CD2 4.03Å; L15-L226 HydrophobicContact CB-CD1 3.74Å; L15-L226 HydrophobicContact CD1-CD1 4.21Å; L15-L226 HydrophobicContact CD2-CD1 4.36Å; L15-L226 HydrophobicContact CG-CD1 4.32Å
16M63.2Low75.1Confident44 Ų4468.5 Ų68.522%0.21734%0.344CS..Hα-helixtrans-58.9-36.2175.7-88.6-76.6-91.300113Y12 L13 R18 V19 K24 F222Y12-M16 HydrophobicContact CD1-CG 4.46Å; Y12-M16 HydrophobicContact CD2-CG 4.2Å; Y12-M16 HydrophobicContact CE1-CG 3.81Å; Y12-M16 HydrophobicContact CE2-CG 3.47Å; Y12-M16 VanDerWaalsContact CE2-CG 3.47Å; Y12-M16 HydrophobicContact CE2-SD 4.24Å; Y12-M16 PolarHBondContact O-N 2.88Å; Y12-M16 WeakPolarHBondContact OH-CE 3.32Å; Y12-M16 WeakPolarHBondContact OH-CG 3.42Å; L13-M16 PolarHBondContact O-N 3.19Å; M16-R18 PolarHBondContact O-N 3.41Å; M16-V19 PolarHBondContact O-N 3.15Å; M16-K24 WeakPolarHBondContact O-CE 3.47Å; M16-K24 PolarHBondContact O-NZ 3.2Å; M16-K24 VanDerWaalsContact O-NZ 3.07Å; M16-F222 HydrophobicContact CE-CD2 4.21Å; M16-F222 HydrophobicContact CE-CE2 3.89Å; M16-F222 HydrophobicContact CE-CZ 4.09Å; M16-F222 HydrophobicContact SD-CB 4.36Å; M16-F222 HydrophobicContact SD-CD1 3.68Å; M16-F222 HydrophobicContact SD-CD2 3.72Å; M16-F222 HydrophobicContact SD-CE1 3.77Å; M16-F222 HydrophobicContact SD-CE2 3.83Å; M16-F222 HydrophobicContact SD-CG 3.66Å; M16-F222 HydrophobicContact SD-CZ 3.86Å
17I65Low76.7Confident139 Ų13965.5 Ų65.571%0.71333%0.328SS*.THydrogen-bonded Turntrans-61.6-25.8176.1-69.7164.9000111.6L13 L15L13-I17 WeakPolarHBondContact O-CG1 3.19Å; L13-I17 PolarHBondContact O-N 3.23Å; L13-I17 VanDerWaalsContact O-N 3.13Å; L15-I17 VanDerWaalsContact C-N 3.28Å; L15-I17 PolarHBondContact O-N 3.4Å
18R70.8Confident78.3Confident126 Ų12665.8 Ų65.848%0.47533%0.325SS..THydrogen-bonded Turntrans-87.2-18.2-177.2-60.7178.3-176.7161.5-0.3113.7L15 M16 P20L15-R18 WeakPolarHBondContact O-CB 3.37Å; L15-R18 PolarHBondContact O-N 3.04Å; M16-R18 PolarHBondContact O-N 3.41Å; R18-P20 WeakPolarHBondContact O-CD 3.27Å
19V77.7Confident80Confident2 Ų266.3 Ų66.31%0.01233%0.326CS..SBendtrans-74.4125.4177.1-178.20000108.8M16 L23 K24 F222 L226M16-V19 PolarHBondContact O-N 3.15Å; V19-L23 HydrophobicContact CG1-CB 3.92Å; V19-L23 HydrophobicContact CG1-CD2 3.51Å; V19-L23 HydrophobicContact CG1-CG 3.89Å; V19-K24 HydrophobicContact CB-CG 4.49Å; V19-K24 HydrophobicContact CG1-CG 4.2Å; V19-K24 WeakPolarHBondContact O-CE 3.36Å; V19-K24 PolarHBondContact O-NZ 2.7Å; V19-F222 HydrophobicContact CB-CD1 4.36Å; V19-F222 HydrophobicContact CB-CE1 4.33Å; V19-F222 HydrophobicContact CG1-CD1 4.07Å; V19-F222 HydrophobicContact CG1-CE1 3.89Å; V19-F222 HydrophobicContact CG2-CD1 4.13Å; V19-L226 HydrophobicContact CG2-CD2 4.07Å; V19-L226 HydrophobicContact CG2-CG 4.41Å
20P85.7Confident81.5Confident38 Ų3863.1 Ų63.125%0.24731%0.306CS..  trans-58.1144.8-179.8-26.935.7000113.1R18 H22 L23 K24 Y139R18-P20 WeakPolarHBondContact O-CD 3.27Å; P20-H22 WeakPolarHBondContact CB-CE1 3.39Å; P20-H22 VanDerWaalsContact CB-ND1 3.33Å; P20-H22 WeakPolarHBondContact CB-ND1 3.49Å; P20-H22 PolarHBondContact O-N 2.86Å; P20-L23 WeakPolarHBondContact O-CB 3.44Å; P20-L23 PolarHBondContact O-N 2.8Å; P20-K24 PolarHBondContact O-N 3Å; P20-K24 VanDerWaalsContact O-N 3.11Å; P20-Y139 VanDerWaalsContact CD-CE2 3.42Å; P20-Y139 HydrophobicContact CG-CD2 3.75Å; P20-Y139 HydrophobicContact CG-CE2 3.67Å
21E88.6Confident82.8Confident124 Ų12460.1 Ų60.158%0.57929%0.289SS*.Hα-helixtrans-57.3-34.5-179.1-71.8-53.9129.600113.6L23 K24 T25E21-L23 VanDerWaalsContact C-N 3.3Å; E21-L23 PolarHBondContact O-N 2.67Å; E21-K24 PolarHBondContact O-N 2.75Å; E21-K24 WeakPolarHBondContact OE1-CD 3.29Å; E21-K24 IonicContact OE1-NZ 2.81Å; E21-K24 PolarHBondContact OE1-NZ 3.5Å; E21-T25 WeakPolarHBondContact O-CB 3.41Å; E21-T25 PolarHBondContact O-N 3.17Å; E21-T25 PolarHBondContact O-OG1 3.13Å
22H90.4Very high84.4Confident106 Ų10659.1 Ų59.149%0.49129%0.285SS..Hα-helixtrans-64.5-35.9176.872.3-94.9000111.7P20 T25 R26 V135P20-H22 WeakPolarHBondContact CB-CE1 3.39Å; P20-H22 VanDerWaalsContact CB-ND1 3.33Å; P20-H22 WeakPolarHBondContact CB-ND1 3.49Å; P20-H22 PolarHBondContact O-N 2.86Å; H22-T25 WeakPolarHBondContact O-CB 3.47Å; H22-T25 PolarHBondContact O-N 2.81Å; H22-R26 WeakPolarHBondContact O-CG 3.45Å; H22-R26 PolarHBondContact O-N 3.01Å; H22-R26 VanDerWaalsContact O-N 3.1Å; H22-V135 WeakPolarHBondContact CD2-CG1 3.35Å
23L91.7Very high85.9Confident0 Ų056.8 Ų56.80%028%0.276CS..Hα-helixtrans-73.4-41.4177-176.561.1000111.2V19 P20 E21 T25 R26 I27 L132 V135 Y139 I225V19-L23 HydrophobicContact CG1-CB 3.92Å; V19-L23 HydrophobicContact CG1-CD2 3.51Å; V19-L23 HydrophobicContact CG1-CG 3.89Å; P20-L23 WeakPolarHBondContact O-CB 3.44Å; P20-L23 PolarHBondContact O-N 2.8Å; E21-L23 VanDerWaalsContact C-N 3.3Å; E21-L23 PolarHBondContact O-N 2.67Å; L23-T25 VanDerWaalsContact C-N 3.25Å; L23-T25 PolarHBondContact O-N 3.49Å; L23-R26 PolarHBondContact O-N 3.19Å; L23-R26 VanDerWaalsContact O-N 3.13Å; L23-I27 HydrophobicContact CG-CD1 4.26Å; L23-I27 WeakPolarHBondContact O-CG1 3.16Å; L23-I27 PolarHBondContact O-N 3.1Å; L23-L132 HydrophobicContact CD1-CD1 3.76Å; L23-V135 HydrophobicContact CB-CG1 4.47Å; L23-V135 HydrophobicContact CD1-CG1 3.9Å; L23-Y139 HydrophobicContact CD2-CD1 4.04Å; L23-Y139 HydrophobicContact CD2-CE1 4.44Å; L23-Y139 HydrophobicContact CD2-CG 4.17Å; L23-I225 HydrophobicContact CD1-CD1 3.95Å; L23-I225 HydrophobicContact CD2-CD1 3.85Å; L23-I225 HydrophobicContact CD2-CG2 3.77Å; L23-I225 HydrophobicContact CG-CD1 4.07Å
24K92.8Very high87.4Confident41 Ų4152.5 Ų52.518%0.17825%0.253CS..Hα-helixtrans-55.7-42.8171-68175.3-176.6163.90111.8M16 V19 P20 E21 I27 K28 F222M16-K24 WeakPolarHBondContact O-CE 3.47Å; M16-K24 PolarHBondContact O-NZ 3.2Å; M16-K24 VanDerWaalsContact O-NZ 3.07Å; V19-K24 HydrophobicContact CB-CG 4.49Å; V19-K24 HydrophobicContact CG1-CG 4.2Å; V19-K24 WeakPolarHBondContact O-CE 3.36Å; V19-K24 PolarHBondContact O-NZ 2.7Å; P20-K24 PolarHBondContact O-N 3Å; P20-K24 VanDerWaalsContact O-N 3.11Å; E21-K24 PolarHBondContact O-N 2.75Å; E21-K24 WeakPolarHBondContact OE1-CD 3.29Å; E21-K24 IonicContact OE1-NZ 2.81Å; E21-K24 PolarHBondContact OE1-NZ 3.5Å; K24-I27 PolarHBondContact O-N 3.27Å; K24-K28 PolarHBondContact O-N 2.99Å; K24-F222 HydrophobicContact CB-CE1 4.28Å; K24-F222 HydrophobicContact CB-CZ 4.1Å; K24-F222 HydrophobicContact CG-CE1 3.6Å; K24-F222 HydrophobicContact CG-CZ 3.76Å
25T96Very high88.7Confident62 Ų6252.3 Ų52.338%0.3825%0.245SC..Hα-helixtrans-62.1-43.1177.3-59.20000111.3E21 H22 L23 K28 H29E21-T25 WeakPolarHBondContact O-CB 3.41Å; E21-T25 PolarHBondContact O-N 3.17Å; E21-T25 PolarHBondContact O-OG1 3.13Å; H22-T25 WeakPolarHBondContact O-CB 3.47Å; H22-T25 PolarHBondContact O-N 2.81Å; L23-T25 VanDerWaalsContact C-N 3.25Å; L23-T25 PolarHBondContact O-N 3.49Å; T25-K28 WeakPolarHBondContact O-CB 3.39Å; T25-K28 PolarHBondContact O-N 3.03Å; T25-H29 PolarHBondContact O-CD2 2.58Å; T25-H29 PolarHBondContact O-N 2.87Å
26R97.3Very high90.1Very high85 Ų8557.1 Ų57.132%0.32127%0.267SS..Hα-helixtrans-66.4-40.4176.6-68-53.7-177.8-179.2-4.1113.2H22 L23 K28 H29 Y30 I131 L132 V135H22-R26 WeakPolarHBondContact O-CG 3.45Å; H22-R26 PolarHBondContact O-N 3.01Å; H22-R26 VanDerWaalsContact O-N 3.1Å; L23-R26 PolarHBondContact O-N 3.19Å; L23-R26 VanDerWaalsContact O-N 3.13Å; R26-K28 VanDerWaalsContact C-N 3.29Å; R26-K28 PolarHBondContact O-N 3.41Å; R26-H29 PolarHBondContact O-N 3.31Å; R26-Y30 PolarHBondContact O-N 3.17Å; R26-I131 VanDerWaalsContact CZ-CG2 3.5Å; R26-L132 HydrophobicContact CB-CB 4.5Å; R26-L132 HydrophobicContact CB-CD1 3.79Å; R26-V135 HydrophobicContact CG-CB 4.3Å; R26-V135 HydrophobicContact CG-CG1 4.34Å; R26-V135 HydrophobicContact CG-CG2 4.03Å
27I96.6Very high91.7Very high1 Ų155.1 Ų55.11%0.00526%0.257CS..Hα-helixtrans-60.2-43.4173.5-67.8162.3000110L23 K24 H29 Y30 K31 L132 E221 F222 I225L23-I27 HydrophobicContact CG-CD1 4.26Å; L23-I27 WeakPolarHBondContact O-CG1 3.16Å; L23-I27 PolarHBondContact O-N 3.1Å; K24-I27 PolarHBondContact O-N 3.27Å; I27-H29 PolarHBondContact O-N 3.35Å; I27-Y30 PolarHBondContact O-N 2.96Å; I27-K31 HydrophobicContact CG2-CD 3.98Å; I27-K31 HydrophobicContact CG2-CG 4.27Å; I27-K31 WeakPolarHBondContact O-CB 3.32Å; I27-K31 WeakPolarHBondContact O-CG 3.3Å; I27-K31 PolarHBondContact O-N 2.93Å; I27-L132 HydrophobicContact CG1-CD1 3.69Å; I27-L132 HydrophobicContact CG1-CD2 4.25Å; I27-E221 HydrophobicContact CD1-CB 4.49Å; I27-E221 HydrophobicContact CG1-CB 4.31Å; I27-E221 HydrophobicContact CG2-CB 4.16Å; I27-F222 HydrophobicContact CB-CE2 4.45Å; I27-F222 HydrophobicContact CB-CZ 4.21Å; I27-F222 HydrophobicContact CD1-CD1 3.41Å; I27-F222 VanDerWaalsContact CD1-CD1 3.41Å; I27-F222 HydrophobicContact CD1-CD2 4.23Å; I27-F222 HydrophobicContact CD1-CE1 3.22Å; I27-F222 HydrophobicContact CD1-CE2 4.06Å; I27-F222 HydrophobicContact CD1-CG 3.92Å; I27-F222 HydrophobicContact CD1-CZ 3.56Å; I27-F222 HydrophobicContact CG2-CD2 4.37Å; I27-F222 HydrophobicContact CG2-CE2 3.87Å; I27-F222 HydrophobicContact CG2-CZ 4.14Å; I27-I225 HydrophobicContact CD1-CD1 3.75Å; I27-I225 HydrophobicContact CG1-CD1 4.31Å
28K96.6Very high93.2Very high114 Ų11448.9 Ų48.950%0.49623%0.226SC..Hα-helixtrans-59-46.1174.4-176-173.4175.5-62.20112.2K24 T25 R26 K31 D32K24-K28 PolarHBondContact O-N 2.99Å; T25-K28 WeakPolarHBondContact O-CB 3.39Å; T25-K28 PolarHBondContact O-N 3.03Å; R26-K28 VanDerWaalsContact C-N 3.29Å; R26-K28 PolarHBondContact O-N 3.41Å; K28-K31 WeakPolarHBondContact O-CB 3.14Å; K28-K31 PolarHBondContact O-N 3.38Å; K28-D32 IonicContact NZ-OD2 2.74Å; K28-D32 PolarHBondContact NZ-OD2 2.81Å; K28-D32 WeakPolarHBondContact O-CB 3.43Å; K28-D32 VanDerWaalsContact O-CG 3.28Å; K28-D32 PolarHBondContact O-N 3.39Å
29H98.4Very high94.3Very high71 Ų7144 Ų4433%0.32921%0.209SC..Hα-helixtrans-63.1-42.9179.2-68.6-175.7000112.2T25 R26 I27 D32 A33 E128T25-H29 PolarHBondContact O-CD2 2.58Å; T25-H29 PolarHBondContact O-N 2.87Å; R26-H29 PolarHBondContact O-N 3.31Å; I27-H29 PolarHBondContact O-N 3.35Å; H29-D32 PolarHBondContact O-N 3.23Å; H29-A33 WeakPolarHBondContact O-CB 3.47Å; H29-A33 PolarHBondContact O-N 3.31Å; H29-E128 WeakPolarHBondContact CB-OE2 3.48Å
30Y98.1Very high95.1Very high3 Ų345.3 Ų45.31%0.01222%0.215CC..Hα-helixtrans-60.9-48.5174.4170.7-116.5000111.8R26 I27 D32 A33 Y34 K125 R129 L132 E221R26-Y30 PolarHBondContact O-N 3.17Å; I27-Y30 PolarHBondContact O-N 2.96Å; Y30-D32 VanDerWaalsContact C-N 3.34Å; Y30-D32 PolarHBondContact O-N 3.26Å; Y30-A33 PolarHBondContact O-N 3.44Å; Y30-Y34 WeakPolarHBondContact O-CB 3.48Å; Y30-Y34 PolarHBondContact O-N 3.14Å; Y30-K125 HydrophobicContact CE2-CG 4.29Å; Y30-R129 HydrophobicContact CD2-CB 3.97Å; Y30-R129 HydrophobicContact CE2-CB 3.83Å; Y30-R129 HydrophobicContact CE2-CG 4.34Å; Y30-L132 HydrophobicContact CD1-CD2 3.9Å; Y30-L132 HydrophobicContact CG-CD2 4.06Å; Y30-E221 HydrophobicContact CD1-CG 4.26Å; Y30-E221 HydrophobicContact CE1-CG 4.16Å
31K97.2Very high95.4Very high40 Ų4043.9 Ų43.917%0.17421%0.205CC..Hα-helixtrans-54.3-48.6174.6-76.3173.874178.70112.1I27 K28 A33 Y34 F35 V214 D215I27-K31 HydrophobicContact CG2-CD 3.98Å; I27-K31 HydrophobicContact CG2-CG 4.27Å; I27-K31 WeakPolarHBondContact O-CB 3.32Å; I27-K31 WeakPolarHBondContact O-CG 3.3Å; I27-K31 PolarHBondContact O-N 2.93Å; K28-K31 WeakPolarHBondContact O-CB 3.14Å; K28-K31 PolarHBondContact O-N 3.38Å; K31-A33 PolarHBondContact O-N 2.89Å; K31-Y34 WeakPolarHBondContact O-CB 3.43Å; K31-Y34 PolarHBondContact O-N 3.31Å; K31-F35 PolarHBondContact O-N 2.77Å; K31-V214 HydrophobicContact CB-CG1 3.49Å; K31-V214 VanDerWaalsContact CB-CG1 3.49Å; K31-V214 WeakPolarHBondContact CE-O 3.49Å; K31-V214 HydrophobicContact CG-CG1 3.96Å; K31-V214 VanDerWaalsContact O-CG1 3.25Å; K31-V214 WeakPolarHBondContact O-CG1 3.41Å; K31-D215 WeakPolarHBondContact CE-OD1 3.4Å; K31-D215 IonicContact NZ-OD1 3.14Å; K31-D215 PolarHBondContact NZ-OD1 2.94Å
32D97.9Very high95.6Very high41 Ų4138 Ų3822%0.21918%0.178CC..Hα-helixtrans-62.6-44.9179.6-71.6-25.3000110.1K28 H29 Y30 Y34 F35 H36K28-D32 IonicContact NZ-OD2 2.74Å; K28-D32 PolarHBondContact NZ-OD2 2.81Å; K28-D32 WeakPolarHBondContact O-CB 3.43Å; K28-D32 VanDerWaalsContact O-CG 3.28Å; K28-D32 PolarHBondContact O-N 3.39Å; H29-D32 PolarHBondContact O-N 3.23Å; Y30-D32 VanDerWaalsContact C-N 3.34Å; Y30-D32 PolarHBondContact O-N 3.26Å; D32-Y34 VanDerWaalsContact C-N 3.34Å; D32-Y34 PolarHBondContact O-N 2.92Å; D32-F35 PolarHBondContact O-N 3Å; D32-H36 PolarHBondContact O-N 3.32Å; D32-H36 PolarHBondContact O-ND1 2.73Å
33A98.1Very high95.6Very high5 Ų536.1 Ų36.14%0.04117%0.171CC..Hα-helixtrans-63.8-37.9176.500000112.9H29 Y30 K31 H36 S37 K124 E128H29-A33 WeakPolarHBondContact O-CB 3.47Å; H29-A33 PolarHBondContact O-N 3.31Å; Y30-A33 PolarHBondContact O-N 3.44Å; K31-A33 PolarHBondContact O-N 2.89Å; A33-H36 PolarHBondContact O-N 3.02Å; A33-S37 WeakPolarHBondContact O-CB 3.1Å; A33-S37 PolarHBondContact O-N 3.13Å; A33-K124 HydrophobicContact CB-CG 4.41Å; A33-E128 HydrophobicContact CB-CB 4.07Å; A33-E128 HydrophobicContact CB-CG 3.71Å
34Y97.5Very high95.4Very high6 Ų636.9 Ų36.92%0.02418%0.176CC..Hα-helixtrans-60.6-50.5173.2-168-76.1000111Y30 K31 D32 H36 S37 S38 K125 V214 M217 D247Y30-Y34 WeakPolarHBondContact O-CB 3.48Å; Y30-Y34 PolarHBondContact O-N 3.14Å; K31-Y34 WeakPolarHBondContact O-CB 3.43Å; K31-Y34 PolarHBondContact O-N 3.31Å; D32-Y34 VanDerWaalsContact C-N 3.34Å; D32-Y34 PolarHBondContact O-N 2.92Å; Y34-H36 VanDerWaalsContact C-N 3.34Å; Y34-H36 PolarHBondContact O-N 3.11Å; Y34-S37 WeakPolarHBondContact O-CB 3.41Å; Y34-S37 PolarHBondContact O-N 3.44Å; Y34-S37 VanDerWaalsContact O-N 3.1Å; Y34-S38 WeakPolarHBondContact CE1-OG 3.35Å; Y34-S38 PolarHBondContact O-N 2.99Å; Y34-S38 PolarHBondContact O-OG 3.37Å; Y34-K125 HydrophobicContact CD2-CD 3.66Å; Y34-K125 HydrophobicContact CD2-CG 4.21Å; Y34-K125 HydrophobicContact CE2-CD 4.07Å; Y34-K125 HydrophobicContact CG-CD 4.37Å; Y34-V214 HydrophobicContact CD1-CG2 3.68Å; Y34-V214 HydrophobicContact CE1-CG2 4.41Å; Y34-M217 HydrophobicContact CD1-CE 4.38Å; Y34-M217 HydrophobicContact CD1-SD 3.89Å; Y34-M217 HydrophobicContact CD2-CE 3.63Å; Y34-M217 HydrophobicContact CD2-SD 4.23Å; Y34-M217 HydrophobicContact CE1-CE 4.05Å; Y34-M217 HydrophobicContact CE1-SD 3.47Å; Y34-M217 WeakPolarHBondContact CE1-SD 3.47Å; Y34-M217 HydrophobicContact CE2-CE 3.28Å; Y34-M217 HydrophobicContact CE2-SD 3.9Å; Y34-M217 HydrophobicContact CG-CE 4.19Å; Y34-M217 HydrophobicContact CG-SD 4.25Å; Y34-M217 VanDerWaalsContact CZ-CE 3.49Å; Y34-D247 VanDerWaalsContact CE2-OD1 3.31Å; Y34-D247 WeakPolarHBondContact CE2-OD1 3.35Å; Y34-D247 PolarHBondContact OH-OD1 3.41Å
35F96.9Very high95.2Very high38 Ų3835.6 Ų35.617%0.16717%0.171CC..Hα-helixtrans-54.6-49.1176.7177.6-99.2000111.9K31 D32 S37 S38 I39 L210 R211 V214K31-F35 PolarHBondContact O-N 2.77Å; D32-F35 PolarHBondContact O-N 3Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.34Å; F35-S38 PolarHBondContact O-N 3.39Å; F35-I39 HydrophobicContact CD1-CG1 4.33Å; F35-I39 HydrophobicContact CE1-CG1 3.85Å; F35-I39 HydrophobicContact CE2-CD1 4.34Å; F35-I39 HydrophobicContact CE2-CG1 4.11Å; F35-I39 HydrophobicContact CZ-CD1 4.05Å; F35-I39 HydrophobicContact CZ-CG1 3.73Å; F35-I39 WeakPolarHBondContact O-CG1 3.21Å; F35-I39 PolarHBondContact O-N 2.97Å; F35-L210 HydrophobicContact CD2-CB 4.18Å; F35-L210 HydrophobicContact CE2-CB 3.94Å; F35-R211 HydrophobicContact CE2-CB 4.23Å; F35-V214 HydrophobicContact CB-CG1 4.43Å; F35-V214 HydrophobicContact CB-CG2 3.97Å; F35-V214 HydrophobicContact CD2-CG2 4.47Å
36H96.4Very high94.7Very high114 Ų11433.6 Ų33.653%0.52816%0.157SC..Hα-helixtrans-62.9-38.9178.7-72.983.6000111.6D32 A33 Y34 I39 Q40D32-H36 PolarHBondContact O-N 3.32Å; D32-H36 PolarHBondContact O-ND1 2.73Å; A33-H36 PolarHBondContact O-N 3.02Å; Y34-H36 VanDerWaalsContact C-N 3.34Å; Y34-H36 PolarHBondContact O-N 3.11Å; H36-I39 PolarHBondContact O-N 3.11Å; H36-Q40 WeakPolarHBondContact O-CB 3.4Å; H36-Q40 PolarHBondContact O-N 3.1Å
37S96.6Very high93.9Very high1 Ų132.5 Ų32.51%0.00716%0.161CC..Hα-helixtrans-64.8-40.2175-170.10000112.4A33 Y34 F35 Q40 K41A33-S37 WeakPolarHBondContact O-CB 3.1Å; A33-S37 PolarHBondContact O-N 3.13Å; Y34-S37 WeakPolarHBondContact O-CB 3.41Å; Y34-S37 PolarHBondContact O-N 3.44Å; Y34-S37 VanDerWaalsContact O-N 3.1Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.34Å; S37-Q40 PolarHBondContact O-N 3.19Å; S37-K41 WeakPolarHBondContact O-CB 3.48Å; S37-K41 VanDerWaalsContact O-CG 3.26Å; S37-K41 WeakPolarHBondContact O-CG 3.49Å; S37-K41 PolarHBondContact O-N 3.3Å
38S95.3Very high93Very high9 Ų934.5 Ų34.56%0.06317%0.169CC..Hα-helixtrans-66.4-42.4176.3-63.30000112.3Y34 F35 K41 F42Y34-S38 WeakPolarHBondContact CE1-OG 3.35Å; Y34-S38 PolarHBondContact O-N 2.99Å; Y34-S38 PolarHBondContact O-OG 3.37Å; F35-S38 PolarHBondContact O-N 3.39Å; S38-K41 WeakPolarHBondContact O-CB 3.29Å; S38-K41 PolarHBondContact O-N 3.22Å; S38-F42 PolarHBondContact O-N 2.8Å
39I94.2Very high91.9Very high23 Ų2329.6 Ų29.612%0.11815%0.149CC..Hα-helixtrans-63.1-43.9174.6-68.5-68.4000110.8F35 H36 K41 F42 L43 L210F35-I39 HydrophobicContact CD1-CG1 4.33Å; F35-I39 HydrophobicContact CE1-CG1 3.85Å; F35-I39 HydrophobicContact CE2-CD1 4.34Å; F35-I39 HydrophobicContact CE2-CG1 4.11Å; F35-I39 HydrophobicContact CZ-CD1 4.05Å; F35-I39 HydrophobicContact CZ-CG1 3.73Å; F35-I39 WeakPolarHBondContact O-CG1 3.21Å; F35-I39 PolarHBondContact O-N 2.97Å; H36-I39 PolarHBondContact O-N 3.11Å; I39-K41 VanDerWaalsContact C-N 3.33Å; I39-K41 PolarHBondContact O-N 3.41Å; I39-F42 WeakPolarHBondContact O-CB 3.43Å; I39-F42 PolarHBondContact O-N 2.96Å; I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 HydrophobicContact CG2-CG 4.18Å; I39-L43 WeakPolarHBondContact O-CG 3.26Å; I39-L43 PolarHBondContact O-N 3.46Å; I39-L210 HydrophobicContact CD1-CD1 3.52Å; I39-L210 HydrophobicContact CG1-CD1 4.21Å
40Q94Very high90.6Very high30 Ų3031.1 Ų31.114%0.1415%0.152CC..Hα-helixtrans-64.7-38.3179.1-174.26051.900112H36 S37 F42 L43 S44 Q117 S121H36-Q40 WeakPolarHBondContact O-CB 3.4Å; H36-Q40 PolarHBondContact O-N 3.1Å; S37-Q40 PolarHBondContact O-N 3.19Å; Q40-F42 VanDerWaalsContact C-N 3.34Å; Q40-F42 PolarHBondContact O-N 2.9Å; Q40-L43 PolarHBondContact O-N 3.14Å; Q40-S44 PolarHBondContact NE2-OG 3.45Å; Q40-S44 VanDerWaalsContact NE2-OG 3.13Å; Q40-S44 VanDerWaalsContact O-CB 3.32Å; Q40-S44 WeakPolarHBondContact O-CB 3.24Å; Q40-S44 PolarHBondContact O-N 2.78Å; Q40-S44 PolarHBondContact O-OG 2.67Å; Q40-S44 VanDerWaalsContact O-OG 3.12Å; Q40-Q117 HydrophobicContact CG-CB 4.27Å; Q40-S121 WeakPolarHBondContact CB-OG 3.47Å; Q40-S121 WeakPolarHBondContact CG-OG 3.46Å
41K93.3Very high89.2Confident8 Ų835.2 Ų35.24%0.03519%0.186CC..Hα-helixtrans-53.5-51.3171.8-81.6173.9-178.4-177.30111.2S37 S38 I39 S44 L45 Y60 E68 L118 N250S37-K41 WeakPolarHBondContact O-CB 3.48Å; S37-K41 VanDerWaalsContact O-CG 3.26Å; S37-K41 WeakPolarHBondContact O-CG 3.49Å; S37-K41 PolarHBondContact O-N 3.3Å; S38-K41 WeakPolarHBondContact O-CB 3.29Å; S38-K41 PolarHBondContact O-N 3.22Å; I39-K41 VanDerWaalsContact C-N 3.33Å; I39-K41 PolarHBondContact O-N 3.41Å; K41-S44 PolarHBondContact O-N 3.05Å; K41-L45 WeakPolarHBondContact O-CB 3.42Å; K41-L45 PolarHBondContact O-N 3.13Å; K41-Y60 VanDerWaalsContact C-OH 3.23Å; K41-Y60 WeakPolarHBondContact CA-OH 3.22Å; K41-Y60 WeakPolarHBondContact CB-OH 3.19Å; K41-Y60 WeakPolarHBondContact CG-OH 3.47Å; K41-Y60 WeakPolarHBondContact O-CE2 3.43Å; K41-Y60 VanDerWaalsContact O-CZ 3.28Å; K41-Y60 PolarHBondContact O-OH 2.94Å; K41-E68 WeakPolarHBondContact CE-OE1 3.5Å; K41-E68 IonicContact NZ-OE1 3.92Å; K41-E68 PolarHBondContact NZ-OE1 3.23Å; K41-L118 HydrophobicContact CB-CD1 4.5Å; K41-L118 HydrophobicContact CG-CD1 3.76Å; K41-N250 PolarHBondContact NZ-O 3.4Å
42F91.6Very high87.8Confident1 Ų135.2 Ų35.20%0.00419%0.191CC..Hα-helixtrans-59.5-49.3175.4170.6-91.4000112.7S38 I39 Q40 S44 L45 E46 E176 A179 I180 Y203 L206S38-F42 PolarHBondContact O-N 2.8Å; I39-F42 WeakPolarHBondContact O-CB 3.43Å; I39-F42 PolarHBondContact O-N 2.96Å; Q40-F42 VanDerWaalsContact C-N 3.34Å; Q40-F42 PolarHBondContact O-N 2.9Å; F42-S44 PolarHBondContact O-N 2.89Å; F42-L45 PolarHBondContact O-N 3.26Å; F42-L45 VanDerWaalsContact O-N 3.11Å; F42-E46 PolarHBondContact O-N 3.29Å; F42-E176 HydrophobicContact CD2-CB 4.48Å; F42-E176 HydrophobicContact CD2-CG 4.31Å; F42-A179 HydrophobicContact CE2-CB 3.59Å; F42-A179 HydrophobicContact CZ-CB 3.79Å; F42-I180 HydrophobicContact CE2-CG1 3.95Å; F42-Y203 AromaticContact CD1-CD2 3.94Å; F42-Y203 HydrophobicContact CD1-CD2 3.94Å; F42-Y203 AromaticContact CD1-CE2 3.63Å; F42-Y203 HydrophobicContact CD1-CE2 3.63Å; F42-Y203 AromaticContact CE1-CD2 3.36Å; F42-Y203 HydrophobicContact CE1-CD2 3.36Å; F42-Y203 AromaticContact CE1-CE2 3.48Å; F42-Y203 HydrophobicContact CE1-CE2 3.48Å; F42-Y203 VanDerWaalsContact CE1-CE2 3.48Å; F42-Y203 HydrophobicContact CZ-CD2 4Å; F42-L206 HydrophobicContact CB-CD2 4.4Å; F42-L206 HydrophobicContact CD1-CD2 4.3Å; F42-L206 HydrophobicContact CD2-CD2 3.51Å; F42-L206 HydrophobicContact CE2-CD2 3.79Å; F42-L206 HydrophobicContact CG-CD2 3.78Å; F42-L206 HydrophobicContact CZ-CD2 4.32Å
43L90.3Very high86.4Confident66 Ų6638 Ų3835%0.34621%0.214SC..Hα-helixtrans-64.1-29.9-178.6-69.7176.6000112.8I39 Q40 P47 Y203I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 HydrophobicContact CG2-CG 4.18Å; I39-L43 WeakPolarHBondContact O-CG 3.26Å; I39-L43 PolarHBondContact O-N 3.46Å; Q40-L43 PolarHBondContact O-N 3.14Å; L43-P47 WeakPolarHBondContact O-CD 3.42Å; L43-Y203 HydrophobicContact CD2-CE2 4.13Å
44S89.4Confident85.2Confident16 Ų1642.2 Ų42.211%0.11224%0.239CC..Hα-helixtrans-74.3-40.7173.1-69.90000111.2Q40 K41 F42 P47 Y48Q40-S44 PolarHBondContact NE2-OG 3.45Å; Q40-S44 VanDerWaalsContact NE2-OG 3.13Å; Q40-S44 VanDerWaalsContact O-CB 3.32Å; Q40-S44 WeakPolarHBondContact O-CB 3.24Å; Q40-S44 PolarHBondContact O-N 2.78Å; Q40-S44 PolarHBondContact O-OG 2.67Å; Q40-S44 VanDerWaalsContact O-OG 3.12Å; K41-S44 PolarHBondContact O-N 3.05Å; F42-S44 PolarHBondContact O-N 2.89Å; S44-P47 VanDerWaalsContact O-CD 3.28Å; S44-P47 WeakPolarHBondContact O-CD 3.3Å; S44-P47 VanDerWaalsContact O-CG 3.3Å; S44-P47 WeakPolarHBondContact O-CG 3.44Å; S44-Y48 WeakPolarHBondContact O-CD2 3.38Å
45L87.4Confident84.4Confident13 Ų1347.7 Ų47.77%0.06826%0.259CS..Hα-helixtrans-68.9-39.8179.7175.155.6000113.4K41 F42 Y48 T49 P57 Y60 I180K41-L45 WeakPolarHBondContact O-CB 3.42Å; K41-L45 PolarHBondContact O-N 3.13Å; F42-L45 PolarHBondContact O-N 3.26Å; F42-L45 VanDerWaalsContact O-N 3.11Å; L45-Y48 WeakPolarHBondContact O-CB 3.34Å; L45-Y48 PolarHBondContact O-N 2.94Å; L45-Y48 VanDerWaalsContact O-N 3.09Å; L45-T49 HydrophobicContact CD1-CG2 3.8Å; L45-T49 HydrophobicContact CG-CG2 4.11Å; L45-T49 WeakPolarHBondContact O-CG2 3.44Å; L45-T49 PolarHBondContact O-N 3.45Å; L45-T49 VanDerWaalsContact O-N 3.14Å; L45-P57 HydrophobicContact CD1-CB 3.97Å; L45-P57 HydrophobicContact CD1-CG 4.37Å; L45-Y60 HydrophobicContact CB-CD1 3.85Å; L45-Y60 HydrophobicContact CB-CD2 4.22Å; L45-Y60 HydrophobicContact CB-CE1 3.74Å; L45-Y60 HydrophobicContact CB-CE2 4.13Å; L45-Y60 HydrophobicContact CB-CG 4.09Å; L45-Y60 HydrophobicContact CD1-CD1 3.56Å; L45-Y60 HydrophobicContact CD1-CE1 4.17Å; L45-Y60 HydrophobicContact CD1-CG 3.95Å; L45-Y60 HydrophobicContact CD2-CD1 4.28Å; L45-Y60 HydrophobicContact CD2-CE1 4.08Å; L45-Y60 HydrophobicContact CG-CD1 4.08Å; L45-Y60 HydrophobicContact CG-CE1 4.2Å; L45-I180 HydrophobicContact CD2-CD1 3.47Å; L45-I180 VanDerWaalsContact CD2-CD1 3.47Å; L45-I180 HydrophobicContact CG-CD1 3.76Å
46E85.4Confident83.5Confident21 Ų2146.2 Ų46.210%0.09826%0.255CS..Hα-helixtrans-49.2-53.9-177.5-172.3-165-175.500113.4F42 Y48 T49 R50 A183 H199F42-E46 PolarHBondContact O-N 3.29Å; E46-Y48 VanDerWaalsContact C-N 3.34Å; E46-Y48 PolarHBondContact O-N 2.92Å; E46-T49 PolarHBondContact O-N 2.79Å; E46-T49 PolarHBondContact O-OG1 3.22Å; E46-R50 IonicContact OE1-CZ 3.57Å; E46-R50 IonicContact OE1-NH2 2.71Å; E46-R50 PolarHBondContact OE1-NH2 3.35Å; E46-R50 IonicContact OE2-NH2 2.73Å; E46-A183 HydrophobicContact CG-CB 3.84Å; E46-A183 WeakPolarHBondContact OE1-CB 3Å; E46-H199 IonicContact OE1-CE1 2.61Å; E46-H199 IonicContact OE1-NE2 3.24Å; E46-H199 PolarHBondContact OE1-NE2 3.37Å
47P80.3Confident82.9Confident61 Ų6142.3 Ų42.340%0.39624%0.239SC..Hα-helixtrans-66.6-31.2179.126.8-36000113.6L43 S44 T49 R50 A51L43-P47 WeakPolarHBondContact O-CD 3.42Å; S44-P47 VanDerWaalsContact O-CD 3.28Å; S44-P47 WeakPolarHBondContact O-CD 3.3Å; S44-P47 VanDerWaalsContact O-CG 3.3Å; S44-P47 WeakPolarHBondContact O-CG 3.44Å; P47-T49 VanDerWaalsContact C-N 3.34Å; P47-T49 PolarHBondContact O-N 3.08Å; P47-R50 WeakPolarHBondContact O-CB 3.49Å; P47-R50 PolarHBondContact O-N 2.67Å; P47-A51 PolarHBondContact O-N 3.37Å
48Y77.8Confident82.5Confident43 Ų4347.1 Ų47.117%0.16926%0.262CS..Hα-helixtrans-61.3-45.1175.5-82.7-71.4000110.6S44 L45 E46 R50 A51 S52 A56 Y60 R111 R112S44-Y48 WeakPolarHBondContact O-CD2 3.38Å; L45-Y48 WeakPolarHBondContact O-CB 3.34Å; L45-Y48 PolarHBondContact O-N 2.94Å; L45-Y48 VanDerWaalsContact O-N 3.09Å; E46-Y48 VanDerWaalsContact C-N 3.34Å; E46-Y48 PolarHBondContact O-N 2.92Å; Y48-R50 PolarHBondContact O-N 2.84Å; Y48-R50 VanDerWaalsContact O-N 3.09Å; Y48-A51 PolarHBondContact O-N 2.97Å; Y48-A51 VanDerWaalsContact O-N 3.08Å; Y48-S52 PolarHBondContact O-N 3.14Å; Y48-A56 HydrophobicContact CD1-CB 3.82Å; Y48-A56 HydrophobicContact CG-CB 4.25Å; Y48-A56 WeakPolarHBondContact O-CB 3.38Å; Y48-Y60 HydrophobicContact CD2-CD2 4.17Å; Y48-Y60 HydrophobicContact CD2-CG 4.34Å; Y48-Y60 HydrophobicContact CE2-CD2 4.39Å; Y48-R111 PolarHBondContact OH-O 2.94Å; Y48-R112 VanDerWaalsContact OH-C 3.24Å; Y48-R112 WeakPolarHBondContact OH-CA 3.46Å; Y48-R112 PolarHBondContact OH-O 2.71Å
49T74.2Confident82.2Confident12 Ų1248.6 Ų48.67%0.07427%0.269CS..Hα-helixtrans-61.4-23.9-179.170.70000113.3L45 E46 P47 S52 P57 I180 N184L45-T49 HydrophobicContact CD1-CG2 3.8Å; L45-T49 HydrophobicContact CG-CG2 4.11Å; L45-T49 WeakPolarHBondContact O-CG2 3.44Å; L45-T49 PolarHBondContact O-N 3.45Å; L45-T49 VanDerWaalsContact O-N 3.14Å; E46-T49 PolarHBondContact O-N 2.79Å; E46-T49 PolarHBondContact O-OG1 3.22Å; P47-T49 VanDerWaalsContact C-N 3.34Å; P47-T49 PolarHBondContact O-N 3.08Å; T49-S52 CarbonylContact O-C 3.56Å; T49-P57 HydrophobicContact CG2-CG 3.72Å; T49-I180 HydrophobicContact CG2-CD1 4.28Å; T49-I180 HydrophobicContact CG2-CG1 4.47Å; T49-I180 HydrophobicContact CG2-CG2 3.57Å; T49-I180 WeakPolarHBondContact OG1-CG2 3.41Å; T49-N184 PolarHBondContact OG1-ND2 3.17Å; T49-N184 VanDerWaalsContact OG1-ND2 3.14Å; T49-N184 PolarHBondContact OG1-OD1 3.5Å
50R71Confident82Confident103 Ų10347.6 Ų47.639%0.38926%0.263SS..Hα-helixtrans-76.3-39.3176.3-60.8172.1-170.9179.3-5112.6E46 P47 Y48 N184 M187E46-R50 IonicContact OE1-CZ 3.57Å; E46-R50 IonicContact OE1-NH2 2.71Å; E46-R50 PolarHBondContact OE1-NH2 3.35Å; E46-R50 IonicContact OE2-NH2 2.73Å; P47-R50 WeakPolarHBondContact O-CB 3.49Å; P47-R50 PolarHBondContact O-N 2.67Å; Y48-R50 PolarHBondContact O-N 2.84Å; Y48-R50 VanDerWaalsContact O-N 3.09Å; R50-N184 WeakPolarHBondContact CG-OD1 3.44Å; R50-M187 VanDerWaalsContact CZ-CG 3.47Å
51A68.4Low81.9Confident88 Ų8849.2 Ų49.273%0.72727%0.271SS*.Hα-helixtrans-71.8-35.8-178.700000112.1P47 Y48P47-A51 PolarHBondContact O-N 3.37Å; Y48-A51 PolarHBondContact O-N 2.97Å; Y48-A51 VanDerWaalsContact O-N 3.08Å
52S68.3Low81.8Confident41 Ų4152.7 Ų52.729%0.28729%0.287SS..  trans-159.4123.6174174.20000108.9Y48 T49 T54 R55 A56 P57Y48-S52 PolarHBondContact O-N 3.14Å; T49-S52 CarbonylContact O-C 3.56Å; S52-T54 PolarHBondContact O-N 3.47Å; S52-T54 VanDerWaalsContact O-N 3.13Å; S52-R55 PolarHBondContact OG-N 3.11Å; S52-A56 WeakPolarHBondContact O-CB 3.49Å; S52-P57 WeakPolarHBondContact O-CD 3.38Å
53S68.6Low82Confident100 Ų10052.9 Ų52.970%0.69929%0.288SS*.THydrogen-bonded Turntrans-65.1-18.4-178.256.70000113.9
54T72.1Confident82.2Confident93 Ų9349.7 Ų49.757%0.57127%0.271SS*.THydrogen-bonded Turntrans-115.2-55.5-175.953.80000112.7S52 Q58S52-T54 PolarHBondContact O-N 3.47Å; S52-T54 VanDerWaalsContact O-N 3.13Å; T54-Q58 WeakPolarHBondContact O-CG 3.34Å
55R80.9Confident82.6Confident120 Ų12051.7 Ų51.745%0.45328%0.281SS..Hα-helixtrans-74.8-37.6-169.6-174.757-179.41524.3112.9S52 Q58 I59 E62S52-R55 PolarHBondContact OG-N 3.11Å; R55-Q58 WeakPolarHBondContact O-CB 3.25Å; R55-Q58 PolarHBondContact O-N 3.36Å; R55-I59 HydrophobicContact CG-CD1 3.95Å; R55-I59 WeakPolarHBondContact O-CG1 3.36Å; R55-I59 PolarHBondContact O-N 2.93Å; R55-I59 VanDerWaalsContact O-N 3.09Å; R55-E62 IonicContact NH1-OE1 3.63Å
56A79.2Confident83Confident8 Ų853.4 Ų53.47%0.06629%0.286CS..Hα-helixtrans-72.2-41.4-174.200000112.8Y48 S52 Q58 I59 Y60Y48-A56 HydrophobicContact CD1-CB 3.82Å; Y48-A56 HydrophobicContact CG-CB 4.25Å; Y48-A56 WeakPolarHBondContact O-CB 3.38Å; S52-A56 WeakPolarHBondContact O-CB 3.49Å; A56-Q58 VanDerWaalsContact C-N 3.3Å; A56-Q58 PolarHBondContact O-N 3.37Å; A56-I59 PolarHBondContact O-N 3.34Å; A56-Y60 PolarHBondContact O-N 2.85Å
57P83.9Confident83.6Confident32 Ų3252.4 Ų52.421%0.20828%0.281CS..Hα-helixtrans-57.2-39.2169-29.536.2000113.8L45 T49 S52 Y60 H61L45-P57 HydrophobicContact CD1-CB 3.97Å; L45-P57 HydrophobicContact CD1-CG 4.37Å; T49-P57 HydrophobicContact CG2-CG 3.72Å; S52-P57 WeakPolarHBondContact O-CD 3.38Å; P57-Y60 PolarHBondContact O-N 2.74Å; P57-H61 WeakPolarHBondContact O-CB 3.44Å; P57-H61 PolarHBondContact O-N 3.47Å
58Q87.5Confident84.4Confident102 Ų10249.5 Ų49.548%0.47726%0.262SS..Hα-helixtrans-63.1-46175.8-69.1171.8-9.800111.9T54 R55 A56 Y60 H61 E62T54-Q58 WeakPolarHBondContact O-CG 3.34Å; R55-Q58 WeakPolarHBondContact O-CB 3.25Å; R55-Q58 PolarHBondContact O-N 3.36Å; A56-Q58 VanDerWaalsContact C-N 3.3Å; A56-Q58 PolarHBondContact O-N 3.37Å; Q58-Y60 VanDerWaalsContact C-N 3.3Å; Q58-Y60 PolarHBondContact O-N 3.14Å; Q58-H61 PolarHBondContact O-N 3.3Å; Q58-E62 WeakPolarHBondContact O-CG 3.4Å; Q58-E62 PolarHBondContact O-N 3.47Å
59I88.4Confident85.3Confident40 Ų4050.9 Ų50.921%0.20527%0.269CS..Hα-helixtrans-61.2-42.6177.5-69167.6000110.6R55 A56 E63 R112R55-I59 HydrophobicContact CG-CD1 3.95Å; R55-I59 WeakPolarHBondContact O-CG1 3.36Å; R55-I59 PolarHBondContact O-N 2.93Å; R55-I59 VanDerWaalsContact O-N 3.09Å; A56-I59 PolarHBondContact O-N 3.34Å; I59-E63 WeakPolarHBondContact O-CB 3.4Å; I59-E63 PolarHBondContact O-N 2.73Å; I59-R112 HydrophobicContact CG2-CG 3.82Å
60Y89.9Confident86.5Confident1 Ų150.8 Ų50.80%0.00427%0.268CS..Hα-helixtrans-60.4-46.7174.1164.4-90.9000111.7K41 L45 Y48 A56 P57 Q58 E62 E63 C64 L118K41-Y60 VanDerWaalsContact C-OH 3.23Å; K41-Y60 WeakPolarHBondContact CA-OH 3.22Å; K41-Y60 WeakPolarHBondContact CB-OH 3.19Å; K41-Y60 WeakPolarHBondContact CG-OH 3.47Å; K41-Y60 WeakPolarHBondContact O-CE2 3.43Å; K41-Y60 VanDerWaalsContact O-CZ 3.28Å; K41-Y60 PolarHBondContact O-OH 2.94Å; L45-Y60 HydrophobicContact CB-CD1 3.85Å; L45-Y60 HydrophobicContact CB-CD2 4.22Å; L45-Y60 HydrophobicContact CB-CE1 3.74Å; L45-Y60 HydrophobicContact CB-CE2 4.13Å; L45-Y60 HydrophobicContact CB-CG 4.09Å; L45-Y60 HydrophobicContact CD1-CD1 3.56Å; L45-Y60 HydrophobicContact CD1-CE1 4.17Å; L45-Y60 HydrophobicContact CD1-CG 3.95Å; L45-Y60 HydrophobicContact CD2-CD1 4.28Å; L45-Y60 HydrophobicContact CD2-CE1 4.08Å; L45-Y60 HydrophobicContact CG-CD1 4.08Å; L45-Y60 HydrophobicContact CG-CE1 4.2Å; Y48-Y60 HydrophobicContact CD2-CD2 4.17Å; Y48-Y60 HydrophobicContact CD2-CG 4.34Å; Y48-Y60 HydrophobicContact CE2-CD2 4.39Å; A56-Y60 PolarHBondContact O-N 2.85Å; P57-Y60 PolarHBondContact O-N 2.74Å; Q58-Y60 VanDerWaalsContact C-N 3.3Å; Q58-Y60 PolarHBondContact O-N 3.14Å; Y60-E62 PolarHBondContact O-N 3.05Å; Y60-E63 PolarHBondContact O-N 2.99Å; Y60-E63 VanDerWaalsContact O-N 3.17Å; Y60-C64 HydrophobicContact CE1-CB 4.33Å; Y60-C64 WeakPolarHBondContact O-CB 3.48Å; Y60-C64 PolarHBondContact O-N 2.77Å; Y60-L118 HydrophobicContact CD2-CD2 4.34Å; Y60-L118 HydrophobicContact CE2-CD1 4.42Å; Y60-L118 HydrophobicContact CE2-CD2 3.85Å
61H91.7Very high87.8Confident65 Ų6547.6 Ų47.630%0.30126%0.256SS..Hα-helixtrans-61.9-45.9-179.2-176.280.3000111.5P57 Q58 E63 C64 L65 C251 S252P57-H61 WeakPolarHBondContact O-CB 3.44Å; P57-H61 PolarHBondContact O-N 3.47Å; Q58-H61 PolarHBondContact O-N 3.3Å; H61-E63 VanDerWaalsContact C-N 3.29Å; H61-E63 PolarHBondContact O-N 3.28Å; H61-C64 PolarHBondContact O-N 3.47Å; H61-L65 VanDerWaalsContact NE2-CD1 3.31Å; H61-L65 WeakPolarHBondContact NE2-CD1 3.34Å; H61-L65 WeakPolarHBondContact O-CG 3.44Å; H61-L65 PolarHBondContact O-N 3.46Å; H61-C251 PolarHBondContact CE1-O 3.47Å; H61-S252 PolarHBondContact ND1-O 3.48Å
62E92.9Very high89.2Confident81 Ų8143.4 Ų43.438%0.37922%0.222SC..Hα-helixtrans-55.3-45.1172.9-73.3172.6-159.900111.4R55 Q58 Y60 R66 R112R55-E62 IonicContact NH1-OE1 3.63Å; Q58-E62 WeakPolarHBondContact O-CG 3.4Å; Q58-E62 PolarHBondContact O-N 3.47Å; Y60-E62 PolarHBondContact O-N 3.05Å; E62-R66 VanDerWaalsContact O-CB 3.25Å; E62-R66 WeakPolarHBondContact O-CB 3.39Å; E62-R66 PolarHBondContact O-N 3.1Å; E62-R112 IonicContact OE2-CZ 3.88Å; E62-R112 IonicContact OE2-NH1 3.69Å; E62-R112 PolarHBondContact OE2-NH1 3.24Å; E62-R112 IonicContact OE2-NH2 3.85Å
63E94.5Very high90.6Very high4 Ų441.4 Ų41.42%0.01921%0.208CC..Hα-helixtrans-69.4-41.5-179.6-176.264-175.600112.7I59 Y60 H61 R66 L67 R112 D113 L118I59-E63 WeakPolarHBondContact O-CB 3.4Å; I59-E63 PolarHBondContact O-N 2.73Å; Y60-E63 PolarHBondContact O-N 2.99Å; Y60-E63 VanDerWaalsContact O-N 3.17Å; H61-E63 VanDerWaalsContact C-N 3.29Å; H61-E63 PolarHBondContact O-N 3.28Å; E63-R66 PolarHBondContact O-N 2.97Å; E63-R66 IonicContact OE1-CZ 3.78Å; E63-R66 IonicContact OE1-NE 2.75Å; E63-R66 IonicContact OE1-NH2 3.98Å; E63-R66 PolarHBondContact OE1-NH2 3.4Å; E63-R66 IonicContact OE2-CZ 3.07Å; E63-R66 IonicContact OE2-NE 2.81Å; E63-R66 PolarHBondContact OE2-NE 2.99Å; E63-R66 IonicContact OE2-NH2 2.61Å; E63-R66 PolarHBondContact OE2-NH2 3.23Å; E63-L67 HydrophobicContact CG-CD1 4.07Å; E63-L67 WeakPolarHBondContact O-CB 3.47Å; E63-L67 WeakPolarHBondContact O-CG 3.41Å; E63-L67 PolarHBondContact O-N 2.99Å; E63-R112 HydrophobicContact CB-CB 4.01Å; E63-R112 HydrophobicContact CG-CB 3.74Å; E63-D113 HydrophobicContact CG-CB 4.48Å; E63-L118 HydrophobicContact CG-CD2 4.42Å
64C95.3Very high92Very high0 Ų041.3 Ų41.30%020%0.195CC..Hα-helixtrans-58.1-50.8175-179.10000110.7Y60 H61 R66 L67 E68 L118 C251Y60-C64 HydrophobicContact CE1-CB 4.33Å; Y60-C64 WeakPolarHBondContact O-CB 3.48Å; Y60-C64 PolarHBondContact O-N 2.77Å; H61-C64 PolarHBondContact O-N 3.47Å; C64-R66 VanDerWaalsContact C-N 3.34Å; C64-R66 PolarHBondContact O-N 2.95Å; C64-L67 PolarHBondContact O-N 2.9Å; C64-E68 WeakPolarHBondContact O-CB 3.47Å; C64-E68 WeakPolarHBondContact O-CG 3.42Å; C64-E68 PolarHBondContact O-N 3.31Å; C64-L118 HydrophobicContact CB-CD2 4.4Å; C64-C251 HydrophobicContact CB-CB 3.76Å; C64-C251 WeakPolarHBondContact CB-SG 3.41Å; C64-C251 WeakPolarHBondContact SG-CB 3.31Å; C64-C251 CovalentContact SG-SG 2.04Å; C64-C251 PolarHBondContact SG-SG 3.19Å
65L96.3Very high93.3Very high58 Ų5837 Ų3730%0.30417%0.169SC..Hα-helixtrans-63-40.3178.3-73.6179.7000112H61 E68 K69 C251H61-L65 VanDerWaalsContact NE2-CD1 3.31Å; H61-L65 WeakPolarHBondContact NE2-CD1 3.34Å; H61-L65 WeakPolarHBondContact O-CG 3.44Å; H61-L65 PolarHBondContact O-N 3.46Å; L65-E68 PolarHBondContact O-N 3.36Å; L65-K69 VanDerWaalsContact O-CB 3.26Å; L65-K69 WeakPolarHBondContact O-CB 3.33Å; L65-K69 PolarHBondContact O-N 2.87Å; L65-C251 HydrophobicContact CD2-CB 3.86Å; L65-C251 HydrophobicContact CG-CB 4.08Å; L65-C251 PolarHBondContact N-SG 3.13Å
66R96.4Very high94.1Very high48 Ų4831.3 Ų31.318%0.18115%0.147CC..Hα-helixtrans-61.1-45.9177.5-169.9-166.467.971.5-7.1111.5E62 E63 C64 L70 D105E62-R66 VanDerWaalsContact O-CB 3.25Å; E62-R66 WeakPolarHBondContact O-CB 3.39Å; E62-R66 PolarHBondContact O-N 3.1Å; E63-R66 PolarHBondContact O-N 2.97Å; E63-R66 IonicContact OE1-CZ 3.78Å; E63-R66 IonicContact OE1-NE 2.75Å; E63-R66 IonicContact OE1-NH2 3.98Å; E63-R66 PolarHBondContact OE1-NH2 3.4Å; E63-R66 IonicContact OE2-CZ 3.07Å; E63-R66 IonicContact OE2-NE 2.81Å; E63-R66 PolarHBondContact OE2-NE 2.99Å; E63-R66 IonicContact OE2-NH2 2.61Å; E63-R66 PolarHBondContact OE2-NH2 3.23Å; C64-R66 VanDerWaalsContact C-N 3.34Å; C64-R66 PolarHBondContact O-N 2.95Å; R66-L70 WeakPolarHBondContact O-CB 3.35Å; R66-L70 PolarHBondContact O-N 3.48Å; R66-D105 IonicContact CZ-OD1 3.88Å; R66-D105 VanDerWaalsContact NH1-CA 3.28Å; R66-D105 IonicContact NH1-OD1 3.8Å; R66-D105 PolarHBondContact NH1-OD1 3.45Å; R66-D105 IonicContact NH2-OD1 2.91Å; R66-D105 PolarHBondContact NH2-OD1 3.02Å
67L97.2Very high94.9Very high0 Ų032.1 Ų32.10%015%0.151CC..Hα-helixtrans-68.6-45178.2-71.1171.7000111.7E63 C64 K69 L70 Y71 L118 R119 I122E63-L67 HydrophobicContact CG-CD1 4.07Å; E63-L67 WeakPolarHBondContact O-CB 3.47Å; E63-L67 WeakPolarHBondContact O-CG 3.41Å; E63-L67 PolarHBondContact O-N 2.99Å; C64-L67 PolarHBondContact O-N 2.9Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.36Å; L67-L70 PolarHBondContact O-N 3.46Å; L67-Y71 HydrophobicContact CD2-CE2 4.4Å; L67-Y71 WeakPolarHBondContact O-CD2 3.38Å; L67-Y71 PolarHBondContact O-N 3.07Å; L67-Y71 VanDerWaalsContact O-N 3.13Å; L67-L118 HydrophobicContact CD1-CB 4.27Å; L67-L118 HydrophobicContact CD1-CD2 3.93Å; L67-L118 HydrophobicContact CD1-CG 3.86Å; L67-R119 HydrophobicContact CD1-CB 4.06Å; L67-R119 HydrophobicContact CD2-CB 3.92Å; L67-R119 HydrophobicContact CD2-CG 3.99Å; L67-I122 HydrophobicContact CB-CD1 3.75Å; L67-I122 HydrophobicContact CD1-CD1 4.33Å
68E97.9Very high95.5Very high0 Ų033.6 Ų33.60%016%0.155CC..Hα-helixtrans-56.9-47.4174.2-75.2-73-173.300110.9K41 C64 L65 L70 Y71 F72 I122 K125 W126 S248K41-E68 WeakPolarHBondContact CE-OE1 3.5Å; K41-E68 IonicContact NZ-OE1 3.92Å; K41-E68 PolarHBondContact NZ-OE1 3.23Å; C64-E68 WeakPolarHBondContact O-CB 3.47Å; C64-E68 WeakPolarHBondContact O-CG 3.42Å; C64-E68 PolarHBondContact O-N 3.31Å; L65-E68 PolarHBondContact O-N 3.36Å; E68-L70 PolarHBondContact O-N 2.95Å; E68-Y71 PolarHBondContact O-N 3.35Å; E68-F72 WeakPolarHBondContact O-CB 3.43Å; E68-F72 PolarHBondContact O-N 3.17Å; E68-I122 HydrophobicContact CG-CD1 4.18Å; E68-I122 HydrophobicContact CG-CG2 4.34Å; E68-K125 IonicContact OE1-NZ 3.69Å; E68-K125 PolarHBondContact OE1-NZ 3.36Å; E68-K125 WeakPolarHBondContact OE2-CE 3.4Å; E68-K125 IonicContact OE2-NZ 2.68Å; E68-K125 PolarHBondContact OE2-NZ 2.89Å; E68-W126 PolarHBondContact OE2-NE1 3.33Å; E68-S248 WeakPolarHBondContact CB-O 3.36Å
69K97.6Very high95.9Very high73 Ų7329 Ų2932%0.31713%0.133SC..Hα-helixtrans-60.1-43.3177.9-17268.3179.2-179.10112.3L65 L67 Y71 F72 T73 E97L65-K69 VanDerWaalsContact O-CB 3.26Å; L65-K69 WeakPolarHBondContact O-CB 3.33Å; L65-K69 PolarHBondContact O-N 2.87Å; L67-K69 VanDerWaalsContact C-N 3.33Å; L67-K69 PolarHBondContact O-N 3.36Å; K69-Y71 PolarHBondContact O-N 3.01Å; K69-F72 HydrophobicContact CD-CD1 4.41Å; K69-T73 HydrophobicContact CD-CG2 3.97Å; K69-T73 HydrophobicContact CG-CG2 4.24Å; K69-T73 WeakPolarHBondContact O-CB 3.19Å; K69-T73 VanDerWaalsContact O-CG2 3.26Å; K69-T73 WeakPolarHBondContact O-CG2 3Å; K69-T73 PolarHBondContact O-N 2.98Å; K69-T73 PolarHBondContact O-OG1 2.88Å; K69-E97 WeakPolarHBondContact CE-OE2 3.48Å; K69-E97 IonicContact NZ-OE2 2.9Å; K69-E97 PolarHBondContact NZ-OE2 3.24Å
70L98.1Very high96.2Very high10 Ų1027 Ų275%0.05212%0.123CC..Hα-helixtrans-58.6-47.7178.6175.767.4000112.2R66 L67 E68 T73 K74 Y98 A101 K102 D105R66-L70 WeakPolarHBondContact O-CB 3.35Å; R66-L70 PolarHBondContact O-N 3.48Å; L67-L70 PolarHBondContact O-N 3.46Å; E68-L70 PolarHBondContact O-N 2.95Å; L70-T73 PolarHBondContact O-OG1 3.2Å; L70-K74 WeakPolarHBondContact O-CB 3.36Å; L70-K74 PolarHBondContact O-N 3.07Å; L70-Y98 HydrophobicContact CD1-CD2 4.31Å; L70-Y98 HydrophobicContact CD1-CE2 3.86Å; L70-A101 HydrophobicContact CB-CB 4.31Å; L70-A101 HydrophobicContact CD1-CB 3.96Å; L70-K102 HydrophobicContact CD1-CG 4.09Å; L70-D105 HydrophobicContact CD1-CB 4.39Å; L70-D105 HydrophobicContact CD2-CB 3.92Å
71Y98.5Very high96.4Very high35 Ų3530.1 Ų30.114%0.13715%0.145CC..Hα-helixtrans-81.8-32.2-176.4-70-68000112.9L67 E68 K69 W75 R119 I122 S123L67-Y71 HydrophobicContact CD2-CE2 4.4Å; L67-Y71 WeakPolarHBondContact O-CD2 3.38Å; L67-Y71 PolarHBondContact O-N 3.07Å; L67-Y71 VanDerWaalsContact O-N 3.13Å; E68-Y71 PolarHBondContact O-N 3.35Å; K69-Y71 PolarHBondContact O-N 3.01Å; Y71-W75 WeakPolarHBondContact O-CB 3.48Å; Y71-W75 PolarHBondContact O-N 3.13Å; Y71-R119 HydrophobicContact CE2-CG 3.98Å; Y71-R119 WeakPolarHBondContact OH-CG 3.38Å; Y71-I122 HydrophobicContact CD2-CB 4.4Å; Y71-I122 HydrophobicContact CD2-CG2 3.7Å; Y71-I122 HydrophobicContact CE2-CG2 4.48Å; Y71-I122 HydrophobicContact CG-CG2 4.42Å; Y71-S123 VanDerWaalsContact CE1-CB 3.5Å; Y71-S123 WeakPolarHBondContact CE1-OG 3.32Å
72F98.3Very high96.3Very high0 Ų032.7 Ų32.70%016%0.155CC..Hα-helixtrans-60.4-52.4170.4166.4-116.2000111.5E68 K69 K74 W75 A76 Y94 W126 M244 D245E68-F72 WeakPolarHBondContact O-CB 3.43Å; E68-F72 PolarHBondContact O-N 3.17Å; K69-F72 HydrophobicContact CD-CD1 4.41Å; F72-K74 VanDerWaalsContact C-N 3.32Å; F72-K74 PolarHBondContact O-N 3.33Å; F72-W75 AromaticContact CD2-CE3 3.81Å; F72-W75 HydrophobicContact CD2-CE3 3.81Å; F72-W75 HydrophobicContact CD2-CZ3 4.08Å; F72-W75 AromaticContact CE2-CE3 3.89Å; F72-W75 HydrophobicContact CE2-CE3 3.89Å; F72-W75 AromaticContact CE2-CZ3 3.69Å; F72-W75 HydrophobicContact CE2-CZ3 3.69Å; F72-W75 CarbonylContact O-C 3.57Å; F72-W75 WeakPolarHBondContact O-CB 3.47Å; F72-W75 PolarHBondContact O-N 3.34Å; F72-W75 VanDerWaalsContact O-N 3.1Å; F72-A76 HydrophobicContact CE2-CB 4.46Å; F72-A76 WeakPolarHBondContact O-CB 3.44Å; F72-A76 PolarHBondContact O-N 2.91Å; F72-Y94 HydrophobicContact CE1-CD1 4.48Å; F72-Y94 AromaticContact CE1-CE1 3.68Å; F72-Y94 HydrophobicContact CE1-CE1 3.68Å; F72-Y94 AromaticContact CZ-CE1 3.79Å; F72-Y94 HydrophobicContact CZ-CE1 3.79Å; F72-W126 HydrophobicContact CB-CH2 3.83Å; F72-W126 HydrophobicContact CB-CZ2 3.59Å; F72-W126 HydrophobicContact CB-CZ3 4.37Å; F72-W126 AromaticContact CD2-CH2 3.46Å; F72-W126 HydrophobicContact CD2-CH2 3.46Å; F72-W126 VanDerWaalsContact CD2-CH2 3.46Å; F72-W126 HydrophobicContact CD2-CZ2 4.11Å; F72-W126 AromaticContact CD2-CZ3 3.84Å; F72-W126 HydrophobicContact CD2-CZ3 3.84Å; F72-W126 HydrophobicContact CE2-CH2 4.46Å; F72-W126 HydrophobicContact CG-CH2 4.06Å; F72-W126 HydrophobicContact CG-CZ2 4.26Å; F72-M244 HydrophobicContact CD2-CB 4.33Å; F72-M244 HydrophobicContact CE2-CB 3.95Å; F72-D245 HydrophobicContact CE1-CB 4.33Å; F72-D245 VanDerWaalsContact CE1-OD1 3.24Å; F72-D245 WeakPolarHBondContact CE1-OD1 3.45Å; F72-D245 HydrophobicContact CE2-CB 4.23Å; F72-D245 VanDerWaalsContact CZ-CA 3.48Å; F72-D245 HydrophobicContact CZ-CB 3.64Å; F72-D245 WeakPolarHBondContact CZ-OD1 3.47Å
73T98.1Very high96Very high0 Ų029.7 Ų29.70%014%0.142CC..Hα-helixtrans-64-38.7-17951.50000111.5K69 L70 W75 A76 V77 Y94 E97 Y98K69-T73 HydrophobicContact CD-CG2 3.97Å; K69-T73 HydrophobicContact CG-CG2 4.24Å; K69-T73 WeakPolarHBondContact O-CB 3.19Å; K69-T73 VanDerWaalsContact O-CG2 3.26Å; K69-T73 WeakPolarHBondContact O-CG2 3Å; K69-T73 PolarHBondContact O-N 2.98Å; K69-T73 PolarHBondContact O-OG1 2.88Å; L70-T73 PolarHBondContact O-OG1 3.2Å; T73-W75 PolarHBondContact O-N 2.84Å; T73-A76 PolarHBondContact O-N 3.34Å; T73-V77 WeakPolarHBondContact O-CG2 3.4Å; T73-V77 PolarHBondContact O-N 2.68Å; T73-Y94 HydrophobicContact CG2-CD1 4.49Å; T73-E97 HydrophobicContact CG2-CB 3.79Å; T73-Y98 WeakPolarHBondContact OG1-CD2 3.46Å
74K98.2Very high95.2Very high98 Ų9832 Ų3243%0.42617%0.166SC..Hα-helixtrans-56.1-48.5170.1-175-179.8178.8177.90112.2L70 F72 H78 Y98L70-K74 WeakPolarHBondContact O-CB 3.36Å; L70-K74 PolarHBondContact O-N 3.07Å; F72-K74 VanDerWaalsContact C-N 3.32Å; F72-K74 PolarHBondContact O-N 3.33Å; K74-H78 PolarHBondContact O-N 2.95Å; K74-H78 VanDerWaalsContact O-N 3.17Å; K74-Y98 HydrophobicContact CB-CD2 4.01Å; K74-Y98 HydrophobicContact CB-CE1 4.43Å; K74-Y98 HydrophobicContact CB-CE2 3.57Å; K74-Y98 HydrophobicContact CG-CE1 4.32Å; K74-Y98 HydrophobicContact CG-CE2 4.1Å
75W98.3Very high94.2Very high3 Ų332.9 Ų32.91%0.01117%0.174CC..Hα-helixtrans-63.4-43.5177.2164.289000111.4Y71 F72 T73 V77 H78 Y79 W126 D133 I240 I241 M244Y71-W75 WeakPolarHBondContact O-CB 3.48Å; Y71-W75 PolarHBondContact O-N 3.13Å; F72-W75 AromaticContact CD2-CE3 3.81Å; F72-W75 HydrophobicContact CD2-CE3 3.81Å; F72-W75 HydrophobicContact CD2-CZ3 4.08Å; F72-W75 AromaticContact CE2-CE3 3.89Å; F72-W75 HydrophobicContact CE2-CE3 3.89Å; F72-W75 AromaticContact CE2-CZ3 3.69Å; F72-W75 HydrophobicContact CE2-CZ3 3.69Å; F72-W75 CarbonylContact O-C 3.57Å; F72-W75 WeakPolarHBondContact O-CB 3.47Å; F72-W75 PolarHBondContact O-N 3.34Å; F72-W75 VanDerWaalsContact O-N 3.1Å; T73-W75 PolarHBondContact O-N 2.84Å; W75-V77 PolarHBondContact O-N 3.41Å; W75-H78 WeakPolarHBondContact O-CB 3.36Å; W75-H78 PolarHBondContact O-N 3.38Å; W75-Y79 HydrophobicContact CH2-CD1 4.49Å; W75-Y79 HydrophobicContact CH2-CG 4.41Å; W75-Y79 HydrophobicContact CZ2-CD1 4.5Å; W75-Y79 HydrophobicContact CZ2-CD2 4.23Å; W75-Y79 HydrophobicContact CZ2-CG 4.01Å; W75-Y79 WeakPolarHBondContact O-CB 3.48Å; W75-Y79 PolarHBondContact O-N 3.16Å; W75-W126 HydrophobicContact CB-CE3 3.78Å; W75-W126 HydrophobicContact CB-CZ3 4.35Å; W75-W126 HydrophobicContact CD2-CE3 4.13Å; W75-W126 AromaticContact CD2-CZ3 3.9Å; W75-W126 HydrophobicContact CD2-CZ3 3.9Å; W75-W126 HydrophobicContact CE3-CE3 4.47Å; W75-W126 AromaticContact CE3-CZ3 3.9Å; W75-W126 HydrophobicContact CE3-CZ3 3.9Å; W75-W126 AromaticContact CG-CE3 3.8Å; W75-W126 HydrophobicContact CG-CE3 3.8Å; W75-W126 HydrophobicContact CG-CZ3 4.09Å; W75-D133 VanDerWaalsContact CE2-OD2 3.25Å; W75-D133 VanDerWaalsContact CZ2-OD2 3.26Å; W75-D133 WeakPolarHBondContact CZ2-OD2 3.31Å; W75-D133 PolarHBondContact NE1-OD2 3.13Å; W75-I240 HydrophobicContact CH2-CG2 3.8Å; W75-I240 HydrophobicContact CZ2-CG2 3.81Å; W75-I241 HydrophobicContact CH2-CD1 3.96Å; W75-I241 HydrophobicContact CZ3-CD1 3.86Å; W75-M244 HydrophobicContact CE3-CB 4.17Å; W75-M244 HydrophobicContact CH2-CB 3.46Å; W75-M244 VanDerWaalsContact CH2-CB 3.46Å; W75-M244 HydrophobicContact CH2-CG 3.36Å; W75-M244 HydrophobicContact CZ2-CB 4.22Å; W75-M244 HydrophobicContact CZ2-CG 3.67Å; W75-M244 HydrophobicContact CZ3-CB 3.43Å; W75-M244 VanDerWaalsContact CZ3-CB 3.43Å; W75-M244 HydrophobicContact CZ3-CG 3.85Å
76A97.2Very high93.2Very high0 Ų035 Ų350%019%0.189CC..Hα-helixtrans-62.6-45.1-177.600000111.3F72 T73 Y79 L80 Y94 I241F72-A76 HydrophobicContact CE2-CB 4.46Å; F72-A76 WeakPolarHBondContact O-CB 3.44Å; F72-A76 PolarHBondContact O-N 2.91Å; T73-A76 PolarHBondContact O-N 3.34Å; A76-Y79 PolarHBondContact O-N 3.18Å; A76-L80 WeakPolarHBondContact O-CB 3.4Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.47Å; A76-L80 PolarHBondContact O-N 2.96Å; A76-Y94 HydrophobicContact CB-CD1 3.84Å; A76-Y94 HydrophobicContact CB-CD2 4.21Å; A76-Y94 HydrophobicContact CB-CE1 4.19Å; A76-Y94 HydrophobicContact CB-CE2 4.49Å; A76-Y94 HydrophobicContact CB-CG 3.85Å; A76-I241 HydrophobicContact CB-CD1 4.26Å
77V96.8Very high92.6Very high24 Ų2436.5 Ų36.515%0.14520%0.201CC..Hα-helixtrans-57.7-51.4173172.90000110.3T73 W75 Y79 L80 S81 L91 Y94 E95T73-V77 WeakPolarHBondContact O-CG2 3.4Å; T73-V77 PolarHBondContact O-N 2.68Å; W75-V77 PolarHBondContact O-N 3.41Å; V77-Y79 PolarHBondContact O-N 3.37Å; V77-L80 PolarHBondContact O-N 3.47Å; V77-S81 WeakPolarHBondContact O-CB 3.44Å; V77-S81 PolarHBondContact O-N 3.19Å; V77-S81 PolarHBondContact O-OG 3.28Å; V77-L91 HydrophobicContact CG1-CD1 4.38Å; V77-Y94 WeakPolarHBondContact CG2-O 3.21Å; V77-E95 HydrophobicContact CG1-CG 4.06Å; V77-E95 HydrophobicContact CG2-CB 4.5Å; V77-E95 HydrophobicContact CG2-CG 3.98Å
78H96.1Very high92.2Very high64 Ų6441.8 Ų41.830%0.29623%0.228SC..Hα-helixtrans-56-49.9178.4-178.693.9000112.2K74 W75 K82 E130 D134K74-H78 PolarHBondContact O-N 2.95Å; K74-H78 VanDerWaalsContact O-N 3.17Å; W75-H78 WeakPolarHBondContact O-CB 3.36Å; W75-H78 PolarHBondContact O-N 3.38Å; H78-K82 VanDerWaalsContact O-CB 3.29Å; H78-K82 WeakPolarHBondContact O-CB 3.43Å; H78-K82 PolarHBondContact O-N 3.42Å; H78-E130 IonicContact CE1-OE1 2.73Å; H78-E130 IonicContact ND1-OE1 2.65Å; H78-E130 IonicContact NE2-OE1 2.89Å; H78-D134 IonicContact NE2-OD1 2.93Å
79Y95.8Very high92Very high4 Ų446.6 Ų46.62%0.01626%0.257CS..Hα-helixtrans-61.3-47.7-177.2177.5-96.7000111.6W75 A76 V77 N83 D133 I237 I240 I241W75-Y79 HydrophobicContact CH2-CD1 4.49Å; W75-Y79 HydrophobicContact CH2-CG 4.41Å; W75-Y79 HydrophobicContact CZ2-CD1 4.5Å; W75-Y79 HydrophobicContact CZ2-CD2 4.23Å; W75-Y79 HydrophobicContact CZ2-CG 4.01Å; W75-Y79 WeakPolarHBondContact O-CB 3.48Å; W75-Y79 PolarHBondContact O-N 3.16Å; A76-Y79 PolarHBondContact O-N 3.18Å; V77-Y79 PolarHBondContact O-N 3.37Å; Y79-N83 WeakPolarHBondContact CD2-ND2 3.29Å; Y79-N83 WeakPolarHBondContact CE2-ND2 3.22Å; Y79-N83 VanDerWaalsContact O-CB 3.27Å; Y79-N83 WeakPolarHBondContact O-CB 3.37Å; Y79-N83 PolarHBondContact O-N 3.24Å; Y79-N83 PolarHBondContact O-ND2 3.16Å; Y79-D133 HydrophobicContact CD2-CB 3.93Å; Y79-D133 HydrophobicContact CE2-CB 4.14Å; Y79-I237 HydrophobicContact CE1-CG1 4.26Å; Y79-I237 HydrophobicContact CE1-CG2 4.33Å; Y79-I240 HydrophobicContact CE1-CB 4.34Å; Y79-I240 HydrophobicContact CE1-CG2 4Å; Y79-I240 HydrophobicContact CE2-CD1 4.23Å; Y79-I240 HydrophobicContact CE2-CG2 4.09Å; Y79-I240 WeakPolarHBondContact OH-CD1 3.16Å; Y79-I241 HydrophobicContact CD1-CD1 4.01Å; Y79-I241 HydrophobicContact CD1-CG1 4.44Å
80L95Very high91.8Very high0 Ų045.5 Ų45.50%026%0.255CS..Hα-helixtrans-67.9-44.6-178.8-70.7170.2000112.4A76 V77 K82 G84 A85 L90 L91 Y94 I237 I241A76-L80 WeakPolarHBondContact O-CB 3.4Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.47Å; A76-L80 PolarHBondContact O-N 2.96Å; V77-L80 PolarHBondContact O-N 3.47Å; L80-K82 VanDerWaalsContact C-N 3.31Å; L80-K82 PolarHBondContact O-N 2.88Å; L80-G84 PolarHBondContact O-N 3.34Å; L80-A85 HydrophobicContact CB-CB 4.09Å; L80-A85 HydrophobicContact CD2-CB 3.82Å; L80-A85 PolarHBondContact O-N 3.4Å; L80-A85 VanDerWaalsContact O-N 3.16Å; L80-L90 HydrophobicContact CD1-CD2 4.42Å; L80-L90 HydrophobicContact CD1-CG 4.14Å; L80-L90 HydrophobicContact CD2-CD2 4.08Å; L80-L91 HydrophobicContact CB-CD1 3.93Å; L80-Y94 HydrophobicContact CD1-CD2 3.49Å; L80-Y94 VanDerWaalsContact CD1-CD2 3.49Å; L80-Y94 HydrophobicContact CD1-CE2 4.13Å; L80-Y94 HydrophobicContact CD1-CG 4.36Å; L80-I237 HydrophobicContact CD2-CG2 3.52Å; L80-I241 HydrophobicContact CD1-CD1 4.27Å; L80-I241 HydrophobicContact CD2-CD1 4.18Å; L80-I241 HydrophobicContact CD2-CG1 4.15Å; L80-I241 HydrophobicContact CG-CD1 4.09Å
81S93.4Very high91.7Very high65 Ų6546.5 Ų46.546%0.45526%0.26SS..Hα-helixtrans-61.3-41177.4-590000111.7V77V77-S81 WeakPolarHBondContact O-CB 3.44Å; V77-S81 PolarHBondContact O-N 3.19Å; V77-S81 PolarHBondContact O-OG 3.28Å
82K90.7Very high91.6Very high119 Ų11949.6 Ų49.652%0.51728%0.276SS..Hα-helixtrans-76.2-36.2-177.6-168.3173.4-173.11680113.3H78 L80 G84 D134H78-K82 VanDerWaalsContact O-CB 3.29Å; H78-K82 WeakPolarHBondContact O-CB 3.43Å; H78-K82 PolarHBondContact O-N 3.42Å; L80-K82 VanDerWaalsContact C-N 3.31Å; L80-K82 PolarHBondContact O-N 2.88Å; K82-G84 PolarHBondContact O-N 3.38Å; K82-D134 VanDerWaalsContact CD-OD1 3.29Å; K82-D134 WeakPolarHBondContact CD-OD1 3.12Å; K82-D134 WeakPolarHBondContact CE-OD1 3.14Å; K82-D134 IonicContact NZ-OD1 2.71Å; K82-D134 PolarHBondContact NZ-OD1 2.93Å; K82-D134 IonicContact NZ-OD2 2.76Å; K82-D134 PolarHBondContact NZ-OD2 3.14Å
83N87.3Confident91.5Very high19 Ų1952.2 Ų52.210%0.10229%0.294CS..THydrogen-bonded Turntrans-84.33.5-178.5-79.5-78.4000114.2Y79 S137 K233 I237Y79-N83 WeakPolarHBondContact CD2-ND2 3.29Å; Y79-N83 WeakPolarHBondContact CE2-ND2 3.22Å; Y79-N83 VanDerWaalsContact O-CB 3.27Å; Y79-N83 WeakPolarHBondContact O-CB 3.37Å; Y79-N83 PolarHBondContact O-N 3.24Å; Y79-N83 PolarHBondContact O-ND2 3.16Å; N83-S137 PolarHBondContact OD1-OG 2.86Å; N83-K233 WeakPolarHBondContact O-CE 3.24Å; N83-K233 PolarHBondContact OD1-NZ 2.93Å; N83-I237 HydrophobicContact CB-CD1 4.36Å
84G77.6Confident91.4Very high52 Ų5253.1 Ų53.154%0.53630%0.298SS..THydrogen-bonded Turntrans64.950.2176.300000111.9L80 K82 T86L80-G84 PolarHBondContact O-N 3.34Å; K82-G84 PolarHBondContact O-N 3.38Å; G84-T86 PolarHBondContact O-N 3.45Å; G84-T86 VanDerWaalsContact O-N 3.08Å
85A72.6Confident91.4Very high18 Ų1852.2 Ų52.215%0.14930%0.295CS..  trans-51.2118.5176.600000110.5L80 D87L80-A85 HydrophobicContact CB-CB 4.09Å; L80-A85 HydrophobicContact CD2-CB 3.82Å; L80-A85 PolarHBondContact O-N 3.4Å; L80-A85 VanDerWaalsContact O-N 3.16Å; A85-D87 PolarHBondContact O-N 2.97Å
86T76.4Confident91.4Very high103 Ų10357.2 Ų57.263%0.63232%0.322SS*.SBendtrans-67.7-29.2174.850.70000111G84 I88 D234G84-T86 PolarHBondContact O-N 3.45Å; G84-T86 VanDerWaalsContact O-N 3.08Å; T86-I88 PolarHBondContact O-N 2.82Å; T86-I88 VanDerWaalsContact O-N 3.14Å; T86-D234 PolarHBondContact OG1-OD1 3.49Å
87D84.4Confident91.4Very high79 Ų7960.1 Ų60.142%0.42234%0.335SS..  trans-81.286.2174.5-167.1-15.1000111.2A85 T89 L90 L91A85-D87 PolarHBondContact O-N 2.97Å; D87-T89 PolarHBondContact O-N 3.48Å; D87-T89 VanDerWaalsContact OD1-CB 3.3Å; D87-T89 WeakPolarHBondContact OD1-CB 3.14Å; D87-T89 PolarHBondContact OD1-N 3.48Å; D87-T89 VanDerWaalsContact OD1-N 3.11Å; D87-L90 HydrophobicContact CB-CB 3.93Å; D87-L90 PolarHBondContact O-N 3.36Å; D87-L90 PolarHBondContact OD1-N 3.02Å; D87-L91 PolarHBondContact O-N 3.45Å
88I89Confident91.5Very high112 Ų11261.2 Ų61.257%0.57434%0.337SS*.Hα-helixtrans-58.6-33.9175.7-62.7171.3000111.1T86 L91 Q92T86-I88 PolarHBondContact O-N 2.82Å; T86-I88 VanDerWaalsContact O-N 3.14Å; I88-L91 PolarHBondContact O-N 3Å; I88-Q92 HydrophobicContact CG2-CG 4.29Å; I88-Q92 WeakPolarHBondContact O-CG 3.47Å; I88-Q92 PolarHBondContact O-N 3.48Å
89T93Very high91.6Very high100 Ų10062.4 Ų62.461%0.61334%0.343SS*.Hα-helixtrans-65.2-41.7179.9-49.40000110.7D87 Q92 S93D87-T89 PolarHBondContact O-N 3.48Å; D87-T89 VanDerWaalsContact OD1-CB 3.3Å; D87-T89 WeakPolarHBondContact OD1-CB 3.14Å; D87-T89 PolarHBondContact OD1-N 3.48Å; D87-T89 VanDerWaalsContact OD1-N 3.11Å; T89-Q92 PolarHBondContact O-N 2.99Å; T89-S93 PolarHBondContact O-N 3.28Å
90L93.2Very high91.7Very high51 Ų5167.5 Ų67.527%0.26737%0.367SS..Hα-helixtrans-62.2-44.5176.4-176.464.7000111.9L80 D87 S93 Y94L80-L90 HydrophobicContact CD1-CD2 4.42Å; L80-L90 HydrophobicContact CD1-CG 4.14Å; L80-L90 HydrophobicContact CD2-CD2 4.08Å; D87-L90 HydrophobicContact CB-CB 3.93Å; D87-L90 PolarHBondContact O-N 3.36Å; D87-L90 PolarHBondContact OD1-N 3.02Å; L90-S93 WeakPolarHBondContact O-CB 3.11Å; L90-S93 PolarHBondContact O-N 2.92Å; L90-Y94 HydrophobicContact CD1-CD2 4.11Å; L90-Y94 HydrophobicContact CD1-CE2 3.71Å; L90-Y94 HydrophobicContact CG-CD2 4.25Å; L90-Y94 HydrophobicContact CG-CE2 4.17Å; L90-Y94 WeakPolarHBondContact O-CD2 3.39Å; L90-Y94 PolarHBondContact O-N 3.37Å
91L95.3Very high91.9Very high31 Ų3168.3 Ų68.316%0.16237%0.374CS..Hα-helixtrans-60.5-49.4175.9173.959.1000111V77 L80 D87 I88 S93 Y94 E95V77-L91 HydrophobicContact CG1-CD1 4.38Å; L80-L91 HydrophobicContact CB-CD1 3.93Å; D87-L91 PolarHBondContact O-N 3.45Å; I88-L91 PolarHBondContact O-N 3Å; L91-S93 VanDerWaalsContact C-N 3.27Å; L91-S93 PolarHBondContact O-N 3.02Å; L91-Y94 PolarHBondContact O-N 3.04Å; L91-Y94 VanDerWaalsContact O-N 3.14Å; L91-E95 HydrophobicContact CD1-CG 4.06Å; L91-E95 HydrophobicContact CG-CG 4.34Å; L91-E95 WeakPolarHBondContact O-CG 3.44Å; L91-E95 PolarHBondContact O-N 2.61Å
92Q96.1Very high92.1Very high99 Ų9968 Ų6846%0.46336%0.364SS..Hα-helixtrans-59.6-36.9178.3-73.6175.1-17.700112.5I88 T89 E95 N96I88-Q92 HydrophobicContact CG2-CG 4.29Å; I88-Q92 WeakPolarHBondContact O-CG 3.47Å; I88-Q92 PolarHBondContact O-N 3.48Å; T89-Q92 PolarHBondContact O-N 2.99Å; Q92-E95 PolarHBondContact O-N 2.81Å; Q92-N96 WeakPolarHBondContact O-CB 3.19Å; Q92-N96 VanDerWaalsContact O-CG 3.23Å; Q92-N96 PolarHBondContact O-N 2.91Å; Q92-N96 PolarHBondContact O-ND2 3.17Å; Q92-N96 VanDerWaalsContact O-ND2 3.13Å
93S96.5Very high92.4Very high55 Ų5567.6 Ų67.639%0.38536%0.362SS..Hα-helixtrans-59.3-50174.5-167.50000111.2T89 L90 L91 N96 E97T89-S93 PolarHBondContact O-N 3.28Å; L90-S93 WeakPolarHBondContact O-CB 3.11Å; L90-S93 PolarHBondContact O-N 2.92Å; L91-S93 VanDerWaalsContact C-N 3.27Å; L91-S93 PolarHBondContact O-N 3.02Å; S93-N96 PolarHBondContact O-N 2.79Å; S93-E97 WeakPolarHBondContact O-CG 3.26Å; S93-E97 PolarHBondContact O-N 3.34Å
94Y97.2Very high92.7Very high20 Ų2068.2 Ų68.28%0.07837%0.373CS..Hα-helixtrans-70.7-31.3179.6-78.8-62.3000113.5F72 T73 A76 V77 L80 L90 L91 E97 Y98 I241F72-Y94 HydrophobicContact CE1-CD1 4.48Å; F72-Y94 AromaticContact CE1-CE1 3.68Å; F72-Y94 HydrophobicContact CE1-CE1 3.68Å; F72-Y94 AromaticContact CZ-CE1 3.79Å; F72-Y94 HydrophobicContact CZ-CE1 3.79Å; T73-Y94 HydrophobicContact CG2-CD1 4.49Å; A76-Y94 HydrophobicContact CB-CD1 3.84Å; A76-Y94 HydrophobicContact CB-CD2 4.21Å; A76-Y94 HydrophobicContact CB-CE1 4.19Å; A76-Y94 HydrophobicContact CB-CE2 4.49Å; A76-Y94 HydrophobicContact CB-CG 3.85Å; V77-Y94 WeakPolarHBondContact CG2-O 3.21Å; L80-Y94 HydrophobicContact CD1-CD2 3.49Å; L80-Y94 VanDerWaalsContact CD1-CD2 3.49Å; L80-Y94 HydrophobicContact CD1-CE2 4.13Å; L80-Y94 HydrophobicContact CD1-CG 4.36Å; L90-Y94 HydrophobicContact CD1-CD2 4.11Å; L90-Y94 HydrophobicContact CD1-CE2 3.71Å; L90-Y94 HydrophobicContact CG-CD2 4.25Å; L90-Y94 HydrophobicContact CG-CE2 4.17Å; L90-Y94 WeakPolarHBondContact O-CD2 3.39Å; L90-Y94 PolarHBondContact O-N 3.37Å; L91-Y94 PolarHBondContact O-N 3.04Å; L91-Y94 VanDerWaalsContact O-N 3.14Å; Y94-E97 PolarHBondContact O-N 3.02Å; Y94-Y98 VanDerWaalsContact O-CB 3.31Å; Y94-Y98 WeakPolarHBondContact O-CB 3.31Å; Y94-Y98 PolarHBondContact O-N 2.92Å; Y94-I241 HydrophobicContact CE2-CD1 4.44Å; Y94-I241 HydrophobicContact CE2-CG2 3.87Å; Y94-I241 VanDerWaalsContact OH-CG2 3.24Å; Y94-I241 WeakPolarHBondContact OH-CG2 3.36Å
95E97.7Very high93.5Very high79 Ų7967.8 Ų67.837%0.36936%0.358SS..Hα-helixtrans-60.8-47.1171.2-74.2176.915300110.8V77 L91 Q92 Y98 E99V77-E95 HydrophobicContact CG1-CG 4.06Å; V77-E95 HydrophobicContact CG2-CB 4.5Å; V77-E95 HydrophobicContact CG2-CG 3.98Å; L91-E95 HydrophobicContact CD1-CG 4.06Å; L91-E95 HydrophobicContact CG-CG 4.34Å; L91-E95 WeakPolarHBondContact O-CG 3.44Å; L91-E95 PolarHBondContact O-N 2.61Å; Q92-E95 PolarHBondContact O-N 2.81Å; E95-Y98 PolarHBondContact O-N 2.75Å; E95-E99 WeakPolarHBondContact O-CG 3.24Å; E95-E99 PolarHBondContact O-N 3.21Å
96N98.2Very high94.5Very high108 Ų10875.2 Ų75.258%0.57839%0.387SS*.Hα-helixtrans-62.6-46176.4-70.3-30.8000111.8Q92 S93 Y98 E99 E100Q92-N96 WeakPolarHBondContact O-CB 3.19Å; Q92-N96 VanDerWaalsContact O-CG 3.23Å; Q92-N96 PolarHBondContact O-N 2.91Å; Q92-N96 PolarHBondContact O-ND2 3.17Å; Q92-N96 VanDerWaalsContact O-ND2 3.13Å; S93-N96 PolarHBondContact O-N 2.79Å; N96-Y98 VanDerWaalsContact C-N 3.27Å; N96-Y98 PolarHBondContact O-N 3.46Å; N96-E99 PolarHBondContact O-N 3.07Å; N96-E100 WeakPolarHBondContact O-CG 3.29Å; N96-E100 PolarHBondContact O-N 3.01Å
97E97.9Very high95.3Very high60 Ų6077 Ų7728%0.2839%0.393SS..Hα-helixtrans-60.7-37.3176.2-72.6179.8-142.200112.3K69 T73 S93 Y94 E100 A101K69-E97 WeakPolarHBondContact CE-OE2 3.48Å; K69-E97 IonicContact NZ-OE2 2.9Å; K69-E97 PolarHBondContact NZ-OE2 3.24Å; T73-E97 HydrophobicContact CG2-CB 3.79Å; S93-E97 WeakPolarHBondContact O-CG 3.26Å; S93-E97 PolarHBondContact O-N 3.34Å; Y94-E97 PolarHBondContact O-N 3.02Å; E97-E100 PolarHBondContact O-N 3.34Å; E97-A101 WeakPolarHBondContact O-CB 3.14Å; E97-A101 PolarHBondContact O-N 3.43Å
98Y98.5Very high95.6Very high47 Ų4774.2 Ų74.218%0.18438%0.381CS..Hα-helixtrans-69.1-40.2176.4-177.6-136.5000112.2L70 T73 K74 Y94 E95 N96 A101 K102L70-Y98 HydrophobicContact CD1-CD2 4.31Å; L70-Y98 HydrophobicContact CD1-CE2 3.86Å; T73-Y98 WeakPolarHBondContact OG1-CD2 3.46Å; K74-Y98 HydrophobicContact CB-CD2 4.01Å; K74-Y98 HydrophobicContact CB-CE1 4.43Å; K74-Y98 HydrophobicContact CB-CE2 3.57Å; K74-Y98 HydrophobicContact CG-CE1 4.32Å; K74-Y98 HydrophobicContact CG-CE2 4.1Å; Y94-Y98 VanDerWaalsContact O-CB 3.31Å; Y94-Y98 WeakPolarHBondContact O-CB 3.31Å; Y94-Y98 PolarHBondContact O-N 2.92Å; E95-Y98 PolarHBondContact O-N 2.75Å; N96-Y98 VanDerWaalsContact C-N 3.27Å; N96-Y98 PolarHBondContact O-N 3.46Å; Y98-A101 PolarHBondContact O-N 3.42Å; Y98-K102 HydrophobicContact CD1-CD 4.49Å; Y98-K102 HydrophobicContact CD2-CG 4.2Å; Y98-K102 HydrophobicContact CE1-CD 3.96Å; Y98-K102 HydrophobicContact CE2-CD 4.05Å; Y98-K102 HydrophobicContact CE2-CG 3.74Å; Y98-K102 WeakPolarHBondContact O-CB 3.47Å; Y98-K102 WeakPolarHBondContact O-CG 3.48Å; Y98-K102 PolarHBondContact O-N 3.18Å
99E98.3Very high95.6Very high90 Ų9071.3 Ų71.342%0.42137%0.367SS..Hα-helixtrans-60.4-44.2173-70.3-54.214700112E95 N96 K102 K103E95-E99 WeakPolarHBondContact O-CG 3.24Å; E95-E99 PolarHBondContact O-N 3.21Å; N96-E99 PolarHBondContact O-N 3.07Å; E99-K102 VanDerWaalsContact CD-CE 3.45Å; E99-K102 PolarHBondContact O-N 3.41Å; E99-K102 WeakPolarHBondContact OE1-CE 3.26Å; E99-K102 IonicContact OE1-NZ 3.62Å; E99-K102 PolarHBondContact OE1-NZ 3.39Å; E99-K102 WeakPolarHBondContact OE2-CE 3.11Å; E99-K102 IonicContact OE2-NZ 3.93Å; E99-K102 PolarHBondContact OE2-NZ 2.85Å; E99-K103 WeakPolarHBondContact O-CG 2.94Å; E99-K103 PolarHBondContact O-N 3.48Å
100E97.9Very high95.2Very high111 Ų11171.8 Ų71.852%0.51937%0.372SS..Hα-helixtrans-64.5-43.2175.6-69.5-52.212300111.9N96 E97 K102 K103 G104N96-E100 WeakPolarHBondContact O-CG 3.29Å; N96-E100 PolarHBondContact O-N 3.01Å; E97-E100 PolarHBondContact O-N 3.34Å; E100-K102 VanDerWaalsContact C-N 3.3Å; E100-K102 PolarHBondContact O-N 3.29Å; E100-K103 PolarHBondContact O-N 3.43Å; E100-K103 VanDerWaalsContact O-N 3.17Å; E100-K103 IonicContact OE1-NZ 3.85Å; E100-K103 PolarHBondContact OE1-NZ 2.83Å; E100-G104 PolarHBondContact O-N 3.26Å
101A97.9Very high94.7Very high17 Ų1778 Ų7814%0.1439%0.391CS..Hα-helixtrans-61.1-38.5175.600000112.1L70 E97 Y98 G104 D105L70-A101 HydrophobicContact CB-CB 4.31Å; L70-A101 HydrophobicContact CD1-CB 3.96Å; E97-A101 WeakPolarHBondContact O-CB 3.14Å; E97-A101 PolarHBondContact O-N 3.43Å; Y98-A101 PolarHBondContact O-N 3.42Å; A101-G104 PolarHBondContact O-N 3.19Å; A101-D105 WeakPolarHBondContact O-CB 3.33Å; A101-D105 PolarHBondContact O-N 2.98Å
102K98Very high94.2Very high59 Ų5979.9 Ų79.926%0.25740%0.397SS..Hα-helixtrans-64.7-40.7173.9-79.4-174-72.21660112.7L70 Y98 E99 E100 D105 K106L70-K102 HydrophobicContact CD1-CG 4.09Å; Y98-K102 HydrophobicContact CD1-CD 4.49Å; Y98-K102 HydrophobicContact CD2-CG 4.2Å; Y98-K102 HydrophobicContact CE1-CD 3.96Å; Y98-K102 HydrophobicContact CE2-CD 4.05Å; Y98-K102 HydrophobicContact CE2-CG 3.74Å; Y98-K102 WeakPolarHBondContact O-CB 3.47Å; Y98-K102 WeakPolarHBondContact O-CG 3.48Å; Y98-K102 PolarHBondContact O-N 3.18Å; E99-K102 VanDerWaalsContact CD-CE 3.45Å; E99-K102 PolarHBondContact O-N 3.41Å; E99-K102 WeakPolarHBondContact OE1-CE 3.26Å; E99-K102 IonicContact OE1-NZ 3.62Å; E99-K102 PolarHBondContact OE1-NZ 3.39Å; E99-K102 WeakPolarHBondContact OE2-CE 3.11Å; E99-K102 IonicContact OE2-NZ 3.93Å; E99-K102 PolarHBondContact OE2-NZ 2.85Å; E100-K102 VanDerWaalsContact C-N 3.3Å; E100-K102 PolarHBondContact O-N 3.29Å; K102-D105 PolarHBondContact O-N 3.5Å; K102-K106 WeakPolarHBondContact O-CG 2.77Å; K102-K106 PolarHBondContact O-N 3.11Å; K102-K106 VanDerWaalsContact O-N 3.07Å
103K97.1Very high93.7Very high109 Ų10975.7 Ų75.747%0.47438%0.377SS..Hα-helixtrans-63-44.6174.3-69.1171.5-170.7168.60110.7E99 E100 D105 K106 N107E99-K103 WeakPolarHBondContact O-CG 2.94Å; E99-K103 PolarHBondContact O-N 3.48Å; E100-K103 PolarHBondContact O-N 3.43Å; E100-K103 VanDerWaalsContact O-N 3.17Å; E100-K103 IonicContact OE1-NZ 3.85Å; E100-K103 PolarHBondContact OE1-NZ 2.83Å; K103-D105 VanDerWaalsContact C-N 3.31Å; K103-D105 PolarHBondContact O-N 3.39Å; K103-K106 PolarHBondContact O-N 3.13Å; K103-N107 PolarHBondContact O-N 3.48Å; K103-N107 PolarHBondContact O-ND2 2.71Å
104G93.9Very high92.7Very high32 Ų3283.3 Ų83.333%0.3340%0.398SS..Hα-helixtrans-59.2-40.3174.400000112.8E100 A101 N107 A108E100-G104 PolarHBondContact O-N 3.26Å; A101-G104 PolarHBondContact O-N 3.19Å; G104-N107 PolarHBondContact O-N 3.33Å; G104-A108 PolarHBondContact O-N 3.01Å; G104-A108 VanDerWaalsContact O-N 3.1Å
105D95.4Very high92Very high43 Ų4385.7 Ų85.723%0.2343%0.429CS..Hα-helixtrans-67.3-39.7178-169.667.3000113.5R66 L70 A101 K102 K103 N107 A108 R119R66-D105 IonicContact CZ-OD1 3.88Å; R66-D105 VanDerWaalsContact NH1-CA 3.28Å; R66-D105 IonicContact NH1-OD1 3.8Å; R66-D105 PolarHBondContact NH1-OD1 3.45Å; R66-D105 IonicContact NH2-OD1 2.91Å; R66-D105 PolarHBondContact NH2-OD1 3.02Å; L70-D105 HydrophobicContact CD1-CB 4.39Å; L70-D105 HydrophobicContact CD2-CB 3.92Å; A101-D105 WeakPolarHBondContact O-CB 3.33Å; A101-D105 PolarHBondContact O-N 2.98Å; K102-D105 PolarHBondContact O-N 3.5Å; K103-D105 VanDerWaalsContact C-N 3.31Å; K103-D105 PolarHBondContact O-N 3.39Å; D105-N107 PolarHBondContact O-N 3.17Å; D105-A108 WeakPolarHBondContact O-CB 3.46Å; D105-A108 PolarHBondContact O-N 3.29Å; D105-R119 IonicContact OD1-CZ 3.67Å; D105-R119 IonicContact OD1-NE 3.71Å; D105-R119 IonicContact OD1-NH2 3.29Å; D105-R119 PolarHBondContact OD1-NH2 2.91Å; D105-R119 IonicContact OD2-NH2 2.85Å
106K93.5Very high91.8Very high174 Ų17483.1 Ų83.176%0.75742%0.423SS*.Hα-helixtrans-61.7-32.9175.1-73.2175.6-178.71800112.9K102 K103K102-K106 WeakPolarHBondContact O-CG 2.77Å; K102-K106 PolarHBondContact O-N 3.11Å; K102-K106 VanDerWaalsContact O-N 3.07Å; K103-K106 PolarHBondContact O-N 3.13Å
107N91.8Very high91.5Very high141 Ų14183.2 Ų83.275%0.75442%0.42SS*.THydrogen-bonded Turntrans-96.60.5-176.9-64-26.2000113.3K103 G104 D105K103-N107 PolarHBondContact O-N 3.48Å; K103-N107 PolarHBondContact O-ND2 2.71Å; G104-N107 PolarHBondContact O-N 3.33Å; D105-N107 PolarHBondContact O-N 3.17Å
108A91.4Very high91.4Very high21 Ų2180.4 Ų80.417%0.17441%0.407CS..SBendtrans-69.6141.1-176.900000111.4G104 D105 P110G104-A108 PolarHBondContact O-N 3.01Å; G104-A108 VanDerWaalsContact O-N 3.1Å; D105-A108 WeakPolarHBondContact O-CB 3.46Å; D105-A108 PolarHBondContact O-N 3.29Å; A108-P110 VanDerWaalsContact O-CD 3.23Å; A108-P110 WeakPolarHBondContact O-CD 3.05Å
109D89.8Confident91.3Very high51 Ų5182 Ų8227%0.27341%0.413SS..  trans-67.8115.8174.2-179.9-11.7000109.6R111 R112D109-R111 PolarHBondContact O-N 3.41Å; D109-R111 VanDerWaalsContact OD1-CB 3.29Å; D109-R111 WeakPolarHBondContact OD1-CB 3.37Å; D109-R111 WeakPolarHBondContact OD1-CG 3.45Å; D109-R111 IonicContact OD1-CZ 3.21Å; D109-R111 PolarHBondContact OD1-N 3.44Å; D109-R111 IonicContact OD1-NE 2.79Å; D109-R111 PolarHBondContact OD1-NE 2.81Å; D109-R111 IonicContact OD1-NH2 2.63Å; D109-R111 IonicContact OD2-CZ 3.88Å; D109-R111 IonicContact OD2-NE 2.91Å; D109-R111 PolarHBondContact OD2-NE 2.7Å; D109-R111 IonicContact OD2-NH2 2.64Å; D109-R111 PolarHBondContact OD2-NH2 3.28Å; D109-R112 HydrophobicContact CB-CG 4.03Å; D109-R112 WeakPolarHBondContact O-CB 3.47Å; D109-R112 PolarHBondContact O-N 2.73Å
110P83.7Confident91.2Very high110 Ų11080.6 Ų80.671%0.71442%0.416SS*.G310 helixtrans-59.8-18.6-176.9-23.734.7000114A108 R112A108-P110 VanDerWaalsContact O-CD 3.23Å; A108-P110 WeakPolarHBondContact O-CD 3.05Å; P110-R112 VanDerWaalsContact C-N 3.25Å; P110-R112 PolarHBondContact O-N 3.03Å
111R82.2Confident91.2Very high180 Ų18076.1 Ų76.168%0.67940%0.397SS*.G310 helixtrans-76.4-10.4178.9-59171.4-66.6-177.53.2113.3Y48 D109Y48-R111 PolarHBondContact OH-O 2.94Å; D109-R111 PolarHBondContact O-N 3.41Å; D109-R111 VanDerWaalsContact OD1-CB 3.29Å; D109-R111 WeakPolarHBondContact OD1-CB 3.37Å; D109-R111 WeakPolarHBondContact OD1-CG 3.45Å; D109-R111 IonicContact OD1-CZ 3.21Å; D109-R111 PolarHBondContact OD1-N 3.44Å; D109-R111 IonicContact OD1-NE 2.79Å; D109-R111 PolarHBondContact OD1-NE 2.81Å; D109-R111 IonicContact OD1-NH2 2.63Å; D109-R111 IonicContact OD2-CZ 3.88Å; D109-R111 IonicContact OD2-NE 2.91Å; D109-R111 PolarHBondContact OD2-NE 2.7Å; D109-R111 IonicContact OD2-NH2 2.64Å; D109-R111 PolarHBondContact OD2-NH2 3.28Å
112R85.3Confident91.2Very high72 Ų7275.3 Ų75.327%0.27239%0.391SS..G310 helixtrans-75.7-22.3177.3-65.1-177.6-179.4-143.10.4113.3Y48 I59 E62 E63 D109 P110Y48-R112 VanDerWaalsContact OH-C 3.24Å; Y48-R112 WeakPolarHBondContact OH-CA 3.46Å; Y48-R112 PolarHBondContact OH-O 2.71Å; I59-R112 HydrophobicContact CG2-CG 3.82Å; E62-R112 IonicContact OE2-CZ 3.88Å; E62-R112 IonicContact OE2-NH1 3.69Å; E62-R112 PolarHBondContact OE2-NH1 3.24Å; E62-R112 IonicContact OE2-NH2 3.85Å; E63-R112 HydrophobicContact CB-CB 4.01Å; E63-R112 HydrophobicContact CG-CB 3.74Å; D109-R112 HydrophobicContact CB-CG 4.03Å; D109-R112 WeakPolarHBondContact O-CB 3.47Å; D109-R112 PolarHBondContact O-N 2.73Å; P110-R112 VanDerWaalsContact C-N 3.25Å; P110-R112 PolarHBondContact O-N 3.03Å
113D85.3Confident91.2Very high10 Ų1074.3 Ų74.35%0.05339%0.392CS..SBendtrans-12477.2172.9-179.116.1000109.5E63 G115 G116 Q117 L118 R119E63-D113 HydrophobicContact CG-CB 4.48Å; D113-G115 PolarHBondContact O-N 3.37Å; D113-G115 VanDerWaalsContact O-N 3.08Å; D113-G116 PolarHBondContact O-N 2.61Å; D113-G116 VanDerWaalsContact OD2-C 3.27Å; D113-G116 WeakPolarHBondContact OD2-CA 3.37Å; D113-Q117 PolarHBondContact OD1-N 3.35Å; D113-L118 VanDerWaalsContact OD1-CB 3.25Å; D113-L118 WeakPolarHBondContact OD1-CB 3.17Å; D113-L118 PolarHBondContact OD1-N 3.44Å; D113-R119 WeakPolarHBondContact OD2-CB 3.46Å; D113-R119 PolarHBondContact OD2-N 2.87Å
114W75.3Confident91.2Very high215 Ų21574.9 Ų74.981%0.81439%0.394SS*.G310 helixtrans-57.5117.2-177.2-170.5-73.1000111.2G116W114-G116 PolarHBondContact O-N 3.33Å
115G83.5Confident91.4Very high71 Ų7173.4 Ų73.473%0.73238%0.379SS*.G310 helixtrans77.22.4-178.800000115D113 Q117D113-G115 PolarHBondContact O-N 3.37Å; D113-G115 VanDerWaalsContact O-N 3.08Å; G115-Q117 PolarHBondContact O-N 3.3Å
116G92Very high91.6Very high25 Ų2571.7 Ų71.726%0.25837%0.369SS..G310 helixtrans71.711.4176.700000114.6D113 W114 A120D113-G116 PolarHBondContact O-N 2.61Å; D113-G116 VanDerWaalsContact OD2-C 3.27Å; D113-G116 WeakPolarHBondContact OD2-CA 3.37Å; W114-G116 PolarHBondContact O-N 3.33Å; G116-A120 VanDerWaalsContact O-CB 3.29Å; G116-A120 WeakPolarHBondContact O-CB 3.47Å; G116-A120 PolarHBondContact O-N 3.39Å
117Q93.3Very high91.8Very high110 Ų11068.1 Ų68.151%0.51435%0.353SS..Hα-helixtrans-71.5-39-171.2-66-173.9-23.500111.6Q40 D113 G115 A120 S121Q40-Q117 HydrophobicContact CG-CB 4.27Å; D113-Q117 PolarHBondContact OD1-N 3.35Å; G115-Q117 PolarHBondContact O-N 3.3Å; Q117-A120 PolarHBondContact O-N 3.27Å; Q117-S121 PolarHBondContact O-N 3.36Å; Q117-S121 PolarHBondContact O-OG 3.31Å
118L94.4Very high92.1Very high1 Ų163.1 Ų63.11%0.00533%0.325CS..Hα-helixtrans-65.4-46.5178.4-177.462.1000110.4K41 Y60 E63 C64 L67 D113 A120 S121 I122K41-L118 HydrophobicContact CB-CD1 4.5Å; K41-L118 HydrophobicContact CG-CD1 3.76Å; Y60-L118 HydrophobicContact CD2-CD2 4.34Å; Y60-L118 HydrophobicContact CE2-CD1 4.42Å; Y60-L118 HydrophobicContact CE2-CD2 3.85Å; E63-L118 HydrophobicContact CG-CD2 4.42Å; C64-L118 HydrophobicContact CB-CD2 4.4Å; L67-L118 HydrophobicContact CD1-CB 4.27Å; L67-L118 HydrophobicContact CD1-CD2 3.93Å; L67-L118 HydrophobicContact CD1-CG 3.86Å; D113-L118 VanDerWaalsContact OD1-CB 3.25Å; D113-L118 WeakPolarHBondContact OD1-CB 3.17Å; D113-L118 PolarHBondContact OD1-N 3.44Å; L118-A120 PolarHBondContact O-N 2.91Å; L118-S121 PolarHBondContact O-N 2.91Å; L118-S121 PolarHBondContact O-OG 3.38Å; L118-I122 HydrophobicContact CD1-CD1 3.77Å; L118-I122 HydrophobicContact CD1-CG1 4.29Å; L118-I122 HydrophobicContact CG-CD1 3.82Å; L118-I122 WeakPolarHBondContact O-CB 3.36Å; L118-I122 WeakPolarHBondContact O-CG1 3.5Å; L118-I122 PolarHBondContact O-N 2.89Å
119R96.3Very high92.4Very high80 Ų8062.1 Ų62.130%0.30232%0.317SS..Hα-helixtrans-58-48173.8176.7-177.1-81.2142.4-10.3111L67 Y71 D105 D113 S121 I122 S123L67-R119 HydrophobicContact CD1-CB 4.06Å; L67-R119 HydrophobicContact CD2-CB 3.92Å; L67-R119 HydrophobicContact CD2-CG 3.99Å; Y71-R119 HydrophobicContact CE2-CG 3.98Å; Y71-R119 WeakPolarHBondContact OH-CG 3.38Å; D105-R119 IonicContact OD1-CZ 3.67Å; D105-R119 IonicContact OD1-NE 3.71Å; D105-R119 IonicContact OD1-NH2 3.29Å; D105-R119 PolarHBondContact OD1-NH2 2.91Å; D105-R119 IonicContact OD2-NH2 2.85Å; D113-R119 WeakPolarHBondContact OD2-CB 3.46Å; D113-R119 PolarHBondContact OD2-N 2.87Å; R119-S121 VanDerWaalsContact C-N 3.35Å; R119-S121 PolarHBondContact O-N 3.1Å; R119-I122 PolarHBondContact O-N 3.36Å; R119-S123 WeakPolarHBondContact O-CB 3.25Å; R119-S123 PolarHBondContact O-N 3.43Å
120A97.2Very high92.8Very high60 Ų6060.9 Ų60.950%0.49631%0.31SS..Hα-helixtrans-60.6-43.5-178.600000112G116 Q117 L118 K124G116-A120 VanDerWaalsContact O-CB 3.29Å; G116-A120 WeakPolarHBondContact O-CB 3.47Å; G116-A120 PolarHBondContact O-N 3.39Å; Q117-A120 PolarHBondContact O-N 3.27Å; L118-A120 PolarHBondContact O-N 2.91Å; A120-K124 WeakPolarHBondContact O-CB 3.49Å; A120-K124 PolarHBondContact O-N 3.4Å
121S97.3Very high93.5Very high17 Ų1757.6 Ų57.612%0.11929%0.286CS..Hα-helixtrans-69.8-43.7-179.767.70000112.6Q40 Q117 L118 R119 K124 K125Q40-S121 WeakPolarHBondContact CB-OG 3.47Å; Q40-S121 WeakPolarHBondContact CG-OG 3.46Å; Q117-S121 PolarHBondContact O-N 3.36Å; Q117-S121 PolarHBondContact O-OG 3.31Å; L118-S121 PolarHBondContact O-N 2.91Å; L118-S121 PolarHBondContact O-OG 3.38Å; R119-S121 VanDerWaalsContact C-N 3.35Å; R119-S121 PolarHBondContact O-N 3.1Å; S121-K124 PolarHBondContact O-N 2.96Å; S121-K125 PolarHBondContact O-N 2.48Å
122I97.8Very high94.2Very high0 Ų049 Ų490%025%0.253CS..Hα-helixtrans-64.8-45177.2-68.1170.5000109.9L67 E68 Y71 L118 R119 K124 K125 W126L67-I122 HydrophobicContact CB-CD1 3.75Å; L67-I122 HydrophobicContact CD1-CD1 4.33Å; E68-I122 HydrophobicContact CG-CD1 4.18Å; E68-I122 HydrophobicContact CG-CG2 4.34Å; Y71-I122 HydrophobicContact CD2-CB 4.4Å; Y71-I122 HydrophobicContact CD2-CG2 3.7Å; Y71-I122 HydrophobicContact CE2-CG2 4.48Å; Y71-I122 HydrophobicContact CG-CG2 4.42Å; L118-I122 HydrophobicContact CD1-CD1 3.77Å; L118-I122 HydrophobicContact CD1-CG1 4.29Å; L118-I122 HydrophobicContact CG-CD1 3.82Å; L118-I122 WeakPolarHBondContact O-CB 3.36Å; L118-I122 WeakPolarHBondContact O-CG1 3.5Å; L118-I122 PolarHBondContact O-N 2.89Å; R119-I122 PolarHBondContact O-N 3.36Å; I122-K124 VanDerWaalsContact C-N 3.29Å; I122-K124 PolarHBondContact O-N 2.68Å; I122-K125 WeakPolarHBondContact O-CB 3.45Å; I122-K125 PolarHBondContact O-N 2.67Å; I122-W126 VanDerWaalsContact O-CD1 3.25Å; I122-W126 PolarHBondContact O-N 3.37Å; I122-W126 VanDerWaalsContact O-N 3.07Å
123S98.2Very high94.7Very high39 Ų3945.7 Ų45.727%0.27324%0.241SC..Hα-helixtrans-56.6-44.4176.3-170.90000111.8Y71 R119 W126 K127Y71-S123 VanDerWaalsContact CE1-CB 3.5Å; Y71-S123 WeakPolarHBondContact CE1-OG 3.32Å; R119-S123 WeakPolarHBondContact O-CB 3.25Å; R119-S123 PolarHBondContact O-N 3.43Å; S123-W126 PolarHBondContact O-N 2.73Å; S123-K127 WeakPolarHBondContact O-CB 3.47Å; S123-K127 PolarHBondContact O-N 3.28Å
124K98.5Very high95Very high120 Ų12047.3 Ų47.352%0.52225%0.25SC..Hα-helixtrans-64.2-42.8177.7-173175.8-179.5-179.50112A33 A120 S121 I122 W126 K127 E128A33-K124 HydrophobicContact CB-CG 4.41Å; A120-K124 WeakPolarHBondContact O-CB 3.49Å; A120-K124 PolarHBondContact O-N 3.4Å; S121-K124 PolarHBondContact O-N 2.96Å; I122-K124 VanDerWaalsContact C-N 3.29Å; I122-K124 PolarHBondContact O-N 2.68Å; K124-W126 PolarHBondContact O-N 3.26Å; K124-K127 PolarHBondContact O-N 2.9Å; K124-E128 PolarHBondContact O-N 3.4Å
125K98.2Very high95.9Very high2 Ų238.4 Ų38.41%0.00922%0.219CC..Hα-helixtrans-52.7-53.8173.9-177.7-168.771.5155.90110.8Y30 Y34 E68 S121 I122 K127 E128 R129 D247Y30-K125 HydrophobicContact CE2-CG 4.29Å; Y34-K125 HydrophobicContact CD2-CD 3.66Å; Y34-K125 HydrophobicContact CD2-CG 4.21Å; Y34-K125 HydrophobicContact CE2-CD 4.07Å; Y34-K125 HydrophobicContact CG-CD 4.37Å; E68-K125 IonicContact OE1-NZ 3.69Å; E68-K125 PolarHBondContact OE1-NZ 3.36Å; E68-K125 WeakPolarHBondContact OE2-CE 3.4Å; E68-K125 IonicContact OE2-NZ 2.68Å; E68-K125 PolarHBondContact OE2-NZ 2.89Å; S121-K125 PolarHBondContact O-N 2.48Å; I122-K125 WeakPolarHBondContact O-CB 3.45Å; I122-K125 PolarHBondContact O-N 2.67Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 2.69Å; K125-E128 PolarHBondContact O-N 2.85Å; K125-R129 PolarHBondContact O-N 3.07Å; K125-D247 IonicContact NZ-OD2 3.76Å; K125-D247 PolarHBondContact NZ-OD2 2.97Å
126W98.6Very high96.3Very high7 Ų735 Ų353%0.02718%0.184CC..Hα-helixtrans-68.1-30.5-179-74.6105.8000113.4E68 F72 W75 I122 S123 K124 R129 E130 M244E68-W126 PolarHBondContact OE2-NE1 3.33Å; F72-W126 HydrophobicContact CB-CH2 3.83Å; F72-W126 HydrophobicContact CB-CZ2 3.59Å; F72-W126 HydrophobicContact CB-CZ3 4.37Å; F72-W126 AromaticContact CD2-CH2 3.46Å; F72-W126 HydrophobicContact CD2-CH2 3.46Å; F72-W126 VanDerWaalsContact CD2-CH2 3.46Å; F72-W126 HydrophobicContact CD2-CZ2 4.11Å; F72-W126 AromaticContact CD2-CZ3 3.84Å; F72-W126 HydrophobicContact CD2-CZ3 3.84Å; F72-W126 HydrophobicContact CE2-CH2 4.46Å; F72-W126 HydrophobicContact CG-CH2 4.06Å; F72-W126 HydrophobicContact CG-CZ2 4.26Å; W75-W126 HydrophobicContact CB-CE3 3.78Å; W75-W126 HydrophobicContact CB-CZ3 4.35Å; W75-W126 HydrophobicContact CD2-CE3 4.13Å; W75-W126 AromaticContact CD2-CZ3 3.9Å; W75-W126 HydrophobicContact CD2-CZ3 3.9Å; W75-W126 HydrophobicContact CE3-CE3 4.47Å; W75-W126 AromaticContact CE3-CZ3 3.9Å; W75-W126 HydrophobicContact CE3-CZ3 3.9Å; W75-W126 AromaticContact CG-CE3 3.8Å; W75-W126 HydrophobicContact CG-CE3 3.8Å; W75-W126 HydrophobicContact CG-CZ3 4.09Å; I122-W126 VanDerWaalsContact O-CD1 3.25Å; I122-W126 PolarHBondContact O-N 3.37Å; I122-W126 VanDerWaalsContact O-N 3.07Å; S123-W126 PolarHBondContact O-N 2.73Å; K124-W126 PolarHBondContact O-N 3.26Å; W126-R129 HydrophobicContact CE3-CB 4.36Å; W126-R129 HydrophobicContact CE3-CG 4.26Å; W126-R129 HydrophobicContact CZ3-CG 4.34Å; W126-R129 WeakPolarHBondContact O-CB 3.41Å; W126-R129 PolarHBondContact O-N 3Å; W126-E130 PolarHBondContact O-N 3.32Å; W126-M244 HydrophobicContact CH2-CB 4.21Å; W126-M244 HydrophobicContact CZ3-CB 4.22Å; W126-M244 HydrophobicContact CZ3-CG 4.49Å; W126-M244 HydrophobicContact CZ3-SD 4.34Å
127K98.4Very high96.3Very high99 Ų9934.8 Ų34.843%0.4318%0.178SC..Hα-helixtrans-69.3-41.7174.7-171.456.3175.4176.20112.4S123 K124 K125 R129 E130 I131S123-K127 WeakPolarHBondContact O-CB 3.47Å; S123-K127 PolarHBondContact O-N 3.28Å; K124-K127 PolarHBondContact O-N 2.9Å; K125-K127 VanDerWaalsContact C-N 3.32Å; K125-K127 PolarHBondContact O-N 2.69Å; K127-R129 VanDerWaalsContact C-N 3.26Å; K127-R129 PolarHBondContact O-N 3.3Å; K127-E130 WeakPolarHBondContact CD-OE2 3.29Å; K127-E130 IonicContact NZ-OE1 2.68Å; K127-E130 PolarHBondContact NZ-OE1 3.28Å; K127-E130 IonicContact NZ-OE2 2.67Å; K127-E130 PolarHBondContact NZ-OE2 3.11Å; K127-E130 VanDerWaalsContact NZ-OE2 3.1Å; K127-E130 WeakPolarHBondContact O-CB 3.31Å; K127-E130 PolarHBondContact O-N 3.03Å; K127-I131 HydrophobicContact CG-CD1 4.29Å; K127-I131 WeakPolarHBondContact O-CD1 3.33Å; K127-I131 VanDerWaalsContact O-CG1 3.29Å; K127-I131 WeakPolarHBondContact O-CG1 3.37Å; K127-I131 PolarHBondContact O-N 2.97Å; K127-I131 VanDerWaalsContact O-N 3.11Å
128E98.4Very high96.1Very high35 Ų3532.8 Ų32.816%0.16418%0.18CC..Hα-helixtrans-66-32.7173.3-67.6-59.4156.200111.6H29 A33 K124 K125 I131 L132H29-E128 WeakPolarHBondContact CB-OE2 3.48Å; A33-E128 HydrophobicContact CB-CB 4.07Å; A33-E128 HydrophobicContact CB-CG 3.71Å; K124-E128 PolarHBondContact O-N 3.4Å; K125-E128 PolarHBondContact O-N 2.85Å; E128-I131 PolarHBondContact O-N 3.35Å; E128-L132 WeakPolarHBondContact O-CB 3.46Å; E128-L132 PolarHBondContact O-N 3.22Å
129R97.8Very high95.9Very high1 Ų135.1 Ų35.10%0.00419%0.189CC..Hα-helixtrans-62-49.8172-178.766.4-157.2-157.99.5112.1Y30 K125 W126 K127 I131 L132 D133 E221 R224 M244Y30-R129 HydrophobicContact CD2-CB 3.97Å; Y30-R129 HydrophobicContact CE2-CB 3.83Å; Y30-R129 HydrophobicContact CE2-CG 4.34Å; K125-R129 PolarHBondContact O-N 3.07Å; W126-R129 HydrophobicContact CE3-CB 4.36Å; W126-R129 HydrophobicContact CE3-CG 4.26Å; W126-R129 HydrophobicContact CZ3-CG 4.34Å; W126-R129 WeakPolarHBondContact O-CB 3.41Å; W126-R129 PolarHBondContact O-N 3Å; K127-R129 VanDerWaalsContact C-N 3.26Å; K127-R129 PolarHBondContact O-N 3.3Å; R129-I131 VanDerWaalsContact C-N 3.29Å; R129-I131 PolarHBondContact O-N 3.44Å; R129-L132 WeakPolarHBondContact O-CB 3.39Å; R129-L132 PolarHBondContact O-N 3.14Å; R129-L132 VanDerWaalsContact O-N 3.14Å; R129-D133 IonicContact CZ-OD1 3.36Å; R129-D133 VanDerWaalsContact CZ-OD1 3.29Å; R129-D133 IonicContact CZ-OD2 2.68Å; R129-D133 IonicContact NE-OD1 3.17Å; R129-D133 PolarHBondContact NE-OD1 2.7Å; R129-D133 VanDerWaalsContact NE-OD1 3.14Å; R129-D133 IonicContact NE-OD2 3.56Å; R129-D133 PolarHBondContact NE-OD2 3.28Å; R129-D133 IonicContact NH2-OD1 3.76Å; R129-D133 PolarHBondContact NH2-OD1 3.45Å; R129-D133 IonicContact NH2-OD2 2.81Å; R129-D133 PolarHBondContact O-N 3.46Å; R129-E221 IonicContact CZ-OE2 2.93Å; R129-E221 IonicContact NH1-OE1 3.71Å; R129-E221 PolarHBondContact NH1-OE1 2.64Å; R129-E221 IonicContact NH1-OE2 2.72Å; R129-E221 PolarHBondContact NH1-OE2 3.13Å; R129-R224 VanDerWaalsContact NH2-CZ 3.29Å; R129-M244 HydrophobicContact CG-SD 4.12Å; R129-M244 PolarHBondContact NE-SD 3.39Å; R129-M244 VanDerWaalsContact NE-SD 3.41Å; R129-M244 PolarHBondContact NH1-SD 3.32Å
130E97.7Very high95.5Very high25 Ų2532.2 Ų32.212%0.11718%0.18CC..Hα-helixtrans-53-47.2175.3-171.2-166.3130.700111.3H78 W126 K127 D133 D134H78-E130 IonicContact CE1-OE1 2.73Å; H78-E130 IonicContact ND1-OE1 2.65Å; H78-E130 IonicContact NE2-OE1 2.89Å; W126-E130 PolarHBondContact O-N 3.32Å; K127-E130 WeakPolarHBondContact CD-OE2 3.29Å; K127-E130 IonicContact NZ-OE1 2.68Å; K127-E130 PolarHBondContact NZ-OE1 3.28Å; K127-E130 IonicContact NZ-OE2 2.67Å; K127-E130 PolarHBondContact NZ-OE2 3.11Å; K127-E130 VanDerWaalsContact NZ-OE2 3.1Å; K127-E130 WeakPolarHBondContact O-CB 3.31Å; K127-E130 PolarHBondContact O-N 3.03Å; E130-D133 PolarHBondContact O-N 2.94Å; E130-D134 PolarHBondContact O-N 2.82Å
131I97.5Very high94.9Very high41 Ų4133.6 Ų33.621%0.2119%0.191CC..Hα-helixtrans-67.7-37.6179.9-61.5162.6000111.8R26 K127 E128 R129 V135R26-I131 VanDerWaalsContact CZ-CG2 3.5Å; K127-I131 HydrophobicContact CG-CD1 4.29Å; K127-I131 WeakPolarHBondContact O-CD1 3.33Å; K127-I131 VanDerWaalsContact O-CG1 3.29Å; K127-I131 WeakPolarHBondContact O-CG1 3.37Å; K127-I131 PolarHBondContact O-N 2.97Å; K127-I131 VanDerWaalsContact O-N 3.11Å; E128-I131 PolarHBondContact O-N 3.35Å; R129-I131 VanDerWaalsContact C-N 3.29Å; R129-I131 PolarHBondContact O-N 3.44Å; I131-V135 WeakPolarHBondContact O-CG2 3.2Å; I131-V135 PolarHBondContact O-N 3.2Å
132L97.1Very high94.2Very high0 Ų034.1 Ų34.10%020%0.199CC..Hα-helixtrans-61.8-48.1174.9172.459000110.7L23 R26 I27 Y30 E128 R129 D134 V135 E136L23-L132 HydrophobicContact CD1-CD1 3.76Å; R26-L132 HydrophobicContact CB-CB 4.5Å; R26-L132 HydrophobicContact CB-CD1 3.79Å; I27-L132 HydrophobicContact CG1-CD1 3.69Å; I27-L132 HydrophobicContact CG1-CD2 4.25Å; Y30-L132 HydrophobicContact CD1-CD2 3.9Å; Y30-L132 HydrophobicContact CG-CD2 4.06Å; E128-L132 WeakPolarHBondContact O-CB 3.46Å; E128-L132 PolarHBondContact O-N 3.22Å; R129-L132 WeakPolarHBondContact O-CB 3.39Å; R129-L132 PolarHBondContact O-N 3.14Å; R129-L132 VanDerWaalsContact O-N 3.14Å; L132-D134 VanDerWaalsContact C-N 3.3Å; L132-D134 PolarHBondContact O-N 3.5Å; L132-V135 PolarHBondContact O-N 3.31Å; L132-E136 WeakPolarHBondContact O-CB 3.15Å; L132-E136 PolarHBondContact O-N 3.4Å
133D95.6Very high92.9Very high2 Ų240.5 Ų40.51%0.01124%0.241CC..Hα-helixtrans-67-31.4-177.9-65.4-39.8000112.4W75 Y79 R129 E130 S137W75-D133 VanDerWaalsContact CE2-OD2 3.25Å; W75-D133 VanDerWaalsContact CZ2-OD2 3.26Å; W75-D133 WeakPolarHBondContact CZ2-OD2 3.31Å; W75-D133 PolarHBondContact NE1-OD2 3.13Å; Y79-D133 HydrophobicContact CD2-CB 3.93Å; Y79-D133 HydrophobicContact CE2-CB 4.14Å; R129-D133 IonicContact CZ-OD1 3.36Å; R129-D133 VanDerWaalsContact CZ-OD1 3.29Å; R129-D133 IonicContact CZ-OD2 2.68Å; R129-D133 IonicContact NE-OD1 3.17Å; R129-D133 PolarHBondContact NE-OD1 2.7Å; R129-D133 VanDerWaalsContact NE-OD1 3.14Å; R129-D133 IonicContact NE-OD2 3.56Å; R129-D133 PolarHBondContact NE-OD2 3.28Å; R129-D133 IonicContact NH2-OD1 3.76Å; R129-D133 PolarHBondContact NH2-OD1 3.45Å; R129-D133 IonicContact NH2-OD2 2.81Å; R129-D133 PolarHBondContact O-N 3.46Å; E130-D133 PolarHBondContact O-N 2.94Å; D133-S137 VanDerWaalsContact O-CB 3.28Å; D133-S137 WeakPolarHBondContact O-CB 3.36Å; D133-S137 PolarHBondContact O-N 2.9Å; D133-S137 PolarHBondContact O-OG 2.91Å
134D93.1Very high91.3Very high44 Ų4447.8 Ų47.824%0.23526%0.262CS..Hα-helixtrans-61.8-46171.8-84.4-9.1000112.4H78 K82 E130 L132 S137 A138H78-D134 IonicContact NE2-OD1 2.93Å; K82-D134 VanDerWaalsContact CD-OD1 3.29Å; K82-D134 WeakPolarHBondContact CD-OD1 3.12Å; K82-D134 WeakPolarHBondContact CE-OD1 3.14Å; K82-D134 IonicContact NZ-OD1 2.71Å; K82-D134 PolarHBondContact NZ-OD1 2.93Å; K82-D134 IonicContact NZ-OD2 2.76Å; K82-D134 PolarHBondContact NZ-OD2 3.14Å; E130-D134 PolarHBondContact O-N 2.82Å; L132-D134 VanDerWaalsContact C-N 3.3Å; L132-D134 PolarHBondContact O-N 3.5Å; D134-S137 PolarHBondContact O-N 3Å; D134-A138 PolarHBondContact O-N 3.27Å; D134-A138 VanDerWaalsContact O-N 3.15Å
135V93.3Very high89.3Confident28 Ų2847.3 Ų47.317%0.1727%0.27CS..Hα-helixtrans-71.6-39.2178.6172.90000111H22 L23 R26 I131 L132 S137 A138 Y139H22-V135 WeakPolarHBondContact CD2-CG1 3.35Å; L23-V135 HydrophobicContact CB-CG1 4.47Å; L23-V135 HydrophobicContact CD1-CG1 3.9Å; R26-V135 HydrophobicContact CG-CB 4.3Å; R26-V135 HydrophobicContact CG-CG1 4.34Å; R26-V135 HydrophobicContact CG-CG2 4.03Å; I131-V135 WeakPolarHBondContact O-CG2 3.2Å; I131-V135 PolarHBondContact O-N 3.2Å; L132-V135 PolarHBondContact O-N 3.31Å; V135-S137 VanDerWaalsContact C-N 3.34Å; V135-A138 PolarHBondContact O-N 3Å; V135-Y139 WeakPolarHBondContact O-CB 3.38Å; V135-Y139 PolarHBondContact O-N 3.47Å
136E92.8Very high87.2Confident0 Ų055.1 Ų55.10%031%0.311CS..Hα-helixtrans-57.3-48.1172.8-178.8-173101.900110.6L132 A138 Y139 I140 R224 I225 L228 I240L132-E136 WeakPolarHBondContact O-CB 3.15Å; L132-E136 PolarHBondContact O-N 3.4Å; E136-A138 VanDerWaalsContact C-N 3.34Å; E136-A138 PolarHBondContact O-N 2.96Å; E136-Y139 WeakPolarHBondContact O-CB 3.46Å; E136-Y139 PolarHBondContact O-N 2.99Å; E136-I140 HydrophobicContact CG-CD1 3.75Å; E136-I140 HydrophobicContact CG-CG1 4.47Å; E136-I140 VanDerWaalsContact O-CG1 3.32Å; E136-I140 WeakPolarHBondContact O-CG1 2.97Å; E136-I140 PolarHBondContact O-N 3.32Å; E136-R224 IonicContact OE2-CZ 3.55Å; E136-R224 IonicContact OE2-NE 3.47Å; E136-R224 IonicContact OE2-NH2 3.49Å; E136-R224 PolarHBondContact OE2-NH2 2.9Å; E136-I225 HydrophobicContact CG-CD1 4.46Å; E136-I225 HydrophobicContact CG-CG1 3.89Å; E136-I225 HydrophobicContact CG-CG2 4.4Å; E136-I225 WeakPolarHBondContact OE2-CG1 3.49Å; E136-L228 VanDerWaalsContact OE1-CD1 3.24Å; E136-L228 WeakPolarHBondContact OE1-CD1 3.36Å; E136-I240 WeakPolarHBondContact OE1-CD1 3.25Å
137S91.2Very high85.3Confident20 Ų2056.7 Ų56.714%0.1432%0.321CS..Hα-helixtrans-60.7-43.1179.6-60.70000111.7N83 D133 D134 V135 I140 A141N83-S137 PolarHBondContact OD1-OG 2.86Å; D133-S137 VanDerWaalsContact O-CB 3.28Å; D133-S137 WeakPolarHBondContact O-CB 3.36Å; D133-S137 PolarHBondContact O-N 2.9Å; D133-S137 PolarHBondContact O-OG 2.91Å; D134-S137 PolarHBondContact O-N 3Å; V135-S137 VanDerWaalsContact C-N 3.34Å; S137-I140 PolarHBondContact O-N 2.96Å; S137-A141 WeakPolarHBondContact O-CB 3.45Å; S137-A141 PolarHBondContact O-N 3.24Å
138A89.7Confident83.7Confident67 Ų6759.1 Ų59.155%0.55434%0.339SS*.Hα-helixtrans-65.3-40.1175.800000112.4D134 V135 E136 A141 G142D134-A138 PolarHBondContact O-N 3.27Å; D134-A138 VanDerWaalsContact O-N 3.15Å; V135-A138 PolarHBondContact O-N 3Å; E136-A138 VanDerWaalsContact C-N 3.34Å; E136-A138 PolarHBondContact O-N 2.96Å; A138-A141 PolarHBondContact O-N 3.35Å; A138-G142 PolarHBondContact O-N 2.96Å; A138-G142 VanDerWaalsContact O-N 3.13Å
139Y89Confident82.4Confident50 Ų5058.5 Ų58.520%0.19634%0.338CS..Hα-helixtrans-62.9-45.3175.5170.9-105.1000111.9P20 L23 V135 E136 A141 G142 I225 T229P20-Y139 VanDerWaalsContact CD-CE2 3.42Å; P20-Y139 HydrophobicContact CG-CD2 3.75Å; P20-Y139 HydrophobicContact CG-CE2 3.67Å; L23-Y139 HydrophobicContact CD2-CD1 4.04Å; L23-Y139 HydrophobicContact CD2-CE1 4.44Å; L23-Y139 HydrophobicContact CD2-CG 4.17Å; V135-Y139 WeakPolarHBondContact O-CB 3.38Å; V135-Y139 PolarHBondContact O-N 3.47Å; E136-Y139 WeakPolarHBondContact O-CB 3.46Å; E136-Y139 PolarHBondContact O-N 2.99Å; Y139-A141 PolarHBondContact O-N 3.28Å; Y139-G142 PolarHBondContact O-N 2.99Å; Y139-I225 HydrophobicContact CD1-CG2 3.79Å; Y139-I225 HydrophobicContact CE1-CG2 3.76Å; Y139-T229 HydrophobicContact CD1-CG2 4.43Å; Y139-T229 HydrophobicContact CE1-CG2 3.8Å
140I87.4Confident81.8Confident19 Ų1963.3 Ų63.310%0.09736%0.363CS..Hα-helixtrans-66.5-36.9179.4-67.8167.6000111.7E136 S137 G142 L228 T229E136-I140 HydrophobicContact CG-CD1 3.75Å; E136-I140 HydrophobicContact CG-CG1 4.47Å; E136-I140 VanDerWaalsContact O-CG1 3.32Å; E136-I140 WeakPolarHBondContact O-CG1 2.97Å; E136-I140 PolarHBondContact O-N 3.32Å; S137-I140 PolarHBondContact O-N 2.96Å; I140-G142 VanDerWaalsContact C-N 3.28Å; I140-L228 HydrophobicContact CD1-CB 3.71Å; I140-L228 HydrophobicContact CD1-CD1 4.28Å; I140-T229 HydrophobicContact CG1-CG2 4.2Å
141A85.1Confident81.3Confident90 Ų9065.1 Ų65.174%0.74437%0.371SS*.Hα-helixtrans-75.2-16.1178.100000113.6S137 A138 Y139S137-A141 WeakPolarHBondContact O-CB 3.45Å; S137-A141 PolarHBondContact O-N 3.24Å; A138-A141 PolarHBondContact O-N 3.35Å; Y139-A141 PolarHBondContact O-N 3.28Å
142G82.8Confident80.9Confident27 Ų2767.9 Ų67.928%0.27838%0.383SS..SBendtrans-65.6167.2-179.800000113.8A138 Y139 I140 R144A138-G142 PolarHBondContact O-N 2.96Å; A138-G142 VanDerWaalsContact O-N 3.13Å; Y139-G142 PolarHBondContact O-N 2.99Å; I140-G142 VanDerWaalsContact C-N 3.28Å; G142-R144 PolarHBondContact O-N 3.38Å; G142-R144 VanDerWaalsContact O-N 3.12Å
143P70.9Confident80.5Confident135 Ų13570.5 Ų70.588%0.87740%0.395SS*.  trans-56.4120.3175.7-20.731.3000110.2T145P143-T145 PolarHBondContact O-N 3.01Å
144R64.7Low80.2Confident192 Ų19270.5 Ų70.573%0.72540%0.395SS*.  trans-67.6102.7177-65.1-179.6-178.4164.6-1.3108.3G142 N146G142-R144 PolarHBondContact O-N 3.38Å; G142-R144 VanDerWaalsContact O-N 3.12Å; R144-N146 PolarHBondContact O-N 2.65Å
145T57.1Low80.1Confident110 Ų11071.9 Ų71.968%0.67540%0.399SS*.  trans-56.4133.4151.450.30000106P143 V147P143-T145 PolarHBondContact O-N 3.01Å; T145-V147 VanDerWaalsContact O-CG2 3.24Å; T145-V147 WeakPolarHBondContact O-CG2 3.18Å; T145-V147 PolarHBondContact O-N 2.93Å
146N53Low80.1Confident166 Ų16676.5 Ų76.589%0.88842%0.417SS*.  trans-65.974.9-175.5-153.61.6000109.5R144 N148R144-N146 PolarHBondContact O-N 2.65Å; N146-N148 PolarHBondContact O-N 2.89Å; N146-N148 VanDerWaalsContact O-N 3.08Å
147V58.9Low80Confident39 Ų3977.1 Ų77.124%0.23642%0.42CS..  trans-76.9102177.9-161.50000104.1T145 V149T145-V147 VanDerWaalsContact O-CG2 3.24Å; T145-V147 WeakPolarHBondContact O-CG2 3.18Å; T145-V147 PolarHBondContact O-N 2.93Å; V147-V149 HydrophobicContact CB-CG2 3.63Å; V147-V149 HydrophobicContact CG1-CG2 3.22Å; V147-V149 WeakPolarHBondContact O-CG2 3.25Å; V147-V149 PolarHBondContact O-N 3.01Å
148N65.1Low80Confident150 Ų15077.9 Ų77.980%0.80242%0.422SS*.  trans-66.385.1170.7-174.89.8000107.7N146N146-N148 PolarHBondContact O-N 2.89Å; N146-N148 VanDerWaalsContact O-N 3.08Å
149V71.5Confident80.3Confident22 Ų2278.6 Ų78.613%0.13342%0.42CS..  trans-105.6125.1179.3-164.60000108.6L15 V147 K151 L154 T230L15-V149 HydrophobicContact CD2-CG1 4.45Å; L15-V149 HydrophobicContact CD2-CG2 4.39Å; V147-V149 HydrophobicContact CB-CG2 3.63Å; V147-V149 HydrophobicContact CG1-CG2 3.22Å; V147-V149 WeakPolarHBondContact O-CG2 3.25Å; V147-V149 PolarHBondContact O-N 3.01Å; V149-K151 PolarHBondContact O-N 3.01Å; V149-K151 VanDerWaalsContact O-N 3.14Å; V149-L154 HydrophobicContact CB-CD1 4.42Å; V149-L154 HydrophobicContact CG1-CD1 3.2Å; V149-L154 HydrophobicContact CG1-CD2 4.17Å; V149-L154 HydrophobicContact CG1-CG 3.53Å; V149-T230 HydrophobicContact CB-CG2 4.41Å
150N84Confident80.5Confident102 Ų10280.5 Ų80.555%0.54543%0.434SS..  trans-76.9102174.1-176.6-22.4000109.4E152 E153 L154N150-E152 VanDerWaalsContact C-N 3.28Å; N150-E152 PolarHBondContact O-N 2.81Å; N150-E152 PolarHBondContact OD1-N 3.19Å; N150-E152 VanDerWaalsContact OD1-N 3.16Å; N150-E153 HydrophobicContact CB-CB 3.83Å; N150-E153 PolarHBondContact O-N 2.92Å; N150-E153 VanDerWaalsContact O-N 3.17Å; N150-E153 PolarHBondContact OD1-N 3.21Å; N150-L154 PolarHBondContact O-N 3.43Å
151K87.1Confident80.9Confident64 Ų6480.2 Ų80.228%0.27843%0.432SS..Hα-helixtrans-51.7-42.6179.8176.1174175168.80113V149 L154 K155 L227 L231V149-K151 PolarHBondContact O-N 3.01Å; V149-K151 VanDerWaalsContact O-N 3.14Å; K151-L154 PolarHBondContact O-N 3.11Å; K151-K155 WeakPolarHBondContact O-CG 3.26Å; K151-K155 PolarHBondContact O-N 3.37Å; K151-L227 HydrophobicContact CG-CD1 4Å; K151-L231 HydrophobicContact CD-CD2 4.21Å; K151-L231 VanDerWaalsContact NZ-CD2 3.28Å
152E90.4Very high81.4Confident99 Ų9977.3 Ų77.346%0.46341%0.412SS..Hα-helixtrans-73.8-34.2-177.7-66.9-54.2126.800112.3N150 K155 K156N150-E152 VanDerWaalsContact C-N 3.28Å; N150-E152 PolarHBondContact O-N 2.81Å; N150-E152 PolarHBondContact OD1-N 3.19Å; N150-E152 VanDerWaalsContact OD1-N 3.16Å; E152-K155 IonicContact OE1-NZ 2.79Å; E152-K155 PolarHBondContact OE1-NZ 3.48Å; E152-K155 IonicContact OE2-NZ 3.7Å; E152-K156 WeakPolarHBondContact O-CG 3.23Å; E152-K156 PolarHBondContact O-N 3.33Å; E152-K156 VanDerWaalsContact O-N 3.14Å
153E88.8Confident82Confident54 Ų5480.6 Ų80.625%0.25242%0.423SS..Hα-helixtrans-67-42.8173.2-17654.6-149.200111.4L8 N150 K155 K156 Q157L8-E153 WeakPolarHBondContact CD2-OE1 3.31Å; N150-E153 HydrophobicContact CB-CB 3.83Å; N150-E153 PolarHBondContact O-N 2.92Å; N150-E153 VanDerWaalsContact O-N 3.17Å; N150-E153 PolarHBondContact OD1-N 3.21Å; E153-K155 PolarHBondContact O-N 2.87Å; E153-K156 WeakPolarHBondContact O-CB 3.3Å; E153-K156 PolarHBondContact O-N 2.93Å; E153-Q157 WeakPolarHBondContact O-CG 3.43Å; E153-Q157 PolarHBondContact O-N 3.16Å; E153-Q157 PolarHBondContact OE1-NE2 2.68Å; E153-Q157 VanDerWaalsContact OE1-NE2 3.07Å
154L87.8Confident83.2Confident3 Ų378.3 Ų78.32%0.01640%0.403CS..Hα-helixtrans-61.2-42.3174.6-80-172000112.9L15 V149 N150 K151 K156 Q157 L158 L226 L227L15-L154 HydrophobicContact CD1-CD2 4.03Å; V149-L154 HydrophobicContact CB-CD1 4.42Å; V149-L154 HydrophobicContact CG1-CD1 3.2Å; V149-L154 HydrophobicContact CG1-CD2 4.17Å; V149-L154 HydrophobicContact CG1-CG 3.53Å; N150-L154 PolarHBondContact O-N 3.43Å; K151-L154 PolarHBondContact O-N 3.11Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.39Å; L154-Q157 PolarHBondContact O-N 2.94Å; L154-L158 WeakPolarHBondContact O-CB 3.07Å; L154-L158 PolarHBondContact O-N 2.81Å; L154-L226 HydrophobicContact CD1-CB 3.86Å; L154-L226 HydrophobicContact CD2-CB 4.35Å; L154-L227 HydrophobicContact CB-CB 4.41Å; L154-L227 HydrophobicContact CB-CD1 4.15Å; L154-L227 HydrophobicContact CD1-CB 4.04Å; L154-L227 HydrophobicContact CD1-CD1 4.43Å
155K92.4Very high84.7Confident73 Ų7370.4 Ų70.432%0.31738%0.375SS..Hα-helixtrans-57.8-46175-76.7174.8-179.8172.60111K151 E152 E153 Q157 L158 T159 L227K151-K155 WeakPolarHBondContact O-CG 3.26Å; K151-K155 PolarHBondContact O-N 3.37Å; E152-K155 IonicContact OE1-NZ 2.79Å; E152-K155 PolarHBondContact OE1-NZ 3.48Å; E152-K155 IonicContact OE2-NZ 3.7Å; E153-K155 PolarHBondContact O-N 2.87Å; K155-Q157 PolarHBondContact O-N 2.73Å; K155-L158 PolarHBondContact O-N 3.32Å; K155-T159 WeakPolarHBondContact O-CB 3.34Å; K155-T159 PolarHBondContact O-N 3.08Å; K155-T159 PolarHBondContact O-OG1 2.86Å; K155-L227 HydrophobicContact CG-CD1 3.99Å; K155-L227 HydrophobicContact CG-CD2 3.95Å
156K92.6Very high86.5Confident125 Ų12569.6 Ų69.654%0.54336%0.363SS..Hα-helixtrans-61.5-43.8177.3-72.1173.6-175174.90112.1E152 E153 L154 T159 N160E152-K156 WeakPolarHBondContact O-CG 3.23Å; E152-K156 PolarHBondContact O-N 3.33Å; E152-K156 VanDerWaalsContact O-N 3.14Å; E153-K156 WeakPolarHBondContact O-CB 3.3Å; E153-K156 PolarHBondContact O-N 2.93Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.39Å; K156-T159 PolarHBondContact O-N 3.45Å; K156-N160 WeakPolarHBondContact O-CB 3.44Å; K156-N160 PolarHBondContact O-N 2.85Å; K156-N160 PolarHBondContact O-ND2 3.36Å
157Q89.8Confident88.6Confident13 Ų1364.6 Ų64.66%0.06135%0.345CS..Hα-helixtrans-61-49.2176.5-71.2174.711.200110.9L8 E153 L154 K155 T159 N160 T161 Q223L8-Q157 HydrophobicContact CD2-CG 4.17Å; E153-Q157 WeakPolarHBondContact O-CG 3.43Å; E153-Q157 PolarHBondContact O-N 3.16Å; E153-Q157 PolarHBondContact OE1-NE2 2.68Å; E153-Q157 VanDerWaalsContact OE1-NE2 3.07Å; L154-Q157 PolarHBondContact O-N 2.94Å; K155-Q157 PolarHBondContact O-N 2.73Å; Q157-T159 PolarHBondContact O-N 3.43Å; Q157-N160 PolarHBondContact O-N 3.47Å; Q157-T161 PolarHBondContact O-N 2.96Å; Q157-T161 PolarHBondContact O-OG1 3.15Å; Q157-Q223 PolarHBondContact O-OE1 3.38Å
158L92.7Very high90.4Very high36 Ų3664.1 Ų64.119%0.18834%0.34CS..Hα-helixtrans-61.4-41.4178.5-174.461.2000112.4L154 K155 T161 G162 A220 Q223 R224 L227L154-L158 WeakPolarHBondContact O-CB 3.07Å; L154-L158 PolarHBondContact O-N 2.81Å; K155-L158 PolarHBondContact O-N 3.32Å; L158-T161 PolarHBondContact O-N 3.34Å; L158-G162 PolarHBondContact O-N 3.38Å; L158-A220 HydrophobicContact CD1-CB 4.08Å; L158-Q223 VanDerWaalsContact CA-OE1 3.26Å; L158-Q223 HydrophobicContact CB-CB 4.44Å; L158-Q223 HydrophobicContact CD1-CB 4.09Å; L158-R224 HydrophobicContact CD1-CB 4.31Å; L158-R224 HydrophobicContact CD2-CB 4.29Å; L158-R224 HydrophobicContact CD2-CG 4.45Å; L158-L227 HydrophobicContact CD2-CD2 3.86Å
159T94.8Very high91.9Very high82 Ų8258.1 Ų58.150%0.50331%0.308SS..Hα-helixtrans-62.3-45.7174.1-61.80000111.7K155 K156 Q157 T161 G162 N163K155-T159 WeakPolarHBondContact O-CB 3.34Å; K155-T159 PolarHBondContact O-N 3.08Å; K155-T159 PolarHBondContact O-OG1 2.86Å; K156-T159 PolarHBondContact O-N 3.45Å; Q157-T159 PolarHBondContact O-N 3.43Å; T159-T161 PolarHBondContact O-N 2.9Å; T159-G162 PolarHBondContact O-N 2.93Å; T159-N163 VanDerWaalsContact O-CG 3.28Å; T159-N163 PolarHBondContact O-N 2.96Å; T159-N163 PolarHBondContact O-ND2 2.97Å
160N94.5Very high93Very high90 Ų9061 Ų6148%0.48132%0.323SS..Hα-helixtrans-62.3-43.4177.9-70.6-24.4000111.6K156 Q157 N163 N164K156-N160 WeakPolarHBondContact O-CB 3.44Å; K156-N160 PolarHBondContact O-N 2.85Å; K156-N160 PolarHBondContact O-ND2 3.36Å; Q157-N160 PolarHBondContact O-N 3.47Å; N160-N163 PolarHBondContact O-N 3.35Å; N160-N164 VanDerWaalsContact O-CG 3.31Å; N160-N164 PolarHBondContact O-N 3.24Å; N160-N164 VanDerWaalsContact O-N 3.09Å; N160-N164 PolarHBondContact O-ND2 3.13Å
161T94.6Very high93.6Very high12 Ų1258.6 Ų58.67%0.07431%0.31CS..Hα-helixtrans-64.2-41.6176-50.60000111.1Q157 L158 T159 N163 N164 I165 E219 A220 Q223Q157-T161 PolarHBondContact O-N 2.96Å; Q157-T161 PolarHBondContact O-OG1 3.15Å; L158-T161 PolarHBondContact O-N 3.34Å; T159-T161 PolarHBondContact O-N 2.9Å; T161-N163 VanDerWaalsContact C-N 3.35Å; T161-N163 PolarHBondContact O-N 3.24Å; T161-N164 WeakPolarHBondContact O-CB 3.45Å; T161-N164 PolarHBondContact O-N 2.97Å; T161-N164 VanDerWaalsContact O-N 3.15Å; T161-I165 HydrophobicContact CG2-CD1 4.25Å; T161-I165 WeakPolarHBondContact O-CG1 3.47Å; T161-I165 PolarHBondContact O-N 3.4Å; T161-E219 HydrophobicContact CG2-CB 4.12Å; T161-E219 HydrophobicContact CG2-CG 3.87Å; T161-A220 HydrophobicContact CG2-CB 3.86Å; T161-Q223 VanDerWaalsContact OG1-CD 3.27Å; T161-Q223 PolarHBondContact OG1-NE2 3.26Å; T161-Q223 PolarHBondContact OG1-OE1 2.75Å
162G95Very high94Very high30 Ų3055.8 Ų55.831%0.30930%0.298SS..Hα-helixtrans-58.5-43174.900000113L158 T159 N164 I165 E166L158-G162 PolarHBondContact O-N 3.38Å; T159-G162 PolarHBondContact O-N 2.93Å; G162-N164 VanDerWaalsContact C-N 3.34Å; G162-N164 PolarHBondContact O-N 3.09Å; G162-I165 PolarHBondContact O-N 2.95Å; G162-E166 PolarHBondContact O-N 3.34Å
163N96.2Very high94.2Very high95 Ų9555.5 Ų55.551%0.50830%0.296SS..Hα-helixtrans-63.7-39.5175-66.6-17.5000111.9T159 N160 T161 E166 A167T159-N163 VanDerWaalsContact O-CG 3.28Å; T159-N163 PolarHBondContact O-N 2.96Å; T159-N163 PolarHBondContact O-ND2 2.97Å; N160-N163 PolarHBondContact O-N 3.35Å; T161-N163 VanDerWaalsContact C-N 3.35Å; T161-N163 PolarHBondContact O-N 3.24Å; N163-E166 PolarHBondContact O-N 3.37Å; N163-A167 PolarHBondContact O-N 3.44Å
164N96.8Very high94.5Very high88 Ų8858.5 Ų58.547%0.47131%0.31SS..Hα-helixtrans-66.4-38.9175.9-67-20.2000112N160 T161 G162 Q168 L216N160-N164 VanDerWaalsContact O-CG 3.31Å; N160-N164 PolarHBondContact O-N 3.24Å; N160-N164 VanDerWaalsContact O-N 3.09Å; N160-N164 PolarHBondContact O-ND2 3.13Å; T161-N164 WeakPolarHBondContact O-CB 3.45Å; T161-N164 PolarHBondContact O-N 2.97Å; T161-N164 VanDerWaalsContact O-N 3.15Å; G162-N164 VanDerWaalsContact C-N 3.34Å; G162-N164 PolarHBondContact O-N 3.09Å; N164-Q168 VanDerWaalsContact O-CB 3.31Å; N164-Q168 WeakPolarHBondContact O-CB 3.37Å; N164-Q168 PolarHBondContact O-N 3.18Å; N164-L216 HydrophobicContact CB-CD1 4.19Å; N164-L216 HydrophobicContact CB-CD2 4.19Å
165I96.2Very high94.9Very high25 Ų2559.4 Ų59.413%0.12831%0.314CS..Hα-helixtrans-61.1-46.1174-70.9167.1000110.1T161 G162 Q168 L169 L213 L216 M217 A220T161-I165 HydrophobicContact CG2-CD1 4.25Å; T161-I165 WeakPolarHBondContact O-CG1 3.47Å; T161-I165 PolarHBondContact O-N 3.4Å; G162-I165 PolarHBondContact O-N 2.95Å; I165-Q168 PolarHBondContact O-N 3.41Å; I165-L169 HydrophobicContact CG2-CD1 3.87Å; I165-L169 HydrophobicContact CG2-CG 4.32Å; I165-L169 WeakPolarHBondContact O-CB 3.39Å; I165-L169 WeakPolarHBondContact O-CG 3.47Å; I165-L169 PolarHBondContact O-N 3.49Å; I165-L213 HydrophobicContact CG2-CD1 4Å; I165-L216 HydrophobicContact CG1-CB 3.69Å; I165-M217 HydrophobicContact CD1-CG 4.17Å; I165-M217 HydrophobicContact CG1-CG 4.35Å; I165-M217 HydrophobicContact CG2-CG 4.32Å; I165-A220 HydrophobicContact CD1-CB 3.59Å
166E95.1Very high95Very high93 Ų9356.5 Ų56.544%0.43530%0.302SS..Hα-helixtrans-63.7-43.7-179.8-170.9163.2147.700112.3G162 N163 Q168 L169 N170 K246G162-E166 PolarHBondContact O-N 3.34Å; N163-E166 PolarHBondContact O-N 3.37Å; E166-Q168 VanDerWaalsContact C-N 3.33Å; E166-Q168 PolarHBondContact O-N 3.22Å; E166-L169 PolarHBondContact O-N 2.95Å; E166-N170 PolarHBondContact O-N 2.89Å; E166-N170 VanDerWaalsContact O-N 3.13Å; E166-N170 PolarHBondContact O-ND2 3.48Å; E166-K246 IonicContact OE2-NZ 3.35Å; E166-K246 PolarHBondContact OE2-NZ 3.44Å
167A96.8Very high94.9Very high61 Ų6153.3 Ų53.350%0.50430%0.295SS..Hα-helixtrans-60.2-43.2173.300000111.9N163 N170 N171N163-A167 PolarHBondContact O-N 3.44Å; A167-N170 PolarHBondContact O-N 3.45Å; A167-N171 PolarHBondContact O-N 3.44Å
168Q97Very high95.1Very high29 Ų2958 Ų5814%0.13632%0.315CS..Hα-helixtrans-70.4-34.9179.8-171.365.77.800112.5N164 I165 E166 N170 N171 V172 E209 L213 L216N164-Q168 VanDerWaalsContact O-CB 3.31Å; N164-Q168 WeakPolarHBondContact O-CB 3.37Å; N164-Q168 PolarHBondContact O-N 3.18Å; I165-Q168 PolarHBondContact O-N 3.41Å; E166-Q168 VanDerWaalsContact C-N 3.33Å; E166-Q168 PolarHBondContact O-N 3.22Å; Q168-N170 VanDerWaalsContact C-N 3.32Å; Q168-N170 PolarHBondContact O-N 3.38Å; Q168-N171 PolarHBondContact O-N 3.22Å; Q168-N171 PolarHBondContact OE1-ND2 3.42Å; Q168-V172 WeakPolarHBondContact O-CB 3.34Å; Q168-V172 WeakPolarHBondContact O-CG2 3.39Å; Q168-V172 PolarHBondContact O-N 3.01Å; Q168-E209 PolarHBondContact NE2-O 3.23Å; Q168-E209 PolarHBondContact NE2-OE2 2.77Å; Q168-L213 HydrophobicContact CB-CD1 4.11Å; Q168-L213 HydrophobicContact CG-CB 3.7Å; Q168-L213 HydrophobicContact CG-CD1 4.11Å; Q168-L213 HydrophobicContact CG-CG 4.48Å; Q168-L216 HydrophobicContact CB-CD1 4Å; Q168-L216 HydrophobicContact CG-CD1 4.31Å
169L95.4Very high95.2Very high25 Ų2556.3 Ų56.313%0.13131%0.307CS..Hα-helixtrans-59.7-43.9172.2-81.4166.7000111.1I165 E166 V172 K173 L213I165-L169 HydrophobicContact CG2-CD1 3.87Å; I165-L169 HydrophobicContact CG2-CG 4.32Å; I165-L169 WeakPolarHBondContact O-CB 3.39Å; I165-L169 WeakPolarHBondContact O-CG 3.47Å; I165-L169 PolarHBondContact O-N 3.49Å; E166-L169 PolarHBondContact O-N 2.95Å; L169-V172 PolarHBondContact O-N 2.91Å; L169-K173 WeakPolarHBondContact O-CG 3.36Å; L169-K173 PolarHBondContact O-N 2.89Å; L169-L213 HydrophobicContact CD2-CD1 4.13Å; L169-L213 HydrophobicContact CD2-CD2 3.59Å; L169-L213 HydrophobicContact CD2-CG 4.5Å; L169-L213 HydrophobicContact CG-CD1 3.85Å; L169-L213 HydrophobicContact CG-CD2 4.21Å
170N95.1Very high95Very high82 Ų8253.5 Ų53.544%0.43929%0.288SS..Hα-helixtrans-64.5-43.1176.5-68.8-27000111.7E166 A167 Q168 V172 K173 E174E166-N170 PolarHBondContact O-N 2.89Å; E166-N170 VanDerWaalsContact O-N 3.13Å; E166-N170 PolarHBondContact O-ND2 3.48Å; A167-N170 PolarHBondContact O-N 3.45Å; Q168-N170 VanDerWaalsContact C-N 3.32Å; Q168-N170 PolarHBondContact O-N 3.38Å; N170-V172 PolarHBondContact O-N 3.27Å; N170-K173 PolarHBondContact O-N 3.15Å; N170-E174 PolarHBondContact O-N 2.96Å; N170-E174 VanDerWaalsContact O-N 3.07Å
171N96.5Very high94.8Very high52 Ų5254 Ų5428%0.27829%0.288SS..Hα-helixtrans-59-45.6174179.936.8000112A167 Q168 K173 E174 L175A167-N171 PolarHBondContact O-N 3.44Å; Q168-N171 PolarHBondContact O-N 3.22Å; Q168-N171 PolarHBondContact OE1-ND2 3.42Å; N171-K173 PolarHBondContact O-N 3.44Å; N171-E174 PolarHBondContact O-N 3.45Å; N171-L175 WeakPolarHBondContact O-CG 3.45Å; N171-L175 PolarHBondContact O-N 2.95Å
172V96.4Very high94.8Very high5 Ų554 Ų543%0.0329%0.289CS..Hα-helixtrans-59.7-45.9176.1164.30000111Q168 L169 N170 E174 L175 E176 L206 E209 L210 L213Q168-V172 WeakPolarHBondContact O-CB 3.34Å; Q168-V172 WeakPolarHBondContact O-CG2 3.39Å; Q168-V172 PolarHBondContact O-N 3.01Å; L169-V172 PolarHBondContact O-N 2.91Å; N170-V172 PolarHBondContact O-N 3.27Å; V172-E174 VanDerWaalsContact C-N 3.32Å; V172-E174 PolarHBondContact O-N 2.92Å; V172-L175 CarbonylContact O-C 3.59Å; V172-L175 PolarHBondContact O-N 2.84Å; V172-L175 VanDerWaalsContact O-N 3.1Å; V172-E176 HydrophobicContact CG1-CG 4.24Å; V172-E176 WeakPolarHBondContact O-CG 3.34Å; V172-E176 PolarHBondContact O-N 3.28Å; V172-L206 HydrophobicContact CG1-CD1 4.02Å; V172-E209 HydrophobicContact CG2-CB 4.31Å; V172-L210 HydrophobicContact CB-CD2 4.46Å; V172-L210 HydrophobicContact CG1-CD2 3.48Å; V172-L210 VanDerWaalsContact CG1-CD2 3.48Å; V172-L210 HydrophobicContact CG1-CG 4.04Å; V172-L210 HydrophobicContact CG2-CD2 4.11Å; V172-L210 HydrophobicContact CG2-CG 4.34Å; V172-L213 HydrophobicContact CG2-CB 4.46Å; V172-L213 HydrophobicContact CG2-CD2 4.27Å
173K93.7Very high94.6Very high93 Ų9352.6 Ų52.640%0.40427%0.274SS..Hα-helixtrans-59.1-41.2177.6-74.2176.3179.3-177.60112.6L169 N170 N171 E176 S177L169-K173 WeakPolarHBondContact O-CG 3.36Å; L169-K173 PolarHBondContact O-N 2.89Å; N170-K173 PolarHBondContact O-N 3.15Å; N171-K173 PolarHBondContact O-N 3.44Å; K173-E176 PolarHBondContact O-N 2.87Å; K173-S177 PolarHBondContact O-N 3.49Å; K173-S177 VanDerWaalsContact O-N 3.13Å
174E95.4Very high94.2Very high117 Ų11749.8 Ų49.855%0.54726%0.259SS..Hα-helixtrans-64.3-40.9174.6-71.5-175.8-168.200112.2N170 N171 V172 S177 K178N170-E174 PolarHBondContact O-N 2.96Å; N170-E174 VanDerWaalsContact O-N 3.07Å; N171-E174 PolarHBondContact O-N 3.45Å; V172-E174 VanDerWaalsContact C-N 3.32Å; V172-E174 PolarHBondContact O-N 2.92Å; E174-S177 PolarHBondContact O-N 3.49Å; E174-K178 WeakPolarHBondContact O-CG 3.26Å; E174-K178 PolarHBondContact O-N 2.94Å
175L96.4Very high94Very high22 Ų2251.2 Ų51.212%0.11526%0.261CS..Hα-helixtrans-69.3-36.2177.9-71.2170000112.5N171 V172 K178 A179 T205 L206 E209N171-L175 WeakPolarHBondContact O-CG 3.45Å; N171-L175 PolarHBondContact O-N 2.95Å; V172-L175 CarbonylContact O-C 3.59Å; V172-L175 PolarHBondContact O-N 2.84Å; V172-L175 VanDerWaalsContact O-N 3.1Å; L175-K178 HydrophobicContact CD2-CD 4.36Å; L175-K178 PolarHBondContact O-N 3.1Å; L175-A179 WeakPolarHBondContact O-CB 3.35Å; L175-A179 PolarHBondContact O-N 3.46Å; L175-T205 HydrophobicContact CD1-CG2 4.31Å; L175-T205 HydrophobicContact CD2-CG2 3.95Å; L175-L206 HydrophobicContact CB-CB 4.46Å; L175-L206 HydrophobicContact CB-CD1 4.09Å; L175-E209 HydrophobicContact CD1-CB 3.68Å; L175-E209 HydrophobicContact CD1-CG 3.44Å; L175-E209 VanDerWaalsContact CD1-CG 3.44Å
176E93.4Very high93.7Very high12 Ų1250.9 Ų50.96%0.05626%0.259CS..Hα-helixtrans-59.4-47.1171.9-74.1177157.800110.8F42 V172 K173 K178 A179 I180 L206 S252F42-E176 HydrophobicContact CD2-CB 4.48Å; F42-E176 HydrophobicContact CD2-CG 4.31Å; V172-E176 HydrophobicContact CG1-CG 4.24Å; V172-E176 WeakPolarHBondContact O-CG 3.34Å; V172-E176 PolarHBondContact O-N 3.28Å; K173-E176 PolarHBondContact O-N 2.87Å; E176-K178 PolarHBondContact O-N 3.13Å; E176-A179 PolarHBondContact O-N 2.83Å; E176-I180 WeakPolarHBondContact O-CB 3.07Å; E176-I180 VanDerWaalsContact O-CG1 3.3Å; E176-I180 WeakPolarHBondContact O-CG1 3.42Å; E176-I180 PolarHBondContact O-N 3.45Å; E176-L206 HydrophobicContact CG-CD1 3.54Å; E176-L206 HydrophobicContact CG-CD2 3.84Å; E176-L206 HydrophobicContact CG-CG 4.34Å; E176-S252 VanDerWaalsContact OE2-CB 3.31Å; E176-S252 WeakPolarHBondContact OE2-CB 3.09Å; E176-S252 PolarHBondContact OE2-OG 3.06Å
177S91.5Very high93.2Very high58 Ų5848.6 Ų48.641%0.40625%0.249SC..Hα-helixtrans-59.6-44.4175.6-176.70000112.1K173 E174 I180 Q181K173-S177 PolarHBondContact O-N 3.49Å; K173-S177 VanDerWaalsContact O-N 3.13Å; E174-S177 PolarHBondContact O-N 3.49Å; S177-I180 PolarHBondContact O-N 2.04Å; S177-Q181 VanDerWaalsContact O-CG 3.28Å; S177-Q181 WeakPolarHBondContact O-CG 3.08Å; S177-Q181 PolarHBondContact O-N 2.81Å; S177-Q181 PolarHBondContact OG-NE2 2.98Å
178K94.1Very high92.8Very high111 Ų11152.7 Ų52.748%0.48326%0.262SS..Hα-helixtrans-63.1-42.1175.9-72.3167.8-176.51630112.2E174 L175 E176 Q181 A182E174-K178 WeakPolarHBondContact O-CG 3.26Å; E174-K178 PolarHBondContact O-N 2.94Å; L175-K178 HydrophobicContact CD2-CD 4.36Å; L175-K178 PolarHBondContact O-N 3.1Å; E176-K178 PolarHBondContact O-N 3.13Å; K178-Q181 PolarHBondContact O-N 3.12Å; K178-A182 WeakPolarHBondContact O-CB 3.32Å; K178-A182 PolarHBondContact O-N 3.26Å
179A94.2Very high92.5Very high0 Ų054.9 Ų54.90%028%0.275CS..Hα-helixtrans-65.7-41.8178.600000111.7F42 L175 E176 Q181 A182 A183 A202 L206F42-A179 HydrophobicContact CE2-CB 3.59Å; F42-A179 HydrophobicContact CZ-CB 3.79Å; L175-A179 WeakPolarHBondContact O-CB 3.35Å; L175-A179 PolarHBondContact O-N 3.46Å; E176-A179 PolarHBondContact O-N 2.83Å; A179-Q181 PolarHBondContact O-N 2.77Å; A179-A182 PolarHBondContact O-N 2.89Å; A179-A183 WeakPolarHBondContact O-CB 3.05Å; A179-A183 PolarHBondContact O-N 3.39Å; A179-A202 HydrophobicContact CB-CB 4.1Å; A179-L206 HydrophobicContact CB-CD2 4.23Å
180I90.9Very high92.2Very high23 Ų2361.7 Ų61.712%0.11830%0.299CS..Hα-helixtrans-59.9-45.7172.7-73.3164.3000111.1F42 L45 T49 E176 S177 A182 A183 N184F42-I180 HydrophobicContact CE2-CG1 3.95Å; L45-I180 HydrophobicContact CD2-CD1 3.47Å; L45-I180 VanDerWaalsContact CD2-CD1 3.47Å; L45-I180 HydrophobicContact CG-CD1 3.76Å; T49-I180 HydrophobicContact CG2-CD1 4.28Å; T49-I180 HydrophobicContact CG2-CG1 4.47Å; T49-I180 HydrophobicContact CG2-CG2 3.57Å; T49-I180 WeakPolarHBondContact OG1-CG2 3.41Å; E176-I180 WeakPolarHBondContact O-CB 3.07Å; E176-I180 VanDerWaalsContact O-CG1 3.3Å; E176-I180 WeakPolarHBondContact O-CG1 3.42Å; E176-I180 PolarHBondContact O-N 3.45Å; S177-I180 PolarHBondContact O-N 2.04Å; I180-A182 VanDerWaalsContact C-N 3.35Å; I180-A182 PolarHBondContact O-N 2.98Å; I180-A183 WeakPolarHBondContact O-CB 3.44Å; I180-A183 PolarHBondContact O-N 2.9Å; I180-N184 WeakPolarHBondContact O-CB 3.04Å; I180-N184 VanDerWaalsContact O-CG 3.29Å; I180-N184 PolarHBondContact O-N 2.95Å; I180-N184 PolarHBondContact O-ND2 3.34Å
181Q91Very high92.1Very high102 Ų10265.1 Ų65.148%0.47732%0.317SS..Hα-helixtrans-62.2-42.9177.8-72173.829.200111.9S177 K178 A179 N184 K185S177-Q181 VanDerWaalsContact O-CG 3.28Å; S177-Q181 WeakPolarHBondContact O-CG 3.08Å; S177-Q181 PolarHBondContact O-N 2.81Å; S177-Q181 PolarHBondContact OG-NE2 2.98Å; K178-Q181 PolarHBondContact O-N 3.12Å; A179-Q181 PolarHBondContact O-N 2.77Å; Q181-N184 PolarHBondContact O-N 2.99Å; Q181-K185 WeakPolarHBondContact O-CG 3.49Å; Q181-K185 PolarHBondContact O-N 2.92Å
182A93.2Very high92Very high12 Ų1265.4 Ų65.410%0.09932%0.319CS..Hα-helixtrans-64.8-42.7177.200000111.7K178 A179 I180 N184 K185 H186 H199 A202K178-A182 WeakPolarHBondContact O-CB 3.32Å; K178-A182 PolarHBondContact O-N 3.26Å; A179-A182 PolarHBondContact O-N 2.89Å; I180-A182 VanDerWaalsContact C-N 3.35Å; I180-A182 PolarHBondContact O-N 2.98Å; A182-N184 PolarHBondContact O-N 3.03Å; A182-K185 PolarHBondContact O-N 3.17Å; A182-H186 WeakPolarHBondContact O-CB 3.31Å; A182-H186 PolarHBondContact O-N 2.93Å; A182-H199 HydrophobicContact CB-CB 4.3Å; A182-A202 HydrophobicContact CB-CB 4.1Å
183A90.7Very high91.9Very high0 Ų073.2 Ų73.20%035%0.353CS..Hα-helixtrans-57.3-48.5173.700000112.1E46 A179 I180 K185 H186 M187E46-A183 HydrophobicContact CG-CB 3.84Å; E46-A183 WeakPolarHBondContact OE1-CB 3Å; A179-A183 WeakPolarHBondContact O-CB 3.05Å; A179-A183 PolarHBondContact O-N 3.39Å; I180-A183 WeakPolarHBondContact O-CB 3.44Å; I180-A183 PolarHBondContact O-N 2.9Å; A183-K185 PolarHBondContact O-N 2.89Å; A183-H186 PolarHBondContact O-N 3.02Å; A183-M187 WeakPolarHBondContact O-CB 3.41Å; A183-M187 VanDerWaalsContact O-CG 3.25Å; A183-M187 WeakPolarHBondContact O-CG 3.29Å; A183-M187 PolarHBondContact O-N 2.97Å
184N88.8Confident92.1Very high36 Ų3672 Ų7219%0.19336%0.355CS..Hα-helixtrans-64-41.5180-72-24.4000112T49 R50 I180 Q181 A182 M187 N188T49-N184 PolarHBondContact OG1-ND2 3.17Å; T49-N184 VanDerWaalsContact OG1-ND2 3.14Å; T49-N184 PolarHBondContact OG1-OD1 3.5Å; R50-N184 WeakPolarHBondContact CG-OD1 3.44Å; I180-N184 WeakPolarHBondContact O-CB 3.04Å; I180-N184 VanDerWaalsContact O-CG 3.29Å; I180-N184 PolarHBondContact O-N 2.95Å; I180-N184 PolarHBondContact O-ND2 3.34Å; Q181-N184 PolarHBondContact O-N 2.99Å; A182-N184 PolarHBondContact O-N 3.03Å; N184-M187 PolarHBondContact O-N 2.72Å; N184-N188 VanDerWaalsContact O-CG 3.24Å; N184-N188 PolarHBondContact O-N 3.34Å; N184-N188 VanDerWaalsContact O-N 3.08Å; N184-N188 PolarHBondContact O-ND2 3.39Å
185K91.4Very high92.1Very high118 Ų11867.7 Ų67.751%0.51334%0.336SS..Hα-helixtrans-60.7-49.5174.2-73.4177.3-177.2179.30111.8Q181 A182 A183 M187 N188 N189 L195Q181-K185 WeakPolarHBondContact O-CG 3.49Å; Q181-K185 PolarHBondContact O-N 2.92Å; A182-K185 PolarHBondContact O-N 3.17Å; A183-K185 PolarHBondContact O-N 2.89Å; K185-M187 VanDerWaalsContact C-N 3.31Å; K185-M187 PolarHBondContact O-N 2.91Å; K185-N188 PolarHBondContact O-N 2.87Å; K185-N189 PolarHBondContact O-N 3.14Å; K185-L195 HydrophobicContact CB-CD1 4.45Å; K185-L195 HydrophobicContact CB-CD2 4.21Å
186H90.5Very high91.9Very high18 Ų1869.8 Ų69.88%0.08335%0.345CS..Hα-helixtrans-60-41.4178.2172.943.1000112.1A182 A183 N188 N189 R190 L195 E196 H199A182-H186 WeakPolarHBondContact O-CB 3.31Å; A182-H186 PolarHBondContact O-N 2.93Å; A183-H186 PolarHBondContact O-N 3.02Å; H186-N188 VanDerWaalsContact C-N 3.33Å; H186-N188 PolarHBondContact O-N 3.03Å; H186-N189 CarbonylContact O-C 3.02Å; H186-N189 PolarHBondContact O-N 3.33Å; H186-N189 VanDerWaalsContact O-O 3.1Å; H186-R190 WeakPolarHBondContact O-CA 3.48Å; H186-R190 PolarHBondContact O-N 3.08Å; H186-R190 VanDerWaalsContact O-N 3.15Å; H186-L195 HydrophobicContact CB-CB 3.97Å; H186-E196 WeakPolarHBondContact CE1-CB 3.43Å; H186-E196 WeakPolarHBondContact ND1-CA 3.48Å; H186-E196 PolarHBondContact ND1-N 2.94Å; H186-H199 HydrophobicContact CB-CB 4.19Å
187M85.6Confident92.1Very high44 Ų4475.5 Ų75.522%0.21737%0.37CS..Hα-helixtrans-69-30.9179.9-71.4-69.6128.500113.7R50 A183 N184 K185 N189 R190R50-M187 VanDerWaalsContact CZ-CG 3.47Å; A183-M187 WeakPolarHBondContact O-CB 3.41Å; A183-M187 VanDerWaalsContact O-CG 3.25Å; A183-M187 WeakPolarHBondContact O-CG 3.29Å; A183-M187 PolarHBondContact O-N 2.97Å; N184-M187 PolarHBondContact O-N 2.72Å; K185-M187 VanDerWaalsContact C-N 3.31Å; K185-M187 PolarHBondContact O-N 2.91Å; M187-N189 VanDerWaalsContact C-N 3.27Å; M187-R190 WeakPolarHBondContact O-CG 3.48Å
188N87.6Confident92.3Very high147 Ų14776.5 Ų76.579%0.78637%0.368SS*.Hα-helixtrans-73.6-19174.8-70.7-18.3000112.8N184 K185 H186N184-N188 VanDerWaalsContact O-CG 3.24Å; N184-N188 PolarHBondContact O-N 3.34Å; N184-N188 VanDerWaalsContact O-N 3.08Å; N184-N188 PolarHBondContact O-ND2 3.39Å; K185-N188 PolarHBondContact O-N 2.87Å; H186-N188 VanDerWaalsContact C-N 3.33Å; H186-N188 PolarHBondContact O-N 3.03Å
189N91Very high92.3Very high76 Ų7672.7 Ų72.741%0.40635%0.352SS..SBendtrans-144.376.2176.5-1740.6000110.2K185 H186 M187 D191 D192 L195K185-N189 PolarHBondContact O-N 3.14Å; H186-N189 CarbonylContact O-C 3.02Å; H186-N189 PolarHBondContact O-N 3.33Å; H186-N189 VanDerWaalsContact O-O 3.1Å; M187-N189 VanDerWaalsContact C-N 3.27Å; N189-D191 PolarHBondContact O-N 3.37Å; N189-D192 HydrophobicContact CB-CB 4.38Å; N189-D192 PolarHBondContact O-N 3.13Å; N189-L195 HydrophobicContact CB-CD1 3.92Å
190R88.7Confident92.3Very high168 Ų16878.3 Ų78.363%0.63438%0.376SS*.THydrogen-bonded Turntrans-67.7-24.5-172.4-66.1-175.2-179.3-171.2-1.4113.7H186 M187 D192H186-R190 WeakPolarHBondContact O-CA 3.48Å; H186-R190 PolarHBondContact O-N 3.08Å; H186-R190 VanDerWaalsContact O-N 3.15Å; M187-R190 WeakPolarHBondContact O-CG 3.48Å; R190-D192 VanDerWaalsContact C-N 3.27Å
191D93.4Very high92.6Very high153 Ų15381.9 Ų81.982%0.81839%0.393SS*.THydrogen-bonded Turntrans-77.1-17.8179.2-61.6-33.3000111.9N189 K193N189-D191 PolarHBondContact O-N 3.37Å; D191-K193 PolarHBondContact O-N 3.45Å; D191-K193 VanDerWaalsContact O-N 3.13Å
192D94.7Very high92.9Very high58 Ų5878 Ų7831%0.3138%0.378SS..  trans-79.295.7175-170.7-15.2000111.5N189 R190 S194 L195 E196N189-D192 HydrophobicContact CB-CB 4.38Å; N189-D192 PolarHBondContact O-N 3.13Å; R190-D192 VanDerWaalsContact C-N 3.27Å; D192-S194 PolarHBondContact O-N 2.9Å; D192-S194 WeakPolarHBondContact OD1-CA 3.46Å; D192-S194 WeakPolarHBondContact OD1-CB 3.43Å; D192-S194 PolarHBondContact OD1-N 3.45Å; D192-L195 HydrophobicContact CB-CB 4.41Å; D192-L195 HydrophobicContact CB-CD1 3.96Å; D192-L195 HydrophobicContact CB-CG 4.09Å; D192-L195 PolarHBondContact O-N 2.84Å; D192-L195 PolarHBondContact OD1-N 3.39Å; D192-E196 PolarHBondContact O-N 3.29Å
193K94.6Very high92.9Very high170 Ų17081.1 Ų81.174%0.73939%0.388SS*.Hα-helixtrans-58.1-24.9175.4-65.6-177.3179.1177.90113.6D191 K197D191-K193 PolarHBondContact O-N 3.45Å; D191-K193 VanDerWaalsContact O-N 3.13Å; K193-K197 WeakPolarHBondContact O-CB 3.27Å; K193-K197 PolarHBondContact O-N 2.94Å; K193-K197 VanDerWaalsContact O-N 3.07Å
194S96.8Very high93.2Very high66 Ų6684.9 Ų84.946%0.46241%0.414SS..Hα-helixtrans-67.2-40.7175.6-172.80000110.8D192 K197 Q198D192-S194 PolarHBondContact O-N 2.9Å; D192-S194 WeakPolarHBondContact OD1-CA 3.46Å; D192-S194 WeakPolarHBondContact OD1-CB 3.43Å; D192-S194 PolarHBondContact OD1-N 3.45Å; S194-K197 WeakPolarHBondContact O-CB 3.37Å; S194-K197 PolarHBondContact O-N 3.09Å; S194-Q198 WeakPolarHBondContact O-CG 3.35Å; S194-Q198 PolarHBondContact O-N 3.36Å; S194-Q198 PolarHBondContact OG-NE2 3.23Å
195L95.2Very high93.6Very high27 Ų2786.2 Ų86.214%0.14142%0.424CS..Hα-helixtrans-70.3-37.7177.2-62.4177000111.9K185 H186 N189 D192 K197 Q198 H199K185-L195 HydrophobicContact CB-CD1 4.45Å; K185-L195 HydrophobicContact CB-CD2 4.21Å; H186-L195 HydrophobicContact CB-CB 3.97Å; N189-L195 HydrophobicContact CB-CD1 3.92Å; D192-L195 HydrophobicContact CB-CB 4.41Å; D192-L195 HydrophobicContact CB-CD1 3.96Å; D192-L195 HydrophobicContact CB-CG 4.09Å; D192-L195 PolarHBondContact O-N 2.84Å; D192-L195 PolarHBondContact OD1-N 3.39Å; L195-K197 VanDerWaalsContact C-N 3.28Å; L195-K197 PolarHBondContact O-N 3Å; L195-Q198 PolarHBondContact O-N 2.91Å; L195-H199 WeakPolarHBondContact O-CB 3.5Å; L195-H199 PolarHBondContact O-N 3.24Å
196E93.6Very high93.9Very high66 Ų6680.6 Ų80.631%0.30840%0.4SS..Hα-helixtrans-57.5-45.1172.1-170.5-174.517200110.9H186 D192 H199 K200H186-E196 WeakPolarHBondContact CE1-CB 3.43Å; H186-E196 WeakPolarHBondContact ND1-CA 3.48Å; H186-E196 PolarHBondContact ND1-N 2.94Å; D192-E196 PolarHBondContact O-N 3.29Å; E196-H199 PolarHBondContact O-N 3.48Å; E196-K200 HydrophobicContact CG-CD 4.43Å; E196-K200 WeakPolarHBondContact O-CG 3.41Å; E196-K200 PolarHBondContact O-N 3.37Å; E196-K200 WeakPolarHBondContact OE1-CE 3.36Å; E196-K200 IonicContact OE1-NZ 3.44Å; E196-K200 PolarHBondContact OE1-NZ 3.13Å
197K96Very high94.1Very high132 Ų13280.5 Ų80.557%0.57440%0.403SS*.Hα-helixtrans-62.5-46.4177.6-170.3-177-178.4-160.80111.7K193 S194 L195 H199 K200 E201K193-K197 WeakPolarHBondContact O-CB 3.27Å; K193-K197 PolarHBondContact O-N 2.94Å; K193-K197 VanDerWaalsContact O-N 3.07Å; S194-K197 WeakPolarHBondContact O-CB 3.37Å; S194-K197 PolarHBondContact O-N 3.09Å; L195-K197 VanDerWaalsContact C-N 3.28Å; L195-K197 PolarHBondContact O-N 3Å; K197-H199 VanDerWaalsContact C-N 3.33Å; K197-H199 PolarHBondContact O-N 3.36Å; K197-K200 PolarHBondContact O-N 2.8Å; K197-E201 WeakPolarHBondContact CE-OE1 3.35Å; K197-E201 HydrophobicContact CG-CG 4.49Å; K197-E201 IonicContact NZ-OE1 3.79Å; K197-E201 WeakPolarHBondContact O-CB 3.44Å; K197-E201 WeakPolarHBondContact O-CG 3.01Å; K197-E201 PolarHBondContact O-N 3.38Å
198Q96.2Very high94.7Very high80 Ų8085.3 Ų85.337%0.37442%0.423SS..Hα-helixtrans-59.8-42.4176.9-73.1172.542.200112.2S194 L195 E201 A202S194-Q198 WeakPolarHBondContact O-CG 3.35Å; S194-Q198 PolarHBondContact O-N 3.36Å; S194-Q198 PolarHBondContact OG-NE2 3.23Å; L195-Q198 PolarHBondContact O-N 2.91Å; Q198-E201 PolarHBondContact O-N 2.9Å; Q198-A202 WeakPolarHBondContact O-CB 3.31Å; Q198-A202 PolarHBondContact O-N 2.93Å
199H93.3Very high95.2Very high30 Ų3080.2 Ų80.214%0.13940%0.395CS..Hα-helixtrans-60.8-48.3175.1170.4-126.7000111.5E46 A182 H186 L195 E196 K197 E201 A202 Y203E46-H199 IonicContact OE1-CE1 2.61Å; E46-H199 IonicContact OE1-NE2 3.24Å; E46-H199 PolarHBondContact OE1-NE2 3.37Å; A182-H199 HydrophobicContact CB-CB 4.3Å; H186-H199 HydrophobicContact CB-CB 4.19Å; L195-H199 WeakPolarHBondContact O-CB 3.5Å; L195-H199 PolarHBondContact O-N 3.24Å; E196-H199 PolarHBondContact O-N 3.48Å; K197-H199 VanDerWaalsContact C-N 3.33Å; K197-H199 PolarHBondContact O-N 3.36Å; H199-E201 VanDerWaalsContact C-N 3.34Å; H199-E201 PolarHBondContact O-N 3.31Å; H199-A202 PolarHBondContact O-N 3.45Å; H199-Y203 WeakPolarHBondContact O-CB 3.46Å; H199-Y203 PolarHBondContact O-N 3.17Å
200K94.6Very high95.5Very high118 Ų11876.7 Ų76.751%0.51338%0.376SS..Hα-helixtrans-61.2-40.9177.3-72.2176.6-176.91720112.4E196 K197 S204E196-K200 HydrophobicContact CG-CD 4.43Å; E196-K200 WeakPolarHBondContact O-CG 3.41Å; E196-K200 PolarHBondContact O-N 3.37Å; E196-K200 WeakPolarHBondContact OE1-CE 3.36Å; E196-K200 IonicContact OE1-NZ 3.44Å; E196-K200 PolarHBondContact OE1-NZ 3.13Å; K197-K200 PolarHBondContact O-N 2.8Å; K200-S204 VanDerWaalsContact O-CB 3.27Å; K200-S204 WeakPolarHBondContact O-CB 3.44Å; K200-S204 PolarHBondContact O-N 2.53Å
201E97.6Very high95.8Very high99 Ų9975 Ų7546%0.46337%0.369SS..Hα-helixtrans-65.4-43.5177.1-74.8173.5176.300111.9K197 Q198 H199 S204 T205K197-E201 WeakPolarHBondContact CE-OE1 3.35Å; K197-E201 HydrophobicContact CG-CG 4.49Å; K197-E201 IonicContact NZ-OE1 3.79Å; K197-E201 WeakPolarHBondContact O-CB 3.44Å; K197-E201 WeakPolarHBondContact O-CG 3.01Å; K197-E201 PolarHBondContact O-N 3.38Å; Q198-E201 PolarHBondContact O-N 2.9Å; H199-E201 VanDerWaalsContact C-N 3.34Å; H199-E201 PolarHBondContact O-N 3.31Å; E201-S204 PolarHBondContact O-N 2.76Å; E201-T205 WeakPolarHBondContact O-CB 3.44Å; E201-T205 PolarHBondContact O-N 2.96Å; E201-T205 PolarHBondContact O-OG1 3.36Å
202A96.5Very high96Very high21 Ų2169.8 Ų69.817%0.17435%0.345CS..Hα-helixtrans-63.7-45.6176.500000111.4A179 A182 Q198 H199 T205 L206A179-A202 HydrophobicContact CB-CB 4.1Å; A182-A202 HydrophobicContact CB-CB 4.1Å; Q198-A202 WeakPolarHBondContact O-CB 3.31Å; Q198-A202 PolarHBondContact O-N 2.93Å; H199-A202 PolarHBondContact O-N 3.45Å; A202-T205 PolarHBondContact O-N 3.44Å; A202-L206 WeakPolarHBondContact O-CB 3.09Å; A202-L206 PolarHBondContact O-N 3.38Å
203Y94.9Very high96.1Very high76 Ų7667.1 Ų67.130%0.29833%0.331SS..Hα-helixtrans-62.3-43.9175.5-176.7-101.3000112.3F42 L43 H199 T205 L206 G207F42-Y203 AromaticContact CD1-CD2 3.94Å; F42-Y203 HydrophobicContact CD1-CD2 3.94Å; F42-Y203 AromaticContact CD1-CE2 3.63Å; F42-Y203 HydrophobicContact CD1-CE2 3.63Å; F42-Y203 AromaticContact CE1-CD2 3.36Å; F42-Y203 HydrophobicContact CE1-CD2 3.36Å; F42-Y203 AromaticContact CE1-CE2 3.48Å; F42-Y203 HydrophobicContact CE1-CE2 3.48Å; F42-Y203 VanDerWaalsContact CE1-CE2 3.48Å; F42-Y203 HydrophobicContact CZ-CD2 4Å; L43-Y203 HydrophobicContact CD2-CE2 4.13Å; H199-Y203 WeakPolarHBondContact O-CB 3.46Å; H199-Y203 PolarHBondContact O-N 3.17Å; Y203-T205 VanDerWaalsContact C-N 3.31Å; Y203-T205 PolarHBondContact O-N 3.11Å; Y203-L206 PolarHBondContact O-N 2.98Å; Y203-G207 PolarHBondContact O-N 2.96Å
204S96.5Very high96.2Very high80 Ų8059.2 Ų59.256%0.55930%0.297SS*.Hα-helixtrans-62.1-39.7176.6-176.40000112K200 E201 K208K200-S204 VanDerWaalsContact O-CB 3.27Å; K200-S204 WeakPolarHBondContact O-CB 3.44Å; K200-S204 PolarHBondContact O-N 2.53Å; E201-S204 PolarHBondContact O-N 2.76Å; S204-K208 PolarHBondContact O-N 3.35Å; S204-K208 VanDerWaalsContact O-N 3.09Å
205T97.9Very high96.2Very high64 Ų6459.8 Ų59.839%0.39330%0.295SS..Hα-helixtrans-66.2-46.7177.1-57.50000110.5L175 E201 A202 Y203 G207 K208 E209L175-T205 HydrophobicContact CD1-CG2 4.31Å; L175-T205 HydrophobicContact CD2-CG2 3.95Å; E201-T205 WeakPolarHBondContact O-CB 3.44Å; E201-T205 PolarHBondContact O-N 2.96Å; E201-T205 PolarHBondContact O-OG1 3.36Å; A202-T205 PolarHBondContact O-N 3.44Å; Y203-T205 VanDerWaalsContact C-N 3.31Å; Y203-T205 PolarHBondContact O-N 3.11Å; T205-G207 PolarHBondContact O-N 3.25Å; T205-K208 WeakPolarHBondContact O-CB 3.3Å; T205-K208 PolarHBondContact O-N 3.09Å; T205-E209 WeakPolarHBondContact O-CG 3.31Å; T205-E209 PolarHBondContact O-N 3.09Å
206L96.3Very high96.2Very high0 Ų060.8 Ų60.80%030%0.3CS..Hα-helixtrans-55.6-49.2174.2172.361000111.6F42 V172 L175 E176 A179 A202 Y203 K208 E209 L210F42-L206 HydrophobicContact CB-CD2 4.4Å; F42-L206 HydrophobicContact CD1-CD2 4.3Å; F42-L206 HydrophobicContact CD2-CD2 3.51Å; F42-L206 HydrophobicContact CE2-CD2 3.79Å; F42-L206 HydrophobicContact CG-CD2 3.78Å; F42-L206 HydrophobicContact CZ-CD2 4.32Å; V172-L206 HydrophobicContact CG1-CD1 4.02Å; L175-L206 HydrophobicContact CB-CB 4.46Å; L175-L206 HydrophobicContact CB-CD1 4.09Å; E176-L206 HydrophobicContact CG-CD1 3.54Å; E176-L206 HydrophobicContact CG-CD2 3.84Å; E176-L206 HydrophobicContact CG-CG 4.34Å; A179-L206 HydrophobicContact CB-CD2 4.23Å; A202-L206 WeakPolarHBondContact O-CB 3.09Å; A202-L206 PolarHBondContact O-N 3.38Å; Y203-L206 PolarHBondContact O-N 2.98Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 3.38Å; L206-E209 PolarHBondContact O-N 3.34Å; L206-L210 HydrophobicContact CD1-CD1 3.9Å; L206-L210 HydrophobicContact CD1-CG 3.95Å; L206-L210 HydrophobicContact CG-CD1 3.9Å; L206-L210 HydrophobicContact CG-CG 4.4Å; L206-L210 WeakPolarHBondContact O-CB 3.38Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 3.41Å
207G96.1Very high96.3Very high16 Ų1658.5 Ų58.517%0.16529%0.289CS..Hα-helixtrans-60.1-37.7179.300000113.2Y203 T205 R211Y203-G207 PolarHBondContact O-N 2.96Å; T205-G207 PolarHBondContact O-N 3.25Å; G207-R211 PolarHBondContact O-N 2.86Å; G207-R211 VanDerWaalsContact O-N 3.13Å
208K97.5Very high96.2Very high144 Ų14452.3 Ų52.363%0.62626%0.263SS*.Hα-helixtrans-64.9-48174.7-175.6-173.8175.6-169.10111.5S204 T205 L206 R211 S212S204-K208 PolarHBondContact O-N 3.35Å; S204-K208 VanDerWaalsContact O-N 3.09Å; T205-K208 WeakPolarHBondContact O-CB 3.3Å; T205-K208 PolarHBondContact O-N 3.09Å; L206-K208 VanDerWaalsContact C-N 3.3Å; L206-K208 PolarHBondContact O-N 3.38Å; K208-R211 WeakPolarHBondContact O-CB 3.36Å; K208-R211 PolarHBondContact O-N 3.2Å; K208-R211 VanDerWaalsContact O-N 3.14Å; K208-S212 PolarHBondContact O-N 2.86Å; K208-S212 VanDerWaalsContact O-N 3.08Å; K208-S212 PolarHBondContact O-OG 3.42Å
209E97.9Very high96.1Very high41 Ų4150 Ų5019%0.19225%0.252CS..Hα-helixtrans-71.4-31-178.2-65.7-51138.600112.9Q168 V172 L175 T205 L206 R211 S212 L213Q168-E209 PolarHBondContact NE2-O 3.23Å; Q168-E209 PolarHBondContact NE2-OE2 2.77Å; V172-E209 HydrophobicContact CG2-CB 4.31Å; L175-E209 HydrophobicContact CD1-CB 3.68Å; L175-E209 HydrophobicContact CD1-CG 3.44Å; L175-E209 VanDerWaalsContact CD1-CG 3.44Å; T205-E209 WeakPolarHBondContact O-CG 3.31Å; T205-E209 PolarHBondContact O-N 3.09Å; L206-E209 PolarHBondContact O-N 3.34Å; E209-R211 VanDerWaalsContact C-N 3.31Å; E209-S212 WeakPolarHBondContact O-CB 3.27Å; E209-S212 PolarHBondContact O-N 3.33Å; E209-L213 PolarHBondContact O-N 3.21Å
210L96.6Very high96.2Very high1 Ų149.2 Ų49.21%0.00525%0.251CS..Hα-helixtrans-62.6-37.5168-82.6172.4000112F35 I39 V172 L206 L213 V214F35-L210 HydrophobicContact CD2-CB 4.18Å; F35-L210 HydrophobicContact CE2-CB 3.94Å; I39-L210 HydrophobicContact CD1-CD1 3.52Å; I39-L210 HydrophobicContact CG1-CD1 4.21Å; V172-L210 HydrophobicContact CB-CD2 4.46Å; V172-L210 HydrophobicContact CG1-CD2 3.48Å; V172-L210 VanDerWaalsContact CG1-CD2 3.48Å; V172-L210 HydrophobicContact CG1-CG 4.04Å; V172-L210 HydrophobicContact CG2-CD2 4.11Å; V172-L210 HydrophobicContact CG2-CG 4.34Å; L206-L210 HydrophobicContact CD1-CD1 3.9Å; L206-L210 HydrophobicContact CD1-CG 3.95Å; L206-L210 HydrophobicContact CG-CD1 3.9Å; L206-L210 HydrophobicContact CG-CG 4.4Å; L206-L210 WeakPolarHBondContact O-CB 3.38Å; L206-L210 WeakPolarHBondContact O-CG 3.38Å; L206-L210 PolarHBondContact O-N 3.41Å; L210-L213 HydrophobicContact CD2-CD2 4.38Å; L210-L213 WeakPolarHBondContact O-CB 3.49Å; L210-L213 PolarHBondContact O-N 3.02Å; L210-V214 WeakPolarHBondContact O-CG2 3.45Å; L210-V214 PolarHBondContact O-N 2.92Å
211R96.6Very high96.2Very high132 Ų13244 Ų4450%0.49823%0.228SC..Hα-helixtrans-67.8-42.2175.9-166.5160.7-175.886.32.3111.5F35 G207 K208 E209 L213 V214 D215F35-R211 HydrophobicContact CE2-CB 4.23Å; G207-R211 PolarHBondContact O-N 2.86Å; G207-R211 VanDerWaalsContact O-N 3.13Å; K208-R211 WeakPolarHBondContact O-CB 3.36Å; K208-R211 PolarHBondContact O-N 3.2Å; K208-R211 VanDerWaalsContact O-N 3.14Å; E209-R211 VanDerWaalsContact C-N 3.31Å; R211-L213 VanDerWaalsContact C-N 3.32Å; R211-L213 PolarHBondContact O-N 3.42Å; R211-V214 PolarHBondContact O-N 2.88Å; R211-D215 PolarHBondContact O-N 3.47Å
212S97.4Very high95.9Very high45 Ų4540.2 Ų40.232%0.31521%0.21SC..Hα-helixtrans-58-43.2172.2-57.70000112.2K208 E209 D215 L216K208-S212 PolarHBondContact O-N 2.86Å; K208-S212 VanDerWaalsContact O-N 3.08Å; K208-S212 PolarHBondContact O-OG 3.42Å; E209-S212 WeakPolarHBondContact O-CB 3.27Å; E209-S212 PolarHBondContact O-N 3.33Å; S212-D215 PolarHBondContact O-N 2.8Å; S212-L216 PolarHBondContact O-N 3.29Å; S212-L216 VanDerWaalsContact O-N 3.09Å
213L96.7Very high95.6Very high1 Ų139.8 Ų39.81%0.00520%0.204CC..Hα-helixtrans-57.9-50.8174.7173.161.5000111.3I165 Q168 L169 V172 E209 L210 R211 D215 L216 M217I165-L213 HydrophobicContact CG2-CD1 4Å; Q168-L213 HydrophobicContact CB-CD1 4.11Å; Q168-L213 HydrophobicContact CG-CB 3.7Å; Q168-L213 HydrophobicContact CG-CD1 4.11Å; Q168-L213 HydrophobicContact CG-CG 4.48Å; L169-L213 HydrophobicContact CD2-CD1 4.13Å; L169-L213 HydrophobicContact CD2-CD2 3.59Å; L169-L213 HydrophobicContact CD2-CG 4.5Å; L169-L213 HydrophobicContact CG-CD1 3.85Å; L169-L213 HydrophobicContact CG-CD2 4.21Å; V172-L213 HydrophobicContact CG2-CB 4.46Å; V172-L213 HydrophobicContact CG2-CD2 4.27Å; E209-L213 PolarHBondContact O-N 3.21Å; L210-L213 HydrophobicContact CD2-CD2 4.38Å; L210-L213 WeakPolarHBondContact O-CB 3.49Å; L210-L213 PolarHBondContact O-N 3.02Å; R211-L213 VanDerWaalsContact C-N 3.32Å; R211-L213 PolarHBondContact O-N 3.42Å; L213-D215 VanDerWaalsContact C-N 3.26Å; L213-D215 PolarHBondContact O-N 3.37Å; L213-L216 WeakPolarHBondContact O-CB 3.49Å; L213-L216 PolarHBondContact O-N 3.07Å; L213-L216 VanDerWaalsContact O-N 3.13Å; L213-M217 HydrophobicContact CD1-CG 4.35Å; L213-M217 HydrophobicContact CD1-SD 4.4Å; L213-M217 HydrophobicContact CG-SD 4.24Å; L213-M217 WeakPolarHBondContact O-CG 3.43Å; L213-M217 PolarHBondContact O-N 3.44Å
214V96.4Very high95.5Very high5 Ų536.6 Ų36.63%0.0319%0.192CC..Hα-helixtrans-64-33.8-178.4166.40000111.7K31 Y34 F35 L210 R211 M217 G218K31-V214 HydrophobicContact CB-CG1 3.49Å; K31-V214 VanDerWaalsContact CB-CG1 3.49Å; K31-V214 WeakPolarHBondContact CE-O 3.49Å; K31-V214 HydrophobicContact CG-CG1 3.96Å; K31-V214 VanDerWaalsContact O-CG1 3.25Å; K31-V214 WeakPolarHBondContact O-CG1 3.41Å; Y34-V214 HydrophobicContact CD1-CG2 3.68Å; Y34-V214 HydrophobicContact CE1-CG2 4.41Å; F35-V214 HydrophobicContact CB-CG1 4.43Å; F35-V214 HydrophobicContact CB-CG2 3.97Å; F35-V214 HydrophobicContact CD2-CG2 4.47Å; L210-V214 WeakPolarHBondContact O-CG2 3.45Å; L210-V214 PolarHBondContact O-N 2.92Å; R211-V214 PolarHBondContact O-N 2.88Å; V214-M217 PolarHBondContact O-N 3.45Å; V214-G218 PolarHBondContact O-N 3.48Å
215D96.2Very high95.3Very high78 Ų7832.9 Ų32.942%0.41717%0.166SC..Hα-helixtrans-64.4-42.9172.7-75.3-28.9000112.5K31 R211 S212 L213 G218 E219K31-D215 WeakPolarHBondContact CE-OD1 3.4Å; K31-D215 IonicContact NZ-OD1 3.14Å; K31-D215 PolarHBondContact NZ-OD1 2.94Å; R211-D215 PolarHBondContact O-N 3.47Å; S212-D215 PolarHBondContact O-N 2.8Å; L213-D215 VanDerWaalsContact C-N 3.26Å; L213-D215 PolarHBondContact O-N 3.37Å; D215-G218 PolarHBondContact O-N 2.97Å; D215-E219 PolarHBondContact O-N 3.1Å
216L96.1Very high94.9Very high47 Ų4730.2 Ų30.225%0.24615%0.149CC..Hα-helixtrans-63.4-39172.7-69.4169.2000112.4N164 I165 Q168 S212 L213 G218 E219 A220N164-L216 HydrophobicContact CB-CD1 4.19Å; N164-L216 HydrophobicContact CB-CD2 4.19Å; I165-L216 HydrophobicContact CG1-CB 3.69Å; Q168-L216 HydrophobicContact CB-CD1 4Å; Q168-L216 HydrophobicContact CG-CD1 4.31Å; S212-L216 PolarHBondContact O-N 3.29Å; S212-L216 VanDerWaalsContact O-N 3.09Å; L213-L216 WeakPolarHBondContact O-CB 3.49Å; L213-L216 PolarHBondContact O-N 3.07Å; L213-L216 VanDerWaalsContact O-N 3.13Å; L216-G218 VanDerWaalsContact C-N 3.35Å; L216-E219 WeakPolarHBondContact O-CB 3.28Å; L216-E219 PolarHBondContact O-N 3.36Å; L216-A220 PolarHBondContact O-N 3.05Å
217M95.3Very high94.6Very high19 Ų1930.2 Ų30.29%0.09415%0.149CC..Hα-helixtrans-63-44.8174.6-67.6-178.370.500110.8Y34 I165 L213 V214 E219 A220 E221Y34-M217 HydrophobicContact CD1-CE 4.38Å; Y34-M217 HydrophobicContact CD1-SD 3.89Å; Y34-M217 HydrophobicContact CD2-CE 3.63Å; Y34-M217 HydrophobicContact CD2-SD 4.23Å; Y34-M217 HydrophobicContact CE1-CE 4.05Å; Y34-M217 HydrophobicContact CE1-SD 3.47Å; Y34-M217 WeakPolarHBondContact CE1-SD 3.47Å; Y34-M217 HydrophobicContact CE2-CE 3.28Å; Y34-M217 HydrophobicContact CE2-SD 3.9Å; Y34-M217 HydrophobicContact CG-CE 4.19Å; Y34-M217 HydrophobicContact CG-SD 4.25Å; Y34-M217 VanDerWaalsContact CZ-CE 3.49Å; I165-M217 HydrophobicContact CD1-CG 4.17Å; I165-M217 HydrophobicContact CG1-CG 4.35Å; I165-M217 HydrophobicContact CG2-CG 4.32Å; L213-M217 HydrophobicContact CD1-CG 4.35Å; L213-M217 HydrophobicContact CD1-SD 4.4Å; L213-M217 HydrophobicContact CG-SD 4.24Å; L213-M217 WeakPolarHBondContact O-CG 3.43Å; L213-M217 PolarHBondContact O-N 3.44Å; V214-M217 PolarHBondContact O-N 3.45Å; M217-E219 VanDerWaalsContact C-N 3.26Å; M217-E219 PolarHBondContact O-N 3.47Å; M217-A220 WeakPolarHBondContact O-CB 3.35Å; M217-A220 PolarHBondContact O-N 3.49Å; M217-A220 VanDerWaalsContact O-N 3.11Å; M217-E221 VanDerWaalsContact O-CG 3.32Å; M217-E221 WeakPolarHBondContact O-CG 3.44Å; M217-E221 PolarHBondContact O-N 3.34Å
218G94.7Very high94.4Very high1 Ų129.5 Ų29.51%0.0114%0.141CC..Hα-helixtrans-54.3-42.9172.900000113.5V214 D215 L216 E221 F222V214-G218 PolarHBondContact O-N 3.48Å; D215-G218 PolarHBondContact O-N 2.97Å; L216-G218 VanDerWaalsContact C-N 3.35Å; G218-E221 WeakPolarHBondContact O-CB 3.38Å; G218-E221 PolarHBondContact O-N 3.28Å; G218-F222 WeakPolarHBondContact O-CD2 3.4Å; G218-F222 PolarHBondContact O-N 3.49Å; G218-F222 VanDerWaalsContact O-N 3.14Å
219E93.3Very high94Very high33 Ų3324.1 Ų24.115%0.15412%0.121CC..Hα-helixtrans-61-47.1174.8178.456.2-156.100112.3Y12 T161 D215 L216 M217 E221 F222 Q223Y12-E219 WeakPolarHBondContact CD2-OE1 3.06Å; Y12-E219 WeakPolarHBondContact CE2-OE1 3.3Å; Y12-E219 WeakPolarHBondContact CE2-OE2 3.45Å; Y12-E219 PolarHBondContact OH-OE2 3.32Å; T161-E219 HydrophobicContact CG2-CB 4.12Å; T161-E219 HydrophobicContact CG2-CG 3.87Å; D215-E219 PolarHBondContact O-N 3.1Å; L216-E219 WeakPolarHBondContact O-CB 3.28Å; L216-E219 PolarHBondContact O-N 3.36Å; M217-E219 VanDerWaalsContact C-N 3.26Å; M217-E219 PolarHBondContact O-N 3.47Å; E219-E221 VanDerWaalsContact C-N 3.29Å; E219-E221 PolarHBondContact O-N 2.86Å; E219-F222 PolarHBondContact O-N 3.32Å; E219-Q223 WeakPolarHBondContact O-CG 3.47Å; E219-Q223 PolarHBondContact O-N 3.14Å; E219-Q223 PolarHBondContact OE1-NE2 3Å
220A94.3Very high93.5Very high13 Ų1324.4 Ų24.411%0.10713%0.125CC..Hα-helixtrans-62.1-36.9176.800000112L158 T161 I165 L216 M217 Q223 R224L158-A220 HydrophobicContact CD1-CB 4.08Å; T161-A220 HydrophobicContact CG2-CB 3.86Å; I165-A220 HydrophobicContact CD1-CB 3.59Å; L216-A220 PolarHBondContact O-N 3.05Å; M217-A220 WeakPolarHBondContact O-CB 3.35Å; M217-A220 PolarHBondContact O-N 3.49Å; M217-A220 VanDerWaalsContact O-N 3.11Å; A220-Q223 PolarHBondContact O-N 3.41Å; A220-R224 WeakPolarHBondContact O-CB 3.1Å; A220-R224 PolarHBondContact O-N 3.08Å
221E94.7Very high93.2Very high9 Ų924.6 Ų24.64%0.04213%0.126CC..Hα-helixtrans-60.1-48.3174.2-66.2-64.7136.400111.1I27 Y30 R129 M217 G218 E219 Q223 R224 I225I27-E221 HydrophobicContact CD1-CB 4.49Å; I27-E221 HydrophobicContact CG1-CB 4.31Å; I27-E221 HydrophobicContact CG2-CB 4.16Å; Y30-E221 HydrophobicContact CD1-CG 4.26Å; Y30-E221 HydrophobicContact CE1-CG 4.16Å; R129-E221 IonicContact CZ-OE2 2.93Å; R129-E221 IonicContact NH1-OE1 3.71Å; R129-E221 PolarHBondContact NH1-OE1 2.64Å; R129-E221 IonicContact NH1-OE2 2.72Å; R129-E221 PolarHBondContact NH1-OE2 3.13Å; M217-E221 VanDerWaalsContact O-CG 3.32Å; M217-E221 WeakPolarHBondContact O-CG 3.44Å; M217-E221 PolarHBondContact O-N 3.34Å; G218-E221 WeakPolarHBondContact O-CB 3.38Å; G218-E221 PolarHBondContact O-N 3.28Å; E219-E221 VanDerWaalsContact C-N 3.29Å; E219-E221 PolarHBondContact O-N 2.86Å; E221-Q223 PolarHBondContact O-N 3.09Å; E221-R224 PolarHBondContact O-N 3.22Å; E221-R224 IonicContact OE1-CZ 3.7Å; E221-R224 IonicContact OE1-NH1 3.68Å; E221-R224 PolarHBondContact OE1-NH1 3.17Å; E221-R224 IonicContact OE1-NH2 2.77Å; E221-R224 IonicContact OE2-CZ 3.1Å; E221-R224 IonicContact OE2-NH1 2.73Å; E221-R224 PolarHBondContact OE2-NH1 2.63Å; E221-R224 IonicContact OE2-NH2 2.58Å; E221-R224 PolarHBondContact OE2-NH2 3.43Å; E221-I225 WeakPolarHBondContact O-CD1 3.41Å; E221-I225 WeakPolarHBondContact O-CG1 3.19Å; E221-I225 PolarHBondContact O-N 2.88Å
222F91.3Very high92.8Very high18 Ų1821.5 Ų21.58%0.07912%0.123CC..Hα-helixtrans-59.3-49176.4-77.7-65.7000112.5M16 V19 K24 I27 G218 E219 R224 I225 L226M16-F222 HydrophobicContact CE-CD2 4.21Å; M16-F222 HydrophobicContact CE-CE2 3.89Å; M16-F222 HydrophobicContact CE-CZ 4.09Å; M16-F222 HydrophobicContact SD-CB 4.36Å; M16-F222 HydrophobicContact SD-CD1 3.68Å; M16-F222 HydrophobicContact SD-CD2 3.72Å; M16-F222 HydrophobicContact SD-CE1 3.77Å; M16-F222 HydrophobicContact SD-CE2 3.83Å; M16-F222 HydrophobicContact SD-CG 3.66Å; M16-F222 HydrophobicContact SD-CZ 3.86Å; V19-F222 HydrophobicContact CB-CD1 4.36Å; V19-F222 HydrophobicContact CB-CE1 4.33Å; V19-F222 HydrophobicContact CG1-CD1 4.07Å; V19-F222 HydrophobicContact CG1-CE1 3.89Å; V19-F222 HydrophobicContact CG2-CD1 4.13Å; K24-F222 HydrophobicContact CB-CE1 4.28Å; K24-F222 HydrophobicContact CB-CZ 4.1Å; K24-F222 HydrophobicContact CG-CE1 3.6Å; K24-F222 HydrophobicContact CG-CZ 3.76Å; I27-F222 HydrophobicContact CB-CE2 4.45Å; I27-F222 HydrophobicContact CB-CZ 4.21Å; I27-F222 HydrophobicContact CD1-CD1 3.41Å; I27-F222 VanDerWaalsContact CD1-CD1 3.41Å; I27-F222 HydrophobicContact CD1-CD2 4.23Å; I27-F222 HydrophobicContact CD1-CE1 3.22Å; I27-F222 HydrophobicContact CD1-CE2 4.06Å; I27-F222 HydrophobicContact CD1-CG 3.92Å; I27-F222 HydrophobicContact CD1-CZ 3.56Å; I27-F222 HydrophobicContact CG2-CD2 4.37Å; I27-F222 HydrophobicContact CG2-CE2 3.87Å; I27-F222 HydrophobicContact CG2-CZ 4.14Å; G218-F222 WeakPolarHBondContact O-CD2 3.4Å; G218-F222 PolarHBondContact O-N 3.49Å; G218-F222 VanDerWaalsContact O-N 3.14Å; E219-F222 PolarHBondContact O-N 3.32Å; F222-R224 VanDerWaalsContact C-N 3.35Å; F222-R224 PolarHBondContact O-N 3.4Å; F222-I225 PolarHBondContact O-N 3.41Å; F222-L226 WeakPolarHBondContact O-CG 3.41Å; F222-L226 PolarHBondContact O-N 3.32Å; F222-L226 VanDerWaalsContact O-N 3.16Å
223Q90.6Very high92.5Very high12 Ų1223.1 Ų23.16%0.05612%0.124CC..Hα-helixtrans-62.5-42.2179.7-68.6172.1-2.100111.6Q157 L158 T161 E219 A220 E221 L226 L227Q157-Q223 PolarHBondContact O-OE1 3.38Å; L158-Q223 VanDerWaalsContact CA-OE1 3.26Å; L158-Q223 HydrophobicContact CB-CB 4.44Å; L158-Q223 HydrophobicContact CD1-CB 4.09Å; T161-Q223 VanDerWaalsContact OG1-CD 3.27Å; T161-Q223 PolarHBondContact OG1-NE2 3.26Å; T161-Q223 PolarHBondContact OG1-OE1 2.75Å; E219-Q223 WeakPolarHBondContact O-CG 3.47Å; E219-Q223 PolarHBondContact O-N 3.14Å; E219-Q223 PolarHBondContact OE1-NE2 3Å; A220-Q223 PolarHBondContact O-N 3.41Å; E221-Q223 PolarHBondContact O-N 3.09Å; Q223-L226 PolarHBondContact O-N 3.31Å; Q223-L227 WeakPolarHBondContact O-CB 2.98Å; Q223-L227 PolarHBondContact O-N 2.92Å
224R93.5Very high92.1Very high10 Ų1027.4 Ų27.44%0.03815%0.147CC..Hα-helixtrans-61.6-49.2177.3-170.7-167.668.6-121.1-7.1110.6R129 E136 L158 A220 E221 F222 L226 L227 L228 M239R129-R224 VanDerWaalsContact NH2-CZ 3.29Å; E136-R224 IonicContact OE2-CZ 3.55Å; E136-R224 IonicContact OE2-NE 3.47Å; E136-R224 IonicContact OE2-NH2 3.49Å; E136-R224 PolarHBondContact OE2-NH2 2.9Å; L158-R224 HydrophobicContact CD1-CB 4.31Å; L158-R224 HydrophobicContact CD2-CB 4.29Å; L158-R224 HydrophobicContact CD2-CG 4.45Å; A220-R224 WeakPolarHBondContact O-CB 3.1Å; A220-R224 PolarHBondContact O-N 3.08Å; E221-R224 PolarHBondContact O-N 3.22Å; E221-R224 IonicContact OE1-CZ 3.7Å; E221-R224 IonicContact OE1-NH1 3.68Å; E221-R224 PolarHBondContact OE1-NH1 3.17Å; E221-R224 IonicContact OE1-NH2 2.77Å; E221-R224 IonicContact OE2-CZ 3.1Å; E221-R224 IonicContact OE2-NH1 2.73Å; E221-R224 PolarHBondContact OE2-NH1 2.63Å; E221-R224 IonicContact OE2-NH2 2.58Å; E221-R224 PolarHBondContact OE2-NH2 3.43Å; F222-R224 VanDerWaalsContact C-N 3.35Å; F222-R224 PolarHBondContact O-N 3.4Å; R224-L226 VanDerWaalsContact C-N 3.3Å; R224-L226 PolarHBondContact O-N 2.92Å; R224-L227 CarbonylContact O-C 3.58Å; R224-L227 WeakPolarHBondContact O-CA 3.37Å; R224-L227 WeakPolarHBondContact O-CB 3.38Å; R224-L227 PolarHBondContact O-N 2.8Å; R224-L228 HydrophobicContact CG-CD1 3.88Å; R224-L228 HydrophobicContact CG-CG 4.12Å; R224-L228 VanDerWaalsContact O-CG 3.22Å; R224-L228 WeakPolarHBondContact O-CG 3.5Å; R224-L228 PolarHBondContact O-N 3.35Å; R224-M239 HydrophobicContact CG-SD 4.09Å
225I91.9Very high91.9Very high1 Ų131.4 Ų31.41%0.00517%0.166CC..Hα-helixtrans-56.6-46.9-179.7-68.5166.1000111.2L23 I27 E136 Y139 E221 F222 L227 L228 T229L23-I225 HydrophobicContact CD1-CD1 3.95Å; L23-I225 HydrophobicContact CD2-CD1 3.85Å; L23-I225 HydrophobicContact CD2-CG2 3.77Å; L23-I225 HydrophobicContact CG-CD1 4.07Å; I27-I225 HydrophobicContact CD1-CD1 3.75Å; I27-I225 HydrophobicContact CG1-CD1 4.31Å; E136-I225 HydrophobicContact CG-CD1 4.46Å; E136-I225 HydrophobicContact CG-CG1 3.89Å; E136-I225 HydrophobicContact CG-CG2 4.4Å; E136-I225 WeakPolarHBondContact OE2-CG1 3.49Å; Y139-I225 HydrophobicContact CD1-CG2 3.79Å; Y139-I225 HydrophobicContact CE1-CG2 3.76Å; E221-I225 WeakPolarHBondContact O-CD1 3.41Å; E221-I225 WeakPolarHBondContact O-CG1 3.19Å; E221-I225 PolarHBondContact O-N 2.88Å; F222-I225 PolarHBondContact O-N 3.41Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 3.23Å; I225-L228 PolarHBondContact O-N 3.01Å; I225-T229 PolarHBondContact O-N 2.91Å
226L89Confident91.7Very high8 Ų828.1 Ų28.14%0.04215%0.148CC..Hα-helixtrans-61.1-40.7177.1-66.8171.1000111.4L15 V19 L154 F222 Q223 R224 T229L15-L226 HydrophobicContact CB-CD1 3.74Å; L15-L226 HydrophobicContact CD1-CD1 4.21Å; L15-L226 HydrophobicContact CD2-CD1 4.36Å; L15-L226 HydrophobicContact CG-CD1 4.32Å; V19-L226 HydrophobicContact CG2-CD2 4.07Å; V19-L226 HydrophobicContact CG2-CG 4.41Å; L154-L226 HydrophobicContact CD1-CB 3.86Å; L154-L226 HydrophobicContact CD2-CB 4.35Å; F222-L226 WeakPolarHBondContact O-CG 3.41Å; F222-L226 PolarHBondContact O-N 3.32Å; F222-L226 VanDerWaalsContact O-N 3.16Å; Q223-L226 PolarHBondContact O-N 3.31Å; R224-L226 VanDerWaalsContact C-N 3.3Å; R224-L226 PolarHBondContact O-N 2.92Å; L226-T229 PolarHBondContact O-N 3.5Å; L226-T229 PolarHBondContact O-OG1 3.24Å
227L90.9Very high91.6Very high1 Ų126.3 Ų26.31%0.00514%0.139CC..Hα-helixtrans-63.8-44.4176.7-179.159.1000111.4K151 L154 K155 L158 Q223 R224 I225 T229 T230 L231 M239K151-L227 HydrophobicContact CG-CD1 4Å; L154-L227 HydrophobicContact CB-CB 4.41Å; L154-L227 HydrophobicContact CB-CD1 4.15Å; L154-L227 HydrophobicContact CD1-CB 4.04Å; L154-L227 HydrophobicContact CD1-CD1 4.43Å; K155-L227 HydrophobicContact CG-CD1 3.99Å; K155-L227 HydrophobicContact CG-CD2 3.95Å; L158-L227 HydrophobicContact CD2-CD2 3.86Å; Q223-L227 WeakPolarHBondContact O-CB 2.98Å; Q223-L227 PolarHBondContact O-N 2.92Å; R224-L227 CarbonylContact O-C 3.58Å; R224-L227 WeakPolarHBondContact O-CA 3.37Å; R224-L227 WeakPolarHBondContact O-CB 3.38Å; R224-L227 PolarHBondContact O-N 2.8Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 3.23Å; L227-T229 PolarHBondContact O-N 2.87Å; L227-T230 WeakPolarHBondContact O-CA 3.32Å; L227-T230 WeakPolarHBondContact O-CB 3.47Å; L227-T230 PolarHBondContact O-N 2.83Å; L227-T230 PolarHBondContact O-OG1 3.33Å; L227-L231 HydrophobicContact CD1-CD2 4.38Å; L227-L231 HydrophobicContact CG-CD1 4.21Å; L227-L231 HydrophobicContact CG-CG 4.41Å; L227-M239 HydrophobicContact CD2-CE 3.78Å; L227-M239 HydrophobicContact CD2-SD 4.02Å
228L91.5Very high91.5Very high0 Ų031.6 Ų31.60%016%0.161CC..Hα-helixtrans-57.9-34.1-179-68.4165.7000112.5E136 I140 R224 I225 T230 L231 Q236 M239 I240E136-L228 VanDerWaalsContact OE1-CD1 3.24Å; E136-L228 WeakPolarHBondContact OE1-CD1 3.36Å; I140-L228 HydrophobicContact CD1-CB 3.71Å; I140-L228 HydrophobicContact CD1-CD1 4.28Å; R224-L228 HydrophobicContact CG-CD1 3.88Å; R224-L228 HydrophobicContact CG-CG 4.12Å; R224-L228 VanDerWaalsContact O-CG 3.22Å; R224-L228 WeakPolarHBondContact O-CG 3.5Å; R224-L228 PolarHBondContact O-N 3.35Å; I225-L228 PolarHBondContact O-N 3.01Å; L228-T230 PolarHBondContact O-N 2.94Å; L228-L231 HydrophobicContact CD2-CD1 4.42Å; L228-L231 PolarHBondContact O-N 3.31Å; L228-L231 VanDerWaalsContact O-N 3.08Å; L228-Q236 HydrophobicContact CB-CG 4.19Å; L228-Q236 VanDerWaalsContact CD2-CA 3.49Å; L228-Q236 HydrophobicContact CD2-CB 3.64Å; L228-Q236 HydrophobicContact CD2-CG 3.76Å; L228-Q236 PolarHBondContact O-NE2 3.3Å; L228-M239 HydrophobicContact CD2-CB 4.47Å; L228-M239 HydrophobicContact CD2-SD 4.13Å; L228-I240 HydrophobicContact CD1-CD1 3.68Å; L228-I240 HydrophobicContact CD1-CG1 3.98Å; L228-I240 HydrophobicContact CD2-CD1 4.02Å; L228-I240 HydrophobicContact CD2-CG1 4.2Å
229T88.6Confident91.5Very high31 Ų3134 Ų3419%0.1917%0.173CC..THydrogen-bonded Turntrans-59.6-19.2174.469.20000113.9Y139 I140 I225 L226 L227Y139-T229 HydrophobicContact CD1-CG2 4.43Å; Y139-T229 HydrophobicContact CE1-CG2 3.8Å; I140-T229 HydrophobicContact CG1-CG2 4.2Å; I225-T229 PolarHBondContact O-N 2.91Å; L226-T229 PolarHBondContact O-N 3.5Å; L226-T229 PolarHBondContact O-OG1 3.24Å; L227-T229 PolarHBondContact O-N 2.87Å
230T88.1Confident91.6Very high47 Ų4732.5 Ų32.529%0.28817%0.165SC..THydrogen-bonded Turntrans-101-5.7-179.277.20000113.9V149 L227 L228V149-T230 HydrophobicContact CB-CG2 4.41Å; L227-T230 WeakPolarHBondContact O-CA 3.32Å; L227-T230 WeakPolarHBondContact O-CB 3.47Å; L227-T230 PolarHBondContact O-N 2.83Å; L227-T230 PolarHBondContact O-OG1 3.33Å; L228-T230 PolarHBondContact O-N 2.94Å
231L89.4Confident91.6Very high6 Ų632.3 Ų32.33%0.03116%0.163CC..SBendtrans-101.5150.8-174.8-59.9-173.2000111.4K151 L227 L228 E235 Q236 M239K151-L231 HydrophobicContact CD-CD2 4.21Å; K151-L231 VanDerWaalsContact NZ-CD2 3.28Å; L227-L231 HydrophobicContact CD1-CD2 4.38Å; L227-L231 HydrophobicContact CG-CD1 4.21Å; L227-L231 HydrophobicContact CG-CG 4.41Å; L228-L231 HydrophobicContact CD2-CD1 4.42Å; L228-L231 PolarHBondContact O-N 3.31Å; L228-L231 VanDerWaalsContact O-N 3.08Å; L231-E235 HydrophobicContact CB-CB 4.15Å; L231-E235 HydrophobicContact CD1-CB 4.35Å; L231-Q236 HydrophobicContact CB-CG 3.86Å; L231-Q236 PolarHBondContact O-NE2 3.43Å; L231-M239 HydrophobicContact CD1-CE 3.57Å; L231-M239 HydrophobicContact CD1-SD 4.09Å
232P89.9Confident91.6Very high66 Ų6637.3 Ų37.343%0.42919%0.186SC..  trans-65.8157.4166.230-34.2000110.9D234 E235 Q236P232-D234 VanDerWaalsContact C-N 3.33Å; P232-D234 PolarHBondContact O-N 3.35Å; P232-E235 HydrophobicContact CG-CB 3.91Å; P232-E235 HydrophobicContact CG-CG 3.73Å; P232-E235 VanDerWaalsContact CG-OE1 3.29Å; P232-E235 WeakPolarHBondContact CG-OE1 3.41Å; P232-E235 PolarHBondContact O-N 3.31Å; P232-E235 VanDerWaalsContact O-N 3.13Å; P232-Q236 WeakPolarHBondContact O-CG 3.48Å; P232-Q236 PolarHBondContact O-N 3.05Å
233K89.2Confident91.7Very high79 Ų7938.3 Ų38.334%0.34320%0.198SC..Hα-helixtrans-57.5-41.4-170.8-170.864.3176.5177.60113.3N83 E235 Q236 I237N83-K233 WeakPolarHBondContact O-CE 3.24Å; N83-K233 PolarHBondContact OD1-NZ 2.93Å; K233-E235 PolarHBondContact O-N 3.42Å; K233-Q236 WeakPolarHBondContact O-CB 3.25Å; K233-Q236 PolarHBondContact O-N 3.5Å; K233-I237 HydrophobicContact CG-CD1 4.19Å; K233-I237 WeakPolarHBondContact O-CG1 3.45Å; K233-I237 PolarHBondContact O-N 3.42Å
234D89.9Confident91.9Very high91 Ų9138.1 Ų38.149%0.48720%0.197SC..Hα-helixtrans-66.4-38.6180-59.9-32.9000112.2T86 P232 Q236 I237 K238T86-D234 PolarHBondContact OG1-OD1 3.49Å; P232-D234 VanDerWaalsContact C-N 3.33Å; P232-D234 PolarHBondContact O-N 3.35Å; D234-Q236 VanDerWaalsContact C-N 3.34Å; D234-I237 PolarHBondContact O-N 2.89Å; D234-K238 WeakPolarHBondContact O-CB 3.45Å; D234-K238 PolarHBondContact O-N 3.44Å
235E91.8Very high92Very high90 Ų9040.7 Ų40.742%0.42121%0.211SC..Hα-helixtrans-66.4-36.9173.5-75.6-179.6-139.600111.7L231 P232 K233 M239L231-E235 HydrophobicContact CB-CB 4.15Å; L231-E235 HydrophobicContact CD1-CB 4.35Å; P232-E235 HydrophobicContact CG-CB 3.91Å; P232-E235 HydrophobicContact CG-CG 3.73Å; P232-E235 VanDerWaalsContact CG-OE1 3.29Å; P232-E235 WeakPolarHBondContact CG-OE1 3.41Å; P232-E235 PolarHBondContact O-N 3.31Å; P232-E235 VanDerWaalsContact O-N 3.13Å; K233-E235 PolarHBondContact O-N 3.42Å; E235-M239 VanDerWaalsContact O-CB 3.3Å; E235-M239 WeakPolarHBondContact O-CB 3.47Å; E235-M239 PolarHBondContact O-N 2.91Å
236Q92.7Very high92Very high9 Ų946.4 Ų46.44%0.04224%0.236CC..Hα-helixtrans-60.5-52175-65.3171.617.200111L228 L231 P232 K233 D234 K238 M239 I240L228-Q236 HydrophobicContact CB-CG 4.19Å; L228-Q236 VanDerWaalsContact CD2-CA 3.49Å; L228-Q236 HydrophobicContact CD2-CB 3.64Å; L228-Q236 HydrophobicContact CD2-CG 3.76Å; L228-Q236 PolarHBondContact O-NE2 3.3Å; L231-Q236 HydrophobicContact CB-CG 3.86Å; L231-Q236 PolarHBondContact O-NE2 3.43Å; P232-Q236 WeakPolarHBondContact O-CG 3.48Å; P232-Q236 PolarHBondContact O-N 3.05Å; K233-Q236 WeakPolarHBondContact O-CB 3.25Å; K233-Q236 PolarHBondContact O-N 3.5Å; D234-Q236 VanDerWaalsContact C-N 3.34Å; Q236-K238 PolarHBondContact O-N 3.36Å; Q236-M239 PolarHBondContact O-N 2.98Å; Q236-I240 WeakPolarHBondContact O-CD1 3.12Å; Q236-I240 WeakPolarHBondContact O-CG1 3.28Å; Q236-I240 PolarHBondContact O-N 3.47Å
237I93.3Very high92.2Very high9 Ų946.4 Ų46.45%0.04624%0.236CC..Hα-helixtrans-58.3-49.9179.8-70.2170.9000110.3Y79 L80 N83 K233 D234 M239 I240 I241Y79-I237 HydrophobicContact CE1-CG1 4.26Å; Y79-I237 HydrophobicContact CE1-CG2 4.33Å; L80-I237 HydrophobicContact CD2-CG2 3.52Å; N83-I237 HydrophobicContact CB-CD1 4.36Å; K233-I237 HydrophobicContact CG-CD1 4.19Å; K233-I237 WeakPolarHBondContact O-CG1 3.45Å; K233-I237 PolarHBondContact O-N 3.42Å; D234-I237 PolarHBondContact O-N 2.89Å; I237-M239 VanDerWaalsContact C-N 3.34Å; I237-M239 PolarHBondContact O-N 3.28Å; I237-I240 PolarHBondContact O-N 3.14Å; I237-I241 HydrophobicContact CG2-CG1 4.29Å; I237-I241 WeakPolarHBondContact O-CB 3.35Å; I237-I241 WeakPolarHBondContact O-CG1 3.48Å; I237-I241 PolarHBondContact O-N 3.44Å
238K93.1Very high92.4Very high130 Ų13046.6 Ų46.657%0.56524%0.237SC*.Hα-helixtrans-57.7-46.1179.5-176.9176.7-179.9176.60112D234 Q236 I240 Q242D234-K238 WeakPolarHBondContact O-CB 3.45Å; D234-K238 PolarHBondContact O-N 3.44Å; Q236-K238 PolarHBondContact O-N 3.36Å; K238-I240 PolarHBondContact O-N 3.13Å; K238-Q242 HydrophobicContact CG-CG 4.46Å; K238-Q242 WeakPolarHBondContact O-CB 3.48Å; K238-Q242 WeakPolarHBondContact O-CG 3.5Å; K238-Q242 PolarHBondContact O-N 3.07Å
239M94.3Very high92.4Very high52 Ų5250.4 Ų50.426%0.25626%0.261SS..Hα-helixtrans-62.2-43.9-179.8-178.9175.8-69.900112.1R224 L227 L228 L231 E235 Q236 I237 A243R224-M239 HydrophobicContact CG-SD 4.09Å; L227-M239 HydrophobicContact CD2-CE 3.78Å; L227-M239 HydrophobicContact CD2-SD 4.02Å; L228-M239 HydrophobicContact CD2-CB 4.47Å; L228-M239 HydrophobicContact CD2-SD 4.13Å; L231-M239 HydrophobicContact CD1-CE 3.57Å; L231-M239 HydrophobicContact CD1-SD 4.09Å; E235-M239 VanDerWaalsContact O-CB 3.3Å; E235-M239 WeakPolarHBondContact O-CB 3.47Å; E235-M239 PolarHBondContact O-N 2.91Å; Q236-M239 PolarHBondContact O-N 2.98Å; I237-M239 VanDerWaalsContact C-N 3.34Å; I237-M239 PolarHBondContact O-N 3.28Å; M239-A243 WeakPolarHBondContact O-CB 3.47Å; M239-A243 PolarHBondContact O-N 3.09Å; M239-A243 VanDerWaalsContact O-N 3.11Å
240I95Very high92.4Very high0 Ų050.4 Ų50.40%026%0.26CS..Hα-helixtrans-68.6-47-178.6-71.3159.6000111W75 Y79 E136 L228 Q236 I237 K238 Q242 A243 M244W75-I240 HydrophobicContact CH2-CG2 3.8Å; W75-I240 HydrophobicContact CZ2-CG2 3.81Å; Y79-I240 HydrophobicContact CE1-CB 4.34Å; Y79-I240 HydrophobicContact CE1-CG2 4Å; Y79-I240 HydrophobicContact CE2-CD1 4.23Å; Y79-I240 HydrophobicContact CE2-CG2 4.09Å; Y79-I240 WeakPolarHBondContact OH-CD1 3.16Å; E136-I240 WeakPolarHBondContact OE1-CD1 3.25Å; L228-I240 HydrophobicContact CD1-CD1 3.68Å; L228-I240 HydrophobicContact CD1-CG1 3.98Å; L228-I240 HydrophobicContact CD2-CD1 4.02Å; L228-I240 HydrophobicContact CD2-CG1 4.2Å; Q236-I240 WeakPolarHBondContact O-CD1 3.12Å; Q236-I240 WeakPolarHBondContact O-CG1 3.28Å; Q236-I240 PolarHBondContact O-N 3.47Å; I237-I240 PolarHBondContact O-N 3.14Å; K238-I240 PolarHBondContact O-N 3.13Å; I240-Q242 PolarHBondContact O-N 2.97Å; I240-A243 PolarHBondContact O-N 3.3Å; I240-M244 WeakPolarHBondContact O-CG 3.37Å; I240-M244 PolarHBondContact O-N 3.34Å
241I94.8Very high92.5Very high10 Ų1048.5 Ų48.55%0.05125%0.248CC..Hα-helixtrans-59.1-47.6177.6-70-65.2000110.9W75 A76 Y79 L80 Y94 I237 A243 M244 D245W75-I241 HydrophobicContact CH2-CD1 3.96Å; W75-I241 HydrophobicContact CZ3-CD1 3.86Å; A76-I241 HydrophobicContact CB-CD1 4.26Å; Y79-I241 HydrophobicContact CD1-CD1 4.01Å; Y79-I241 HydrophobicContact CD1-CG1 4.44Å; L80-I241 HydrophobicContact CD1-CD1 4.27Å; L80-I241 HydrophobicContact CD2-CD1 4.18Å; L80-I241 HydrophobicContact CD2-CG1 4.15Å; L80-I241 HydrophobicContact CG-CD1 4.09Å; Y94-I241 HydrophobicContact CE2-CD1 4.44Å; Y94-I241 HydrophobicContact CE2-CG2 3.87Å; Y94-I241 VanDerWaalsContact OH-CG2 3.24Å; Y94-I241 WeakPolarHBondContact OH-CG2 3.36Å; I237-I241 HydrophobicContact CG2-CG1 4.29Å; I237-I241 WeakPolarHBondContact O-CB 3.35Å; I237-I241 WeakPolarHBondContact O-CG1 3.48Å; I237-I241 PolarHBondContact O-N 3.44Å; I241-A243 VanDerWaalsContact C-N 3.34Å; I241-A243 PolarHBondContact O-N 3.42Å; I241-M244 PolarHBondContact O-N 3.42Å; I241-D245 VanDerWaalsContact O-CB 3.29Å; I241-D245 WeakPolarHBondContact O-CB 3.39Å; I241-D245 PolarHBondContact O-N 3.36Å
242Q94.1Very high91.7Very high114 Ų11451.5 Ų51.553%0.53327%0.27SS..Hα-helixtrans-61.5-40.7179.4-74.3178.9-29.400112.8K238 I240 K246K238-Q242 HydrophobicContact CG-CG 4.46Å; K238-Q242 WeakPolarHBondContact O-CB 3.48Å; K238-Q242 WeakPolarHBondContact O-CG 3.5Å; K238-Q242 PolarHBondContact O-N 3.07Å; I240-Q242 PolarHBondContact O-N 2.97Å; Q242-K246 PolarHBondContact O-N 3.24Å; Q242-K246 VanDerWaalsContact O-N 3.16Å
243A93.6Very high91.8Very high39 Ų3950.8 Ų50.832%0.32226%0.262SS..Hα-helixtrans-64.5-43.4177.700000111.5M239 I240 I241 D247M239-A243 WeakPolarHBondContact O-CB 3.47Å; M239-A243 PolarHBondContact O-N 3.09Å; M239-A243 VanDerWaalsContact O-N 3.11Å; I240-A243 PolarHBondContact O-N 3.3Å; I241-A243 VanDerWaalsContact C-N 3.34Å; I241-A243 PolarHBondContact O-N 3.42Å; A243-D247 PolarHBondContact O-N 3.19Å; A243-D247 VanDerWaalsContact O-N 3.11Å
244M95.4Very high91.9Very high7 Ų749.3 Ų49.33%0.03426%0.258CS..Hα-helixtrans-76.7-32-178-67.3-5597.100113.3F72 W75 W126 R129 I240 I241 D247 S248F72-M244 HydrophobicContact CD2-CB 4.33Å; F72-M244 HydrophobicContact CE2-CB 3.95Å; W75-M244 HydrophobicContact CE3-CB 4.17Å; W75-M244 HydrophobicContact CH2-CB 3.46Å; W75-M244 VanDerWaalsContact CH2-CB 3.46Å; W75-M244 HydrophobicContact CH2-CG 3.36Å; W75-M244 HydrophobicContact CZ2-CB 4.22Å; W75-M244 HydrophobicContact CZ2-CG 3.67Å; W75-M244 HydrophobicContact CZ3-CB 3.43Å; W75-M244 VanDerWaalsContact CZ3-CB 3.43Å; W75-M244 HydrophobicContact CZ3-CG 3.85Å; W126-M244 HydrophobicContact CH2-CB 4.21Å; W126-M244 HydrophobicContact CZ3-CB 4.22Å; W126-M244 HydrophobicContact CZ3-CG 4.49Å; W126-M244 HydrophobicContact CZ3-SD 4.34Å; R129-M244 HydrophobicContact CG-SD 4.12Å; R129-M244 PolarHBondContact NE-SD 3.39Å; R129-M244 VanDerWaalsContact NE-SD 3.41Å; R129-M244 PolarHBondContact NH1-SD 3.32Å; I240-M244 WeakPolarHBondContact O-CG 3.37Å; I240-M244 PolarHBondContact O-N 3.34Å; I241-M244 PolarHBondContact O-N 3.42Å; M244-D247 PolarHBondContact O-N 3.27Å; M244-S248 PolarHBondContact O-N 3.38Å
245D95Very high92Very high64 Ų6447 Ų4734%0.34225%0.245SC..Hα-helixtrans-62.2-46.3171.9-171.758.8000110.6F72 I241 D247 S248F72-D245 HydrophobicContact CE1-CB 4.33Å; F72-D245 VanDerWaalsContact CE1-OD1 3.24Å; F72-D245 WeakPolarHBondContact CE1-OD1 3.45Å; F72-D245 HydrophobicContact CE2-CB 4.23Å; F72-D245 VanDerWaalsContact CZ-CA 3.48Å; F72-D245 HydrophobicContact CZ-CB 3.64Å; F72-D245 WeakPolarHBondContact CZ-OD1 3.47Å; I241-D245 VanDerWaalsContact O-CB 3.29Å; I241-D245 WeakPolarHBondContact O-CB 3.39Å; I241-D245 PolarHBondContact O-N 3.36Å; D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 PolarHBondContact O-N 3.44Å; D245-S248 PolarHBondContact O-N 3.01Å; D245-S248 PolarHBondContact O-OG 2.85Å
246K93.5Very high92Very high121 Ų12144.5 Ų44.553%0.52624%0.235SC..Hα-helixtrans-57.3-43.7172.1-173.2176.6179.7179.90110.9E166 Q242 S248 T249E166-K246 IonicContact OE2-NZ 3.35Å; E166-K246 PolarHBondContact OE2-NZ 3.44Å; Q242-K246 PolarHBondContact O-N 3.24Å; Q242-K246 VanDerWaalsContact O-N 3.16Å; K246-S248 VanDerWaalsContact C-N 3.34Å; K246-S248 PolarHBondContact O-N 3.33Å; K246-T249 PolarHBondContact O-N 2.93Å; K246-T249 PolarHBondContact O-OG1 3.15Å
247D92.4Very high92Very high8 Ų846.7 Ų46.74%0.04325%0.247CC..Hα-helixtrans-64.3-36.1179-170.561.2000113.6Y34 K125 A243 M244 D245 T249 N250Y34-D247 VanDerWaalsContact CE2-OD1 3.31Å; Y34-D247 WeakPolarHBondContact CE2-OD1 3.35Å; Y34-D247 PolarHBondContact OH-OD1 3.41Å; K125-D247 IonicContact NZ-OD2 3.76Å; K125-D247 PolarHBondContact NZ-OD2 2.97Å; A243-D247 PolarHBondContact O-N 3.19Å; A243-D247 VanDerWaalsContact O-N 3.11Å; M244-D247 PolarHBondContact O-N 3.27Å; D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 PolarHBondContact O-N 3.44Å; D247-T249 PolarHBondContact O-N 3.28Å; D247-N250 VanDerWaalsContact O-CB 3.31Å; D247-N250 WeakPolarHBondContact O-CB 3.49Å; D247-N250 PolarHBondContact O-N 3.08Å; D247-N250 PolarHBondContact OD1-ND2 3.4Å
248S94.3Very high91.9Very high5 Ų549.2 Ų49.24%0.03526%0.26CS..Hα-helixtrans-62.6-14.1-177.979.30000114E68 M244 D245 K246E68-S248 WeakPolarHBondContact CB-O 3.36Å; M244-S248 PolarHBondContact O-N 3.38Å; D245-S248 PolarHBondContact O-N 3.01Å; D245-S248 PolarHBondContact O-OG 2.85Å; K246-S248 VanDerWaalsContact C-N 3.34Å; K246-S248 PolarHBondContact O-N 3.33Å
249T92.5Very high91.8Very high81 Ų8143.4 Ų43.450%0.49724%0.238SC..THydrogen-bonded Turntrans-100.84179.263.90000113.3K246 D247 C251K246-T249 PolarHBondContact O-N 2.93Å; K246-T249 PolarHBondContact O-OG1 3.15Å; D247-T249 PolarHBondContact O-N 3.28Å; T249-C251 VanDerWaalsContact C-N 3.25Å; T249-C251 PolarHBondContact O-N 3.17Å
250N87.8Confident91.7Very high30 Ų3042.8 Ų42.816%0.1624%0.237CC..  trans-78.466.4179.4-71.8-29.6000112.6K41 D247K41-N250 PolarHBondContact NZ-O 3.4Å; D247-N250 VanDerWaalsContact O-CB 3.31Å; D247-N250 WeakPolarHBondContact O-CB 3.49Å; D247-N250 PolarHBondContact O-N 3.08Å; D247-N250 PolarHBondContact OD1-ND2 3.4Å
251C89.7Confident91.4Very high7 Ų746.3 Ų46.35%0.04726%0.257CS..  trans-113.2134.2167.6-70.90000109.6H61 C64 L65 T249H61-C251 PolarHBondContact CE1-O 3.47Å; C64-C251 HydrophobicContact CB-CB 3.76Å; C64-C251 WeakPolarHBondContact CB-SG 3.41Å; C64-C251 WeakPolarHBondContact SG-CB 3.31Å; C64-C251 CovalentContact SG-SG 2.04Å; C64-C251 PolarHBondContact SG-SG 3.19Å; L65-C251 HydrophobicContact CD2-CB 3.86Å; L65-C251 HydrophobicContact CG-CB 4.08Å; L65-C251 PolarHBondContact N-SG 3.13Å; T249-C251 VanDerWaalsContact C-N 3.25Å; T249-C251 PolarHBondContact O-N 3.17Å
252S73.4Confident91.1Very high70 Ų7049.6 Ų49.649%0.4928%0.275SS..  trans-72.50178.5-47.90000112.7H61 E176H61-S252 PolarHBondContact ND1-O 3.48Å; E176-S252 VanDerWaalsContact OE2-CB 3.31Å; E176-S252 WeakPolarHBondContact OE2-CB 3.09Å; E176-S252 PolarHBondContact OE2-OG 3.06Å

Retrieved 252 of 252 residues in 101.7 ms (Link to these results)

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