A0A093GSW4_STRCA Loading...

Glucose-6-phosphatase

May hydrolyze glucose-6-phosphate to glucose in the endoplasmic reticulum. May be responsible for glucose production through glycogenolysis and gluconeogenesis.

AlphaFold DB , UniProt , Accession A0A093GSW4, Species STRCA (Struthio camelus australis), Gene n/a, Length 355 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
1M81.3Confident90.1Very high149 Ų14966.2 Ų66.273%0.73435%0.347SS*.  0-46.40-72.8-54.2-73.100111.6L3 L4 H5M1-L3 PolarHBondContact O-N 3.27Å; M1-L4 WeakPolarHBondContact O-CB 3.29Å; M1-L4 PolarHBondContact O-N 2.96Å; M1-L4 VanDerWaalsContact O-N 3.1Å; M1-H5 PolarHBondContact O-N 3Å
2D85.1Confident90.6Very high87 Ų8760.7 Ų60.747%0.46532%0.318SS..Hα-helixtrans-57.3-46-179.6-70.7-28000115.5L4 H5 S6 I89D2-L4 VanDerWaalsContact C-N 3.26Å; D2-L4 PolarHBondContact O-N 3.23Å; D2-H5 PolarHBondContact O-N 3.11Å; D2-H5 VanDerWaalsContact O-N 3.16Å; D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 3.31Å; D2-S6 PolarHBondContact O-OG 3.28Å; D2-S6 VanDerWaalsContact O-OG 3.1Å; D2-I89 HydrophobicContact CB-CD1 3.48Å; D2-I89 VanDerWaalsContact CB-CD1 3.48Å
3L86.6Confident90.9Very high128 Ų12860.8 Ų60.867%0.6732%0.316SS*.Hα-helixtrans-57.9-39.8174.7-177.865.4000112.5M1 N7M1-L3 PolarHBondContact O-N 3.27Å; L3-N7 WeakPolarHBondContact O-CB 3.42Å; L3-N7 VanDerWaalsContact O-CG 3.25Å; L3-N7 PolarHBondContact O-N 3.32Å; L3-N7 PolarHBondContact O-ND2 3.35Å
4L90Very high91.2Very high77 Ų7765.6 Ų65.640%0.40333%0.329SS..Hα-helixtrans-67.5-39.8179.1-175.468.4000111.2M1 D2 G8 H177M1-L4 WeakPolarHBondContact O-CB 3.29Å; M1-L4 PolarHBondContact O-N 2.96Å; M1-L4 VanDerWaalsContact O-N 3.1Å; D2-L4 VanDerWaalsContact C-N 3.26Å; D2-L4 PolarHBondContact O-N 3.23Å; L4-G8 PolarHBondContact O-N 3.44Å; L4-H177 HydrophobicContact CD2-CB 4.11Å
5H91.2Very high91.4Very high7 Ų762.5 Ų62.53%0.03231%0.314CS..Hα-helixtrans-69.8-44175.5-69.1172.7000111.8M1 D2 N7 G8 V9 W83 F175 H177M1-H5 PolarHBondContact O-N 3Å; D2-H5 PolarHBondContact O-N 3.11Å; D2-H5 VanDerWaalsContact O-N 3.16Å; H5-N7 PolarHBondContact O-N 2.9Å; H5-G8 CarbonylContact O-C 3.51Å; H5-G8 WeakPolarHBondContact O-CA 3.4Å; H5-G8 PolarHBondContact O-N 2.87Å; H5-V9 WeakPolarHBondContact O-CG2 3.32Å; H5-V9 PolarHBondContact O-N 2.86Å; H5-W83 HydrophobicContact CB-CD2 3.79Å; H5-W83 VanDerWaalsContact CB-CE2 3.49Å; H5-W83 HydrophobicContact CB-CE3 3.9Å; H5-W83 HydrophobicContact CB-CH2 3.44Å; H5-W83 VanDerWaalsContact CB-CH2 3.44Å; H5-W83 HydrophobicContact CB-CZ2 3.33Å; H5-W83 HydrophobicContact CB-CZ3 3.73Å; H5-W83 AromaticContact CG-CE2 3.84Å; H5-W83 AromaticContact ND1-CD1 3.56Å; H5-W83 AromaticContact ND1-CD2 3.9Å; H5-W83 AromaticContact ND1-CE2 3.4Å; H5-W83 AromaticContact ND1-CZ2 3.94Å; H5-W83 AromaticContact ND1-NE1 3.15Å; H5-W83 PolarHBondContact ND1-NE1 3.33Å; H5-W83 VanDerWaalsContact ND1-NE1 3.15Å; H5-F175 HydrophobicContact CB-CE1 4.03Å; H5-F175 HydrophobicContact CB-CE2 4.34Å; H5-F175 HydrophobicContact CB-CZ 3.8Å; H5-F175 AromaticContact CD2-CD2 3.72Å; H5-F175 AromaticContact CD2-CE2 3.62Å; H5-F175 AromaticContact CD2-CZ 3.95Å; H5-F175 AromaticContact CG-CE2 3.82Å; H5-F175 AromaticContact CG-CZ 3.8Å; H5-F175 AromaticContact NE2-CD2 3.97Å; H5-F175 AromaticContact NE2-CE2 3.89Å; H5-F175 WeakPolarHBondContact O-CE1 3.38Å; H5-H177 AromaticContact CD2-CE1 3.66Å; H5-H177 AromaticContact NE2-CE1 3.72Å
6S89.8Confident91.6Very high18 Ų1859.1 Ų59.113%0.12630%0.297CS..Hα-helixtrans-58.4-46.8175.4-62.10000111.8D2 G8 V9 L10D2-S6 WeakPolarHBondContact O-CB 3.42Å; D2-S6 PolarHBondContact O-N 3.31Å; D2-S6 PolarHBondContact O-OG 3.28Å; D2-S6 VanDerWaalsContact O-OG 3.1Å; S6-G8 VanDerWaalsContact C-N 3.28Å; S6-G8 PolarHBondContact O-N 3.42Å; S6-V9 PolarHBondContact O-N 3.42Å; S6-L10 WeakPolarHBondContact O-CG 3.47Å; S6-L10 PolarHBondContact O-N 3.42Å
7N92.1Very high91.8Very high80 Ų8065.6 Ų65.643%0.42832%0.323SS..Hα-helixtrans-61.9-38.5174-71.4-11.4000111.7L3 H5 L10 I11L3-N7 WeakPolarHBondContact O-CB 3.42Å; L3-N7 VanDerWaalsContact O-CG 3.25Å; L3-N7 PolarHBondContact O-N 3.32Å; L3-N7 PolarHBondContact O-ND2 3.35Å; H5-N7 PolarHBondContact O-N 2.9Å; N7-L10 PolarHBondContact O-N 2.93Å; N7-I11 WeakPolarHBondContact O-CG1 3.45Å; N7-I11 PolarHBondContact O-N 3.45Å; N7-I11 VanDerWaalsContact O-N 3.08Å
8G93.3Very high91.9Very high3 Ų366.6 Ų66.63%0.03133%0.33CS..Hα-helixtrans-61.7-42.617400000113L4 H5 S6 I11 I12L4-G8 PolarHBondContact O-N 3.44Å; H5-G8 CarbonylContact O-C 3.51Å; H5-G8 WeakPolarHBondContact O-CA 3.4Å; H5-G8 PolarHBondContact O-N 2.87Å; S6-G8 VanDerWaalsContact C-N 3.28Å; S6-G8 PolarHBondContact O-N 3.42Å; G8-I11 PolarHBondContact O-N 2.87Å; G8-I12 VanDerWaalsContact O-CG1 3.24Å; G8-I12 WeakPolarHBondContact O-CG1 3.45Å; G8-I12 PolarHBondContact O-N 2.79Å
9V93.8Very high92Very high0 Ų068.4 Ų68.40%033%0.333CS..Hα-helixtrans-60.7-44.5174.9170.40000110.8H5 S6 I11 I12 Q13 W83 V84 P96 L98 F175H5-V9 WeakPolarHBondContact O-CG2 3.32Å; H5-V9 PolarHBondContact O-N 2.86Å; S6-V9 PolarHBondContact O-N 3.42Å; V9-I11 VanDerWaalsContact C-N 3.32Å; V9-I11 PolarHBondContact O-N 3.19Å; V9-I12 PolarHBondContact O-N 2.89Å; V9-I12 VanDerWaalsContact O-N 3.13Å; V9-Q13 HydrophobicContact CG1-CG 4.48Å; V9-Q13 WeakPolarHBondContact O-CG 3.3Å; V9-Q13 PolarHBondContact O-N 3.48Å; V9-W83 HydrophobicContact CG2-CE3 3.88Å; V9-W83 HydrophobicContact CG2-CZ3 3.7Å; V9-V84 HydrophobicContact CG1-CG2 4.45Å; V9-P96 HydrophobicContact CG1-CB 3.58Å; V9-P96 HydrophobicContact CG1-CG 3.91Å; V9-L98 HydrophobicContact CG1-CD2 4.19Å; V9-F175 HydrophobicContact CG2-CE1 3.98Å
10L93.4Very high91.9Very high101 Ų10171.9 Ų71.953%0.52934%0.342SS..Hα-helixtrans-59.4-42.5176.6-67.5174.4000112.1S6 N7 I12 Q13 Y14S6-L10 WeakPolarHBondContact O-CG 3.47Å; S6-L10 PolarHBondContact O-N 3.42Å; N7-L10 PolarHBondContact O-N 2.93Å; L10-I12 VanDerWaalsContact C-N 3.34Å; L10-I12 PolarHBondContact O-N 3.3Å; L10-Q13 PolarHBondContact O-N 2.96Å; L10-Y14 WeakPolarHBondContact O-CB 3.5Å; L10-Y14 PolarHBondContact O-N 3.4Å
11I95.2Very high92Very high78 Ų7873 Ų7340%0.436%0.364SS..Hα-helixtrans-62.6-42.3175.5-68164.1000110.8N7 G8 V9 Y14 L15 V169 P176N7-I11 WeakPolarHBondContact O-CG1 3.45Å; N7-I11 PolarHBondContact O-N 3.45Å; N7-I11 VanDerWaalsContact O-N 3.08Å; G8-I11 PolarHBondContact O-N 2.87Å; V9-I11 VanDerWaalsContact C-N 3.32Å; V9-I11 PolarHBondContact O-N 3.19Å; I11-Y14 PolarHBondContact O-N 3.02Å; I11-L15 HydrophobicContact CG2-CD1 4.06Å; I11-L15 HydrophobicContact CG2-CG 4.45Å; I11-L15 WeakPolarHBondContact O-CG 3.49Å; I11-L15 PolarHBondContact O-N 3.42Å; I11-V169 HydrophobicContact CG2-CG1 4.24Å; I11-P176 HydrophobicContact CB-CG 4.38Å; I11-P176 HydrophobicContact CD1-CG 3.92Å; I11-P176 HydrophobicContact CG2-CG 4.15Å
12I95.6Very high92.5Very high0 Ų072.6 Ų72.60%036%0.355CS..Hα-helixtrans-63-46.8178.2-63.6162.8000110.2G8 V9 L10 Y14 L15 Q16 P80 L98 V169 A172 F175G8-I12 VanDerWaalsContact O-CG1 3.24Å; G8-I12 WeakPolarHBondContact O-CG1 3.45Å; G8-I12 PolarHBondContact O-N 2.79Å; V9-I12 PolarHBondContact O-N 2.89Å; V9-I12 VanDerWaalsContact O-N 3.13Å; L10-I12 VanDerWaalsContact C-N 3.34Å; L10-I12 PolarHBondContact O-N 3.3Å; I12-Y14 VanDerWaalsContact C-N 3.32Å; I12-Y14 PolarHBondContact O-N 3.44Å; I12-L15 PolarHBondContact O-N 3.41Å; I12-Q16 HydrophobicContact CG2-CG 4.17Å; I12-Q16 WeakPolarHBondContact O-CB 3.19Å; I12-Q16 WeakPolarHBondContact O-CG 3.3Å; I12-Q16 PolarHBondContact O-N 2.83Å; I12-P80 HydrophobicContact CD1-CB 3.4Å; I12-P80 HydrophobicContact CD1-CG 3.46Å; I12-P80 VanDerWaalsContact CD1-CG 3.46Å; I12-L98 HydrophobicContact CB-CD2 4.15Å; I12-L98 HydrophobicContact CG2-CD2 3.76Å; I12-V169 HydrophobicContact CD1-CG1 4.48Å; I12-V169 HydrophobicContact CG1-CG1 3.51Å; I12-V169 WeakPolarHBondContact CG1-O 3.4Å; I12-A172 HydrophobicContact CG2-CB 4.1Å; I12-F175 HydrophobicContact CD1-CD1 4.4Å
13Q94.8Very high92.9Very high63 Ų6371.1 Ų71.129%0.29435%0.346SS..Hα-helixtrans-61.7-41.2178.1-70.4-171.7-59.100112.3V9 L10 Q16 K17 L98V9-Q13 HydrophobicContact CG1-CG 4.48Å; V9-Q13 WeakPolarHBondContact O-CG 3.3Å; V9-Q13 PolarHBondContact O-N 3.48Å; L10-Q13 PolarHBondContact O-N 2.96Å; Q13-Q16 PolarHBondContact O-N 2.94Å; Q13-K17 VanDerWaalsContact O-CB 3.23Å; Q13-K17 WeakPolarHBondContact O-CB 3.35Å; Q13-K17 PolarHBondContact O-N 3.46Å; Q13-L98 HydrophobicContact CG-CD2 3.7Å
14Y94.6Very high93.2Very high127 Ų12771.2 Ų71.250%0.49835%0.347SS..Hα-helixtrans-58.5-49.5173.9176.4-98.8000111.3L10 I11 I12 Q16 K17 D18 Y19L10-Y14 WeakPolarHBondContact O-CB 3.5Å; L10-Y14 PolarHBondContact O-N 3.4Å; I11-Y14 PolarHBondContact O-N 3.02Å; I12-Y14 VanDerWaalsContact C-N 3.32Å; I12-Y14 PolarHBondContact O-N 3.44Å; Y14-Q16 PolarHBondContact O-N 3.28Å; Y14-K17 PolarHBondContact O-N 3.08Å; Y14-D18 WeakPolarHBondContact CD2-OD2 3.3Å; Y14-D18 WeakPolarHBondContact CE2-OD2 3.46Å; Y14-D18 WeakPolarHBondContact O-CB 3.16Å; Y14-D18 PolarHBondContact O-N 3.47Å; Y14-Y19 AromaticContact CE1-CE2 3.87Å; Y14-Y19 HydrophobicContact CE1-CE2 3.87Å
15L94.8Very high93.4Very high20 Ų2072.5 Ų72.511%0.10535%0.35CS..Hα-helixtrans-62-45.2177.9-71.7173.3000112.2I11 I12 K17 Y19 I166 V169 F170I11-L15 HydrophobicContact CG2-CD1 4.06Å; I11-L15 HydrophobicContact CG2-CG 4.45Å; I11-L15 WeakPolarHBondContact O-CG 3.49Å; I11-L15 PolarHBondContact O-N 3.42Å; I12-L15 PolarHBondContact O-N 3.41Å; L15-K17 VanDerWaalsContact C-N 3.32Å; L15-K17 PolarHBondContact O-N 3.36Å; L15-Y19 HydrophobicContact CD2-CD2 3.9Å; L15-Y19 HydrophobicContact CD2-CE2 4.19Å; L15-Y19 WeakPolarHBondContact O-CA 3.41Å; L15-Y19 WeakPolarHBondContact O-CB 3.4Å; L15-Y19 PolarHBondContact O-N 2.82Å; L15-I166 HydrophobicContact CD1-CG2 4.37Å; L15-I166 HydrophobicContact CD2-CG2 4.18Å; L15-V169 HydrophobicContact CD1-CB 4.17Å; L15-V169 HydrophobicContact CD1-CG1 3.7Å; L15-F170 HydrophobicContact CB-CD2 4.16Å; L15-F170 WeakPolarHBondContact O-CE2 3.48Å
16Q94.9Very high93.6Very high8 Ų872.6 Ų72.64%0.03735%0.35CS..Hα-helixtrans-64.9-36.1179.7-72.8-177-19.500112.2I12 Q13 Y14 R20 E99 F170I12-Q16 HydrophobicContact CG2-CG 4.17Å; I12-Q16 WeakPolarHBondContact O-CB 3.19Å; I12-Q16 WeakPolarHBondContact O-CG 3.3Å; I12-Q16 PolarHBondContact O-N 2.83Å; Q13-Q16 PolarHBondContact O-N 2.94Å; Y14-Q16 PolarHBondContact O-N 3.28Å; Q16-R20 WeakPolarHBondContact O-CB 3.39Å; Q16-E99 PolarHBondContact NE2-O 3.29Å; Q16-F170 HydrophobicContact CG-CD2 4.3Å; Q16-F170 HydrophobicContact CG-CE2 4.36Å; Q16-F170 WeakPolarHBondContact CG-O 3.19Å; Q16-F170 PolarHBondContact NE2-O 3.22Å
17K94Very high93.7Very high169 Ų16973.6 Ų73.674%0.73535%0.354SS*.Hα-helixtrans-75.1-52.1179.1-174-176.5176.7-173.10112.4Q13 Y14 L15Q13-K17 VanDerWaalsContact O-CB 3.23Å; Q13-K17 WeakPolarHBondContact O-CB 3.35Å; Q13-K17 PolarHBondContact O-N 3.46Å; Y14-K17 PolarHBondContact O-N 3.08Å; L15-K17 VanDerWaalsContact C-N 3.32Å; L15-K17 PolarHBondContact O-N 3.36Å
18D94.6Very high93.8Very high84 Ų8475.6 Ų75.645%0.44936%0.359SS..Hα-helixtrans-91.8-22.3-167.1-63.9-33000113.3Y14Y14-D18 WeakPolarHBondContact CD2-OD2 3.3Å; Y14-D18 WeakPolarHBondContact CE2-OD2 3.46Å; Y14-D18 WeakPolarHBondContact O-CB 3.16Å; Y14-D18 PolarHBondContact O-N 3.47Å
19Y92.6Very high93.9Very high101 Ų10176.1 Ų76.140%0.39636%0.361SS..SBendtrans-110.917.2-179.1-64.3-94.8000113.6Y14 L15 A21 Y22Y14-Y19 AromaticContact CE1-CE2 3.87Å; Y14-Y19 HydrophobicContact CE1-CE2 3.87Å; L15-Y19 HydrophobicContact CD2-CD2 3.9Å; L15-Y19 HydrophobicContact CD2-CE2 4.19Å; L15-Y19 WeakPolarHBondContact O-CA 3.41Å; L15-Y19 WeakPolarHBondContact O-CB 3.4Å; L15-Y19 PolarHBondContact O-N 2.82Å; Y19-A21 PolarHBondContact O-N 2.71Å; Y19-Y22 AromaticContact CD1-CD2 3.99Å; Y19-Y22 HydrophobicContact CD1-CD2 3.99Å; Y19-Y22 HydrophobicContact CD1-CE2 4.37Å; Y19-Y22 PolarHBondContact O-N 3.24Å
20R90.4Very high93.8Very high137 Ų13776.2 Ų76.252%0.51736%0.362SS..G310 helixtrans-55-37.3179.4-166.1172.8-179.7140.17.6113.5Q16 Y22 Q23 E99Q16-R20 WeakPolarHBondContact O-CB 3.39Å; R20-Y22 PolarHBondContact O-N 3.34Å; R20-Y22 VanDerWaalsContact O-N 3.14Å; R20-Q23 VanDerWaalsContact O-CB 3.25Å; R20-Q23 WeakPolarHBondContact O-CB 3.35Å; R20-Q23 PolarHBondContact O-N 3.18Å; R20-Q23 VanDerWaalsContact O-N 3.08Å; R20-E99 IonicContact CZ-OE1 3.4Å; R20-E99 IonicContact CZ-OE2 3.9Å; R20-E99 IonicContact NH1-OE1 2.76Å; R20-E99 PolarHBondContact NH1-OE1 2.98Å; R20-E99 IonicContact NH1-OE2 3.95Å; R20-E99 IonicContact NH2-OE1 3.69Å; R20-E99 IonicContact NH2-OE2 3.99Å
21A93.3Very high93.7Very high97 Ų9776.2 Ų76.280%0.80236%0.359SS*.G310 helixtrans-61.8-20.3177.600000113.4Y19Y19-A21 PolarHBondContact O-N 2.71Å
22Y92.9Very high93.5Very high139 Ų13973.5 Ų73.555%0.54535%0.346SS..G310 helixtrans-9912.9178.8-59-79.7000113.1Y19 R20 D24 F25 L26Y19-Y22 AromaticContact CD1-CD2 3.99Å; Y19-Y22 HydrophobicContact CD1-CD2 3.99Å; Y19-Y22 HydrophobicContact CD1-CE2 4.37Å; Y19-Y22 PolarHBondContact O-N 3.24Å; R20-Y22 PolarHBondContact O-N 3.34Å; R20-Y22 VanDerWaalsContact O-N 3.14Å; Y22-D24 VanDerWaalsContact C-N 3.29Å; Y22-D24 PolarHBondContact O-N 3.15Å; Y22-F25 WeakPolarHBondContact O-CB 3.43Å; Y22-F25 PolarHBondContact O-N 3.43Å; Y22-F25 VanDerWaalsContact O-N 3.13Å; Y22-L26 WeakPolarHBondContact O-CG 3.21Å; Y22-L26 PolarHBondContact O-N 3.35Å
23Q92.9Very high93.2Very high57 Ų5773.5 Ų73.527%0.26635%0.346SS..Hα-helixtrans-50.6-46-178.9172.5-179-35.400112.6R20 F25 L26 N27 F101 F170R20-Q23 VanDerWaalsContact O-CB 3.25Å; R20-Q23 WeakPolarHBondContact O-CB 3.35Å; R20-Q23 PolarHBondContact O-N 3.18Å; R20-Q23 VanDerWaalsContact O-N 3.08Å; Q23-F25 PolarHBondContact O-N 3.27Å; Q23-L26 PolarHBondContact O-N 3.33Å; Q23-N27 WeakPolarHBondContact CG-ND2 3.27Å; Q23-N27 WeakPolarHBondContact O-CB 3.35Å; Q23-N27 VanDerWaalsContact O-CG 3.31Å; Q23-N27 PolarHBondContact O-N 2.85Å; Q23-N27 PolarHBondContact O-ND2 2.95Å; Q23-F101 HydrophobicContact CG-CE1 4.14Å; Q23-F170 HydrophobicContact CB-CE1 4.29Å; Q23-F170 HydrophobicContact CB-CZ 4.15Å; Q23-F170 HydrophobicContact CG-CE1 4.2Å; Q23-F170 HydrophobicContact CG-CZ 4.48Å
24D93.7Very high92.9Very high130 Ų13071.9 Ų71.970%0.69534%0.34SS*.Hα-helixtrans-64.8-41.3-178-67.3-27.1000112Y22 N27 F28Y22-D24 VanDerWaalsContact C-N 3.29Å; Y22-D24 PolarHBondContact O-N 3.15Å; D24-N27 PolarHBondContact O-N 2.93Å; D24-F28 WeakPolarHBondContact O-CB 3.1Å; D24-F28 PolarHBondContact O-N 3.32Å
25F94.4Very high92.5Very high104 Ų10466.6 Ų66.646%0.45632%0.32SS..Hα-helixtrans-62.9-45.3173.9172.6-102000111.3Y22 Q23 F28 M29Y22-F25 WeakPolarHBondContact O-CB 3.43Å; Y22-F25 PolarHBondContact O-N 3.43Å; Y22-F25 VanDerWaalsContact O-N 3.13Å; Q23-F25 PolarHBondContact O-N 3.27Å; F25-F28 WeakPolarHBondContact O-CB 3.33Å; F25-F28 PolarHBondContact O-N 2.85Å; F25-M29 HydrophobicContact CD1-CG 4.38Å; F25-M29 HydrophobicContact CD2-CG 4.32Å; F25-M29 HydrophobicContact CE1-CG 3.89Å; F25-M29 HydrophobicContact CE2-CG 3.83Å; F25-M29 HydrophobicContact CE2-SD 4.07Å; F25-M29 HydrophobicContact CZ-CG 3.59Å; F25-M29 HydrophobicContact CZ-SD 4.12Å; F25-M29 WeakPolarHBondContact O-CG 3.48Å; F25-M29 PolarHBondContact O-N 3.45Å
26L94.3Very high92.1Very high9 Ų970.6 Ų70.65%0.04733%0.334CS..Hα-helixtrans-64.5-43.4178.7-66.9175.1000111Y22 Q23 F28 M29 S30 I166 S167 F170Y22-L26 WeakPolarHBondContact O-CG 3.21Å; Y22-L26 PolarHBondContact O-N 3.35Å; Q23-L26 PolarHBondContact O-N 3.33Å; L26-F28 VanDerWaalsContact C-N 3.34Å; L26-F28 PolarHBondContact O-N 2.8Å; L26-M29 PolarHBondContact O-N 2.91Å; L26-M29 VanDerWaalsContact O-N 3.17Å; L26-S30 PolarHBondContact O-N 3.4Å; L26-I166 HydrophobicContact CD2-CG2 3.86Å; L26-S167 WeakPolarHBondContact O-CB 3.37Å; L26-S167 PolarHBondContact O-OG 3.08Å; L26-F170 HydrophobicContact CB-CD1 4.28Å; L26-F170 HydrophobicContact CD1-CB 3.88Å; L26-F170 HydrophobicContact CD1-CD1 3.84Å; L26-F170 HydrophobicContact CD1-CD2 3.47Å; L26-F170 VanDerWaalsContact CD1-CD2 3.47Å; L26-F170 HydrophobicContact CD1-CE1 4.25Å; L26-F170 HydrophobicContact CD1-CE2 3.9Å; L26-F170 HydrophobicContact CD1-CG 3.45Å; L26-F170 VanDerWaalsContact CD1-CG 3.45Å; L26-F170 HydrophobicContact CD1-CZ 4.28Å
27N92.6Very high91.8Very high39 Ų3970.8 Ų70.821%0.20934%0.336CS..Hα-helixtrans-60.8-43.1174.9-75.4-28.3000111.9Q23 D24 M29 S30 H31Q23-N27 WeakPolarHBondContact CG-ND2 3.27Å; Q23-N27 WeakPolarHBondContact O-CB 3.35Å; Q23-N27 VanDerWaalsContact O-CG 3.31Å; Q23-N27 PolarHBondContact O-N 2.85Å; Q23-N27 PolarHBondContact O-ND2 2.95Å; D24-N27 PolarHBondContact O-N 2.93Å; N27-M29 VanDerWaalsContact C-N 3.34Å; N27-M29 PolarHBondContact O-N 3.22Å; N27-S30 WeakPolarHBondContact O-CB 3.47Å; N27-S30 PolarHBondContact O-N 3.11Å; N27-H31 PolarHBondContact O-N 2.92Å
28F94.2Very high91.6Very high122 Ų12263 Ų6354%0.53530%0.302SS..Hα-helixtrans-58.3-45.7172.9173-101.4000111.7D24 F25 L26 S30 H31 V32D24-F28 WeakPolarHBondContact O-CB 3.1Å; D24-F28 PolarHBondContact O-N 3.32Å; F25-F28 WeakPolarHBondContact O-CB 3.33Å; F25-F28 PolarHBondContact O-N 2.85Å; L26-F28 VanDerWaalsContact C-N 3.34Å; L26-F28 PolarHBondContact O-N 2.8Å; F28-S30 VanDerWaalsContact C-N 3.3Å; F28-S30 PolarHBondContact O-N 3Å; F28-H31 CarbonylContact O-C 3.56Å; F28-H31 WeakPolarHBondContact O-CA 3.5Å; F28-H31 WeakPolarHBondContact O-CB 3.3Å; F28-H31 PolarHBondContact O-N 3.35Å; F28-V32 HydrophobicContact CD1-CG2 4.04Å; F28-V32 HydrophobicContact CE1-CG2 3.54Å; F28-V32 HydrophobicContact CE2-CG2 4.13Å; F28-V32 HydrophobicContact CZ-CG2 3.59Å; F28-V32 WeakPolarHBondContact O-CG2 3.3Å; F28-V32 PolarHBondContact O-N 3.16Å
29M94.3Very high91.4Very high14 Ų1459.6 Ų59.67%0.06928%0.283CS..Hα-helixtrans-65.6-32177.8-68.7-51.5-60.200112.9F25 L26 N27 H31 V32 G33 I160 V164F25-M29 HydrophobicContact CD1-CG 4.38Å; F25-M29 HydrophobicContact CD2-CG 4.32Å; F25-M29 HydrophobicContact CE1-CG 3.89Å; F25-M29 HydrophobicContact CE2-CG 3.83Å; F25-M29 HydrophobicContact CE2-SD 4.07Å; F25-M29 HydrophobicContact CZ-CG 3.59Å; F25-M29 HydrophobicContact CZ-SD 4.12Å; F25-M29 WeakPolarHBondContact O-CG 3.48Å; F25-M29 PolarHBondContact O-N 3.45Å; L26-M29 PolarHBondContact O-N 2.91Å; L26-M29 VanDerWaalsContact O-N 3.17Å; N27-M29 VanDerWaalsContact C-N 3.34Å; N27-M29 PolarHBondContact O-N 3.22Å; M29-H31 VanDerWaalsContact C-N 3.31Å; M29-H31 PolarHBondContact O-N 3.41Å; M29-V32 HydrophobicContact CE-CB 4.35Å; M29-V32 HydrophobicContact CE-CG1 4.24Å; M29-V32 PolarHBondContact O-N 3.12Å; M29-V32 HydrophobicContact SD-CG2 4.27Å; M29-G33 PolarHBondContact O-N 3.43Å; M29-I160 HydrophobicContact CE-CG2 4.22Å; M29-V164 HydrophobicContact CE-CG2 4.35Å
30S92.8Very high91.2Very high2 Ų254.9 Ų54.91%0.01427%0.265CS..Hα-helixtrans-61.6-40.9168.9-102.40000111.7L26 N27 F28 G33 D34 S167 R168L26-S30 PolarHBondContact O-N 3.4Å; N27-S30 WeakPolarHBondContact O-CB 3.47Å; N27-S30 PolarHBondContact O-N 3.11Å; F28-S30 VanDerWaalsContact C-N 3.3Å; F28-S30 PolarHBondContact O-N 3Å; S30-G33 CarbonylContact O-C 3.59Å; S30-G33 PolarHBondContact O-N 3.18Å; S30-D34 PolarHBondContact O-N 3.36Å; S30-S167 WeakPolarHBondContact CB-OG 3.31Å; S30-S167 PolarHBondContact N-OG 3.1Å; S30-S167 PolarHBondContact OG-OG 3.19Å; S30-R168 VanDerWaalsContact OG-CD 3.31Å; S30-R168 WeakPolarHBondContact OG-CD 3.42Å; S30-R168 PolarHBondContact OG-NH1 2.88Å
31H91.4Very high91.2Very high100 Ų10050.8 Ų50.846%0.46325%0.253SS..Hα-helixtrans-66.8-42.3175.6-171.264.8000111.7N27 F28 M29 G33 D34 N37N27-H31 PolarHBondContact O-N 2.92Å; F28-H31 CarbonylContact O-C 3.56Å; F28-H31 WeakPolarHBondContact O-CA 3.5Å; F28-H31 WeakPolarHBondContact O-CB 3.3Å; F28-H31 PolarHBondContact O-N 3.35Å; M29-H31 VanDerWaalsContact C-N 3.31Å; M29-H31 PolarHBondContact O-N 3.41Å; H31-G33 PolarHBondContact O-N 2.91Å; H31-D34 WeakPolarHBondContact O-CB 3.28Å; H31-D34 PolarHBondContact O-N 3.02Å; H31-N37 PolarHBondContact NE2-ND2 3.49Å; H31-N37 PolarHBondContact O-ND2 2.95Å
32V90.4Very high91.2Very high21 Ų2147.8 Ų47.813%0.12722%0.221CC..Hα-helixtrans-56.6-38.9173.91720000111.5F28 M29 D34 I160F28-V32 HydrophobicContact CD1-CG2 4.04Å; F28-V32 HydrophobicContact CE1-CG2 3.54Å; F28-V32 HydrophobicContact CE2-CG2 4.13Å; F28-V32 HydrophobicContact CZ-CG2 3.59Å; F28-V32 WeakPolarHBondContact O-CG2 3.3Å; F28-V32 PolarHBondContact O-N 3.16Å; M29-V32 HydrophobicContact CE-CB 4.35Å; M29-V32 HydrophobicContact CE-CG1 4.24Å; M29-V32 PolarHBondContact O-N 3.12Å; M29-V32 HydrophobicContact SD-CG2 4.27Å; V32-D34 VanDerWaalsContact C-N 3.31Å; V32-D34 PolarHBondContact O-N 3.44Å; V32-I160 HydrophobicContact CG1-CG2 4.42Å
33G88.8Confident91.2Very high1 Ų141.2 Ų41.21%0.0120%0.195CC..THydrogen-bonded Turntrans-80.60.7176.600000115.6M29 S30 H31 P35 H115M29-G33 PolarHBondContact O-N 3.43Å; S30-G33 CarbonylContact O-C 3.59Å; S30-G33 PolarHBondContact O-N 3.18Å; H31-G33 PolarHBondContact O-N 2.91Å; G33-P35 WeakPolarHBondContact O-CD 3.42Å; G33-H115 PolarHBondContact O-CD2 3.48Å
34D90.1Very high91.2Very high29 Ų2938.5 Ų38.516%0.15518%0.183CC..  trans-68.4123.1-178.3-170.9-26.7000110.6S30 H31 V32 R36 N37S30-D34 PolarHBondContact O-N 3.36Å; H31-D34 WeakPolarHBondContact O-CB 3.28Å; H31-D34 PolarHBondContact O-N 3.02Å; V32-D34 VanDerWaalsContact C-N 3.31Å; V32-D34 PolarHBondContact O-N 3.44Å; D34-R36 PolarHBondContact O-N 3.44Å; D34-R36 WeakPolarHBondContact OD1-CB 3.48Å; D34-R36 VanDerWaalsContact OD1-CG 3.23Å; D34-R36 WeakPolarHBondContact OD1-CG 3.44Å; D34-R36 PolarHBondContact OD1-N 2.89Å; D34-R36 IonicContact OD1-NE 3.39Å; D34-R36 IonicContact OD2-NE 2.69Å; D34-N37 WeakPolarHBondContact O-CB 3.29Å; D34-N37 PolarHBondContact O-N 3.25Å
35P85.4Confident91.2Very high15 Ų1535.3 Ų35.310%0.09717%0.165CC..Hα-helixtrans-56-21.2176.1-26.235.4000114.6G33 N37 I38 F39G33-P35 WeakPolarHBondContact O-CD 3.42Å; P35-N37 VanDerWaalsContact C-N 3.29Å; P35-N37 PolarHBondContact O-N 2.88Å; P35-I38 HydrophobicContact CB-CD1 4.22Å; P35-I38 VanDerWaalsContact O-CB 3.31Å; P35-I38 WeakPolarHBondContact O-CB 3.42Å; P35-I38 PolarHBondContact O-N 3.49Å; P35-F39 WeakPolarHBondContact O-CD2 3.48Å
36R86.3Confident91.1Very high104 Ų10432.3 Ų32.339%0.39215%0.151SC..Hα-helixtrans-64.3-35174.5-62.3172.5-158.5-140.21.7111.8D34 I38 F39 S40 D252D34-R36 PolarHBondContact O-N 3.44Å; D34-R36 WeakPolarHBondContact OD1-CB 3.48Å; D34-R36 VanDerWaalsContact OD1-CG 3.23Å; D34-R36 WeakPolarHBondContact OD1-CG 3.44Å; D34-R36 PolarHBondContact OD1-N 2.89Å; D34-R36 IonicContact OD1-NE 3.39Å; D34-R36 IonicContact OD2-NE 2.69Å; R36-I38 PolarHBondContact O-N 3.36Å; R36-F39 PolarHBondContact O-N 3.34Å; R36-F39 VanDerWaalsContact O-N 3.13Å; R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 PolarHBondContact O-OG 2.87Å; R36-D252 IonicContact NH1-OD2 2.76Å; R36-D252 IonicContact NH2-OD2 2.72Å
37N89.4Confident91Very high13 Ų1331.9 Ų31.97%0.0715%0.149CC..Hα-helixtrans-67.5-21.2-179.5-74.8-18.2000113.1H31 D34 P35 F39 S40 I41 Y42H31-N37 PolarHBondContact NE2-ND2 3.49Å; H31-N37 PolarHBondContact O-ND2 2.95Å; D34-N37 WeakPolarHBondContact O-CB 3.29Å; D34-N37 PolarHBondContact O-N 3.25Å; P35-N37 VanDerWaalsContact C-N 3.29Å; P35-N37 PolarHBondContact O-N 2.88Å; N37-F39 VanDerWaalsContact C-N 3.34Å; N37-S40 WeakPolarHBondContact CA-OG 3.3Å; N37-I41 HydrophobicContact CB-CD1 4.26Å; N37-I41 WeakPolarHBondContact O-CA 3.43Å; N37-I41 WeakPolarHBondContact O-CB 3.41Å; N37-I41 PolarHBondContact O-N 3.14Å; N37-Y42 HydrophobicContact CB-CD2 4.48Å; N37-Y42 HydrophobicContact CB-CE2 4.06Å; N37-Y42 WeakPolarHBondContact O-CD2 3.29Å; N37-Y42 PolarHBondContact O-N 3.29Å; N37-Y42 VanDerWaalsContact O-N 3.08Å
38I89.9Confident90.8Very high6 Ų630.4 Ų30.43%0.03114%0.141CC..Iπ-helixtrans-56.8-50.6169.9-59.1167.5000110.3P35 R36 F43 M57 A61 V122P35-I38 HydrophobicContact CB-CD1 4.22Å; P35-I38 VanDerWaalsContact O-CB 3.31Å; P35-I38 WeakPolarHBondContact O-CB 3.42Å; P35-I38 PolarHBondContact O-N 3.49Å; R36-I38 PolarHBondContact O-N 3.36Å; I38-F43 WeakPolarHBondContact O-CB 3.38Å; I38-F43 PolarHBondContact O-N 2.82Å; I38-M57 HydrophobicContact CG2-CG 4.21Å; I38-M57 HydrophobicContact CG2-SD 4.44Å; I38-A61 HydrophobicContact CD1-CB 4.25Å; I38-A61 HydrophobicContact CG2-CB 3.84Å; I38-V122 HydrophobicContact CB-CG2 4.38Å; I38-V122 HydrophobicContact CD1-CB 4.32Å; I38-V122 HydrophobicContact CD1-CG2 3.55Å; I38-V122 HydrophobicContact CG1-CB 4.24Å; I38-V122 HydrophobicContact CG1-CG1 4.38Å; I38-V122 HydrophobicContact CG1-CG2 3.77Å; I38-V122 HydrophobicContact CG2-CG1 4.39Å; I38-V122 HydrophobicContact CG2-CG2 3.71Å
39F89Confident90.5Very high11 Ų1129.4 Ų29.45%0.04814%0.14CC..Iπ-helixtrans-81-32.1-174.3-58.2-83.2000112.6P35 R36 N37 I58 A61 V62 A265 M331P35-F39 WeakPolarHBondContact O-CD2 3.48Å; R36-F39 PolarHBondContact O-N 3.34Å; R36-F39 VanDerWaalsContact O-N 3.13Å; N37-F39 VanDerWaalsContact C-N 3.34Å; F39-I58 HydrophobicContact CD1-CD1 3.53Å; F39-I58 HydrophobicContact CE1-CD1 3.67Å; F39-I58 HydrophobicContact CE1-CG2 4.44Å; F39-A61 HydrophobicContact CZ-CB 4.23Å; F39-V62 HydrophobicContact CE1-CG2 4.45Å; F39-V62 HydrophobicContact CZ-CG2 4.4Å; F39-A265 HydrophobicContact CD1-CB 3.97Å; F39-A265 HydrophobicContact CE1-CB 3.52Å; F39-A265 HydrophobicContact CZ-CB 4.28Å; F39-M331 HydrophobicContact CB-SD 4.2Å
40S88.4Confident90.3Very high3 Ų330.8 Ų30.82%0.02115%0.148CC..Iπ-helixtrans-90.7-26.9-174.961.70000114.7R36 N37 L301R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 PolarHBondContact O-OG 2.87Å; N37-S40 WeakPolarHBondContact CA-OG 3.3Å; S40-L301 WeakPolarHBondContact O-CD2 3.39Å
41I91.5Very high90.1Very high50 Ų5033.3 Ų33.326%0.25616%0.16SC..Iπ-helixtrans-123.7-61.7-173.3-58.6173000111.4N37 P44 L45N37-I41 HydrophobicContact CB-CD1 4.26Å; N37-I41 WeakPolarHBondContact O-CA 3.43Å; N37-I41 WeakPolarHBondContact O-CB 3.41Å; N37-I41 PolarHBondContact O-N 3.14Å; I41-P44 WeakPolarHBondContact O-CD 3.2Å; I41-L45 HydrophobicContact CG2-CD1 3.94Å; I41-L45 WeakPolarHBondContact O-CD1 3.38Å; I41-L45 VanDerWaalsContact O-CG 3.3Å; I41-L45 WeakPolarHBondContact O-CG 3.4Å; I41-L45 PolarHBondContact O-N 3.31Å
42Y92.8Very high90Very high35 Ų3531.4 Ų31.414%0.13716%0.155CC..Iπ-helixtrans-68.8-43.5-169.5-59.4-57.9000112.5N37 L45 W46 W123 M126N37-Y42 HydrophobicContact CB-CD2 4.48Å; N37-Y42 HydrophobicContact CB-CE2 4.06Å; N37-Y42 WeakPolarHBondContact O-CD2 3.29Å; N37-Y42 PolarHBondContact O-N 3.29Å; N37-Y42 VanDerWaalsContact O-N 3.08Å; Y42-L45 PolarHBondContact O-N 3.36Å; Y42-W46 PolarHBondContact O-N 2.91Å; Y42-W123 HydrophobicContact CE1-CZ2 4.11Å; Y42-M126 HydrophobicContact CD1-CE 4.22Å; Y42-M126 HydrophobicContact CD1-SD 4.08Å; Y42-M126 HydrophobicContact CE1-CE 4.45Å; Y42-M126 HydrophobicContact CG-SD 4.38Å
43F93.7Very high90Very high0 Ų031 Ų310%015%0.152CC..Hα-helixtrans-62.2-50.1179.7166.5-109.4000113.3I38 L45 W46 F47 G54 M57 I58 L269 P332 V335 V336I38-F43 WeakPolarHBondContact O-CB 3.38Å; I38-F43 PolarHBondContact O-N 2.82Å; F43-L45 VanDerWaalsContact C-N 3.28Å; F43-L45 PolarHBondContact O-N 2.89Å; F43-W46 PolarHBondContact O-N 3.47Å; F43-F47 HydrophobicContact CD2-CB 4.28Å; F43-F47 HydrophobicContact CE2-CB 4Å; F43-F47 AromaticContact CE2-CD2 3.8Å; F43-F47 HydrophobicContact CE2-CD2 3.8Å; F43-F47 HydrophobicContact CE2-CG 4.13Å; F43-F47 HydrophobicContact CZ-CB 4.36Å; F43-F47 HydrophobicContact CZ-CD2 4.12Å; F43-F47 HydrophobicContact CZ-CG 4.26Å; F43-F47 WeakPolarHBondContact O-CB 3.5Å; F43-F47 PolarHBondContact O-N 3.04Å; F43-G54 VanDerWaalsContact CD2-O 3.3Å; F43-G54 WeakPolarHBondContact CD2-O 3.19Å; F43-G54 WeakPolarHBondContact CE2-O 3.27Å; F43-M57 HydrophobicContact CB-SD 4.2Å; F43-I58 HydrophobicContact CB-CD1 3.91Å; F43-I58 HydrophobicContact CD1-CD1 4.03Å; F43-I58 HydrophobicContact CD1-CG1 4.46Å; F43-I58 HydrophobicContact CD2-CD1 3.58Å; F43-I58 HydrophobicContact CD2-CG1 3.36Å; F43-I58 HydrophobicContact CE1-CD1 4.44Å; F43-I58 HydrophobicContact CE2-CD1 4.02Å; F43-I58 HydrophobicContact CE2-CG1 3.41Å; F43-I58 VanDerWaalsContact CE2-CG1 3.41Å; F43-I58 HydrophobicContact CG-CD1 3.56Å; F43-I58 HydrophobicContact CG-CG1 3.9Å; F43-I58 HydrophobicContact CZ-CD1 4.43Å; F43-I58 HydrophobicContact CZ-CG1 4.01Å; F43-L269 HydrophobicContact CE2-CD1 4.27Å; F43-L269 HydrophobicContact CZ-CD1 4.05Å; F43-P332 HydrophobicContact CE1-CB 4.09Å; F43-P332 HydrophobicContact CZ-CB 4.24Å; F43-V335 HydrophobicContact CD1-CB 4.27Å; F43-V335 HydrophobicContact CD1-CG1 4.09Å; F43-V335 HydrophobicContact CD1-CG2 4.1Å; F43-V335 HydrophobicContact CE1-CB 3.57Å; F43-V335 HydrophobicContact CE1-CG1 3.56Å; F43-V335 HydrophobicContact CE1-CG2 3.83Å; F43-V335 HydrophobicContact CZ-CB 4.32Å; F43-V335 HydrophobicContact CZ-CG1 4.09Å; F43-V336 HydrophobicContact CE1-CG2 4.43Å; F43-V336 HydrophobicContact CZ-CG2 3.7Å
44P92.9Very high90.2Very high0 Ų031 Ų310%015%0.152CC..Hα-helixtrans-54.6-42174.8-26.532.4000113.7I41 Q48 L301 L304 V335I41-P44 WeakPolarHBondContact O-CD 3.2Å; P44-Q48 WeakPolarHBondContact O-CG 3.16Å; P44-Q48 PolarHBondContact O-N 3.41Å; P44-L301 HydrophobicContact CB-CD2 4.08Å; P44-L301 HydrophobicContact CB-CG 4.49Å; P44-L301 HydrophobicContact CG-CD2 4.27Å; P44-L304 HydrophobicContact CB-CD1 4.45Å; P44-L304 HydrophobicContact CG-CD1 3.37Å; P44-V335 HydrophobicContact CB-CG1 4.31Å; P44-V335 HydrophobicContact CB-CG2 4.34Å; P44-V335 HydrophobicContact CG-CG2 3.92Å
45L92.6Very high90.2Very high64 Ų6430 Ų3034%0.33515%0.147SC..Hα-helixtrans-64.7-53.5179.4-69.2166.8000111.1I41 Y42 F43 Q48 L49 T297 L301I41-L45 HydrophobicContact CG2-CD1 3.94Å; I41-L45 WeakPolarHBondContact O-CD1 3.38Å; I41-L45 VanDerWaalsContact O-CG 3.3Å; I41-L45 WeakPolarHBondContact O-CG 3.4Å; I41-L45 PolarHBondContact O-N 3.31Å; Y42-L45 PolarHBondContact O-N 3.36Å; F43-L45 VanDerWaalsContact C-N 3.28Å; F43-L45 PolarHBondContact O-N 2.89Å; L45-Q48 PolarHBondContact O-N 3.43Å; L45-L49 WeakPolarHBondContact O-CG 3.2Å; L45-L49 PolarHBondContact O-N 3.47Å; L45-T297 HydrophobicContact CD2-CG2 3.56Å; L45-L301 HydrophobicContact CD2-CD1 4.28Å
46W92.3Very high90.6Very high40 Ų4030.2 Ų30.215%0.15215%0.146CC..Hα-helixtrans-71.1-33.5-176.2-82.796.3000113.3Y42 F43 Q48 L49 N50 V53 M57 M126 A129 A130Y42-W46 PolarHBondContact O-N 2.91Å; F43-W46 PolarHBondContact O-N 3.47Å; W46-Q48 VanDerWaalsContact C-N 3.34Å; W46-Q48 PolarHBondContact O-N 2.98Å; W46-L49 PolarHBondContact O-N 3.18Å; W46-N50 CarbonylContact O-C 3.4Å; W46-N50 VanDerWaalsContact O-C 3.29Å; W46-N50 PolarHBondContact O-N 3.31Å; W46-V53 HydrophobicContact CB-CG1 4.47Å; W46-V53 HydrophobicContact CD2-CG1 4.08Å; W46-V53 HydrophobicContact CE3-CB 4.14Å; W46-V53 HydrophobicContact CE3-CG1 3.54Å; W46-V53 HydrophobicContact CG-CG1 4.49Å; W46-V53 HydrophobicContact CZ3-CG1 4.07Å; W46-M57 HydrophobicContact CB-CE 3.85Å; W46-M57 VanDerWaalsContact CD1-CE 3.47Å; W46-M57 HydrophobicContact CG-CE 3.67Å; W46-M126 HydrophobicContact CD2-CG 4.45Å; W46-M126 HydrophobicContact CZ2-CB 3.77Å; W46-M126 HydrophobicContact CZ2-CG 4.02Å; W46-M126 VanDerWaalsContact NE1-CG 3.27Å; W46-M126 PolarHBondContact NE1-SD 3.46Å; W46-A129 HydrophobicContact CH2-CB 4.13Å; W46-A129 HydrophobicContact CZ3-CB 3.87Å; W46-A130 HydrophobicContact CH2-CB 4.31Å
47F91.4Very high90.9Very high0 Ų025.2 Ų25.20%013%0.128CC..Hα-helixtrans-63.8-40.1177.9-170.6-94.6000112F43 N50 Q51 F278 V335 V336F43-F47 HydrophobicContact CD2-CB 4.28Å; F43-F47 HydrophobicContact CE2-CB 4Å; F43-F47 AromaticContact CE2-CD2 3.8Å; F43-F47 HydrophobicContact CE2-CD2 3.8Å; F43-F47 HydrophobicContact CE2-CG 4.13Å; F43-F47 HydrophobicContact CZ-CB 4.36Å; F43-F47 HydrophobicContact CZ-CD2 4.12Å; F43-F47 HydrophobicContact CZ-CG 4.26Å; F43-F47 WeakPolarHBondContact O-CB 3.5Å; F43-F47 PolarHBondContact O-N 3.04Å; F47-N50 CarbonylContact O-C 3.55Å; F47-Q51 HydrophobicContact CD1-CG 4.44Å; F47-Q51 HydrophobicContact CD2-CB 4.43Å; F47-Q51 HydrophobicContact CE1-CG 4Å; F47-Q51 HydrophobicContact CE2-CB 3.98Å; F47-Q51 HydrophobicContact CE2-CG 4.2Å; F47-Q51 HydrophobicContact CZ-CB 4.08Å; F47-Q51 HydrophobicContact CZ-CG 3.85Å; F47-Q51 WeakPolarHBondContact O-CA 3.13Å; F47-Q51 WeakPolarHBondContact O-CG 3.35Å; F47-Q51 PolarHBondContact O-N 2.91Å; F47-F278 HydrophobicContact CE1-CE2 4.3Å; F47-F278 HydrophobicContact CZ-CD2 4.45Å; F47-F278 AromaticContact CZ-CE2 3.8Å; F47-F278 HydrophobicContact CZ-CE2 3.8Å; F47-V335 HydrophobicContact CB-CG1 4.21Å; F47-V335 HydrophobicContact CD1-CG1 4.12Å; F47-V335 HydrophobicContact CG-CG1 4.34Å; F47-V336 HydrophobicContact CD1-CG2 4.32Å; F47-V336 HydrophobicContact CD2-CG2 4.22Å; F47-V336 HydrophobicContact CE1-CB 4.13Å; F47-V336 HydrophobicContact CE1-CG1 4.18Å; F47-V336 HydrophobicContact CE1-CG2 3.9Å; F47-V336 HydrophobicContact CE2-CG1 4.41Å; F47-V336 HydrophobicContact CE2-CG2 3.79Å; F47-V336 HydrophobicContact CG-CG2 4.48Å; F47-V336 HydrophobicContact CZ-CB 4.01Å; F47-V336 HydrophobicContact CZ-CG1 3.68Å; F47-V336 HydrophobicContact CZ-CG2 3.63Å
48Q89.3Confident91.1Very high9 Ų924.6 Ų24.64%0.04212%0.124CC..Hα-helixtrans-75.2-27.9177.6-61.5-58-28.500112.8P44 L45 W46 R293 C296 T297 V335P44-Q48 WeakPolarHBondContact O-CG 3.16Å; P44-Q48 PolarHBondContact O-N 3.41Å; L45-Q48 PolarHBondContact O-N 3.43Å; W46-Q48 VanDerWaalsContact C-N 3.34Å; W46-Q48 PolarHBondContact O-N 2.98Å; Q48-R293 WeakPolarHBondContact O-CD 2.93Å; Q48-C296 HydrophobicContact CG-CB 4.18Å; Q48-T297 VanDerWaalsContact CB-OG1 3.31Å; Q48-T297 WeakPolarHBondContact CB-OG1 3.37Å; Q48-T297 WeakPolarHBondContact CG-OG1 3.46Å; Q48-V335 PolarHBondContact NE2-O 3.33Å
49L88.8Confident91.3Very high101 Ų10124.9 Ų24.953%0.52913%0.125SC..Hα-helixtrans-72.5-51.2171.7-69.4173000111.4L45 W46 R293L45-L49 WeakPolarHBondContact O-CG 3.2Å; L45-L49 PolarHBondContact O-N 3.47Å; W46-L49 PolarHBondContact O-N 3.18Å; L49-R293 PolarHBondContact O-NH1 3.42Å
50N88.9Confident91.5Very high43 Ų4324.3 Ų24.323%0.2312%0.123CC..  trans-150.3108.7178.9-173-25.2000111.2W46 F47 V52 V53 G54 Y133W46-N50 CarbonylContact O-C 3.4Å; W46-N50 VanDerWaalsContact O-C 3.29Å; W46-N50 PolarHBondContact O-N 3.31Å; F47-N50 CarbonylContact O-C 3.55Å; N50-V52 PolarHBondContact O-N 3.42Å; N50-V52 VanDerWaalsContact O-N 3.16Å; N50-V52 VanDerWaalsContact OD1-CB 3.24Å; N50-V52 WeakPolarHBondContact OD1-CB 3.36Å; N50-V52 PolarHBondContact OD1-N 2.83Å; N50-V53 HydrophobicContact CB-CB 4.13Å; N50-V53 HydrophobicContact CB-CG2 3.94Å; N50-V53 PolarHBondContact O-N 3.19Å; N50-V53 VanDerWaalsContact O-N 3.08Å; N50-V53 PolarHBondContact OD1-N 3.11Å; N50-G54 PolarHBondContact O-N 2.95Å; N50-Y133 VanDerWaalsContact CB-OH 3.24Å; N50-Y133 WeakPolarHBondContact CB-OH 3.49Å; N50-Y133 PolarHBondContact ND2-OH 2.97Å
51Q89.1Confident91.8Very high55 Ų5524.5 Ų24.526%0.25712%0.124SC..Hα-helixtrans-57.7-32.4-179.1-64.9168.25.100112.7F47 T55F47-Q51 HydrophobicContact CD1-CG 4.44Å; F47-Q51 HydrophobicContact CD2-CB 4.43Å; F47-Q51 HydrophobicContact CE1-CG 4Å; F47-Q51 HydrophobicContact CE2-CB 3.98Å; F47-Q51 HydrophobicContact CE2-CG 4.2Å; F47-Q51 HydrophobicContact CZ-CB 4.08Å; F47-Q51 HydrophobicContact CZ-CG 3.85Å; F47-Q51 WeakPolarHBondContact O-CA 3.13Å; F47-Q51 WeakPolarHBondContact O-CG 3.35Å; F47-Q51 PolarHBondContact O-N 2.91Å; Q51-T55 VanDerWaalsContact O-CB 3.27Å; Q51-T55 WeakPolarHBondContact O-CB 3.22Å; Q51-T55 PolarHBondContact O-N 3.42Å; Q51-T55 PolarHBondContact O-OG1 2.99Å
52V88.8Confident91.9Very high59 Ų5922.1 Ų22.136%0.35811%0.112SC..Hα-helixtrans-66.9-47.5177.9178.10000110.6N50 T55 K56 Q200N50-V52 PolarHBondContact O-N 3.42Å; N50-V52 VanDerWaalsContact O-N 3.16Å; N50-V52 VanDerWaalsContact OD1-CB 3.24Å; N50-V52 WeakPolarHBondContact OD1-CB 3.36Å; N50-V52 PolarHBondContact OD1-N 2.83Å; V52-T55 PolarHBondContact O-N 3.23Å; V52-K56 WeakPolarHBondContact O-CB 3.48Å; V52-K56 PolarHBondContact O-N 3.49Å; V52-Q200 HydrophobicContact CG1-CB 4.36Å; V52-Q200 HydrophobicContact CG1-CG 3.69Å; V52-Q200 VanDerWaalsContact CG1-OE1 3.29Å
53V90.8Very high92Very high13 Ų1321.2 Ų21.28%0.07911%0.109CC..Hα-helixtrans-66-44.3178.6178.90000110.4W46 N50 T55 K56 M57 V125 A129W46-V53 HydrophobicContact CB-CG1 4.47Å; W46-V53 HydrophobicContact CD2-CG1 4.08Å; W46-V53 HydrophobicContact CE3-CB 4.14Å; W46-V53 HydrophobicContact CE3-CG1 3.54Å; W46-V53 HydrophobicContact CG-CG1 4.49Å; W46-V53 HydrophobicContact CZ3-CG1 4.07Å; N50-V53 HydrophobicContact CB-CB 4.13Å; N50-V53 HydrophobicContact CB-CG2 3.94Å; N50-V53 PolarHBondContact O-N 3.19Å; N50-V53 VanDerWaalsContact O-N 3.08Å; N50-V53 PolarHBondContact OD1-N 3.11Å; V53-T55 PolarHBondContact O-N 2.97Å; V53-K56 PolarHBondContact O-N 3.16Å; V53-M57 WeakPolarHBondContact O-CB 3.29Å; V53-M57 PolarHBondContact O-N 3.07Å; V53-V125 HydrophobicContact CG1-CG1 4.18Å; V53-A129 HydrophobicContact CB-CB 4.3Å; V53-A129 HydrophobicContact CG1-CB 3.59Å; V53-A129 HydrophobicContact CG2-CB 3.65Å
54G92.1Very high92Very high0 Ų021.4 Ų21.40%011%0.111CC..Hα-helixtrans-61.3-41.417600000112.9F43 N50 M57 I58F43-G54 VanDerWaalsContact CD2-O 3.3Å; F43-G54 WeakPolarHBondContact CD2-O 3.19Å; F43-G54 WeakPolarHBondContact CE2-O 3.27Å; N50-G54 PolarHBondContact O-N 2.95Å; G54-M57 WeakPolarHBondContact O-CB 3.22Å; G54-M57 PolarHBondContact O-N 3.12Å; G54-I58 PolarHBondContact O-N 3.37Å
55T91.8Very high92Very high9 Ų922.8 Ų22.86%0.05512%0.118CC..Hα-helixtrans-62.2-50175-59.50000110.6Q51 V52 V53 M57 I58 W59 L269 I273Q51-T55 VanDerWaalsContact O-CB 3.27Å; Q51-T55 WeakPolarHBondContact O-CB 3.22Å; Q51-T55 PolarHBondContact O-N 3.42Å; Q51-T55 PolarHBondContact O-OG1 2.99Å; V52-T55 PolarHBondContact O-N 3.23Å; V53-T55 PolarHBondContact O-N 2.97Å; T55-M57 VanDerWaalsContact C-N 3.27Å; T55-M57 PolarHBondContact O-N 2.69Å; T55-I58 PolarHBondContact O-N 3.46Å; T55-W59 PolarHBondContact O-N 3.48Å; T55-L269 HydrophobicContact CG2-CD2 4.15Å; T55-I273 HydrophobicContact CG2-CD1 3.54Å; T55-I273 VanDerWaalsContact OG1-CD1 3.28Å; T55-I273 WeakPolarHBondContact OG1-CD1 3.24Å
56K92.1Very high92.2Very high19 Ų1920.7 Ų20.78%0.08311%0.106CC..Hα-helixtrans-57.6-40.3177.4-177.2-179.4175.6-168.90111.9V52 V53 I58 W59 V60 V125 F193 E194V52-K56 WeakPolarHBondContact O-CB 3.48Å; V52-K56 PolarHBondContact O-N 3.49Å; V53-K56 PolarHBondContact O-N 3.16Å; K56-I58 VanDerWaalsContact C-N 3.35Å; K56-I58 PolarHBondContact O-N 3.4Å; K56-W59 WeakPolarHBondContact O-CB 3.34Å; K56-W59 PolarHBondContact O-N 3.49Å; K56-V60 HydrophobicContact CG-CG2 4.02Å; K56-V60 WeakPolarHBondContact O-CB 3.28Å; K56-V60 VanDerWaalsContact O-CG2 3.26Å; K56-V60 WeakPolarHBondContact O-CG2 3.43Å; K56-V60 PolarHBondContact O-N 3.26Å; K56-V125 HydrophobicContact CD-CG1 4.24Å; K56-V125 HydrophobicContact CG-CG1 4.4Å; K56-F193 WeakPolarHBondContact CE-O 3.32Å; K56-E194 IonicContact NZ-OE1 2.62Å; K56-E194 PolarHBondContact NZ-OE1 3.13Å; K56-E194 IonicContact NZ-OE2 2.83Å; K56-E194 PolarHBondContact NZ-OE2 3.39Å
57M93.1Very high92.3Very high0 Ų022.3 Ų22.30%011%0.114CC..Hα-helixtrans-56.8-45.1179-178.5177.9-66.600112.4I38 F43 W46 V53 G54 T55 A61 V122 M126I38-M57 HydrophobicContact CG2-CG 4.21Å; I38-M57 HydrophobicContact CG2-SD 4.44Å; F43-M57 HydrophobicContact CB-SD 4.2Å; W46-M57 HydrophobicContact CB-CE 3.85Å; W46-M57 VanDerWaalsContact CD1-CE 3.47Å; W46-M57 HydrophobicContact CG-CE 3.67Å; V53-M57 WeakPolarHBondContact O-CB 3.29Å; V53-M57 PolarHBondContact O-N 3.07Å; G54-M57 WeakPolarHBondContact O-CB 3.22Å; G54-M57 PolarHBondContact O-N 3.12Å; T55-M57 VanDerWaalsContact C-N 3.27Å; T55-M57 PolarHBondContact O-N 2.69Å; M57-A61 VanDerWaalsContact O-CB 3.23Å; M57-A61 WeakPolarHBondContact O-CB 3.48Å; M57-A61 PolarHBondContact O-N 2.68Å; M57-V122 HydrophobicContact CE-CG1 3.83Å; M57-V122 HydrophobicContact CG-CG1 3.82Å; M57-V122 HydrophobicContact CG-CG2 4.13Å; M57-V122 HydrophobicContact SD-CG1 3.74Å; M57-M126 HydrophobicContact CE-CG 3.57Å; M57-M126 HydrophobicContact CE-SD 4.04Å
58I94Very high92.5Very high0 Ų022.4 Ų22.40%012%0.115CC..Hα-helixtrans-67.4-42.8178-63.2-61.7000111.5F39 F43 G54 T55 K56 V60 A61 V62 L269F39-I58 HydrophobicContact CD1-CD1 3.53Å; F39-I58 HydrophobicContact CE1-CD1 3.67Å; F39-I58 HydrophobicContact CE1-CG2 4.44Å; F43-I58 HydrophobicContact CB-CD1 3.91Å; F43-I58 HydrophobicContact CD1-CD1 4.03Å; F43-I58 HydrophobicContact CD1-CG1 4.46Å; F43-I58 HydrophobicContact CD2-CD1 3.58Å; F43-I58 HydrophobicContact CD2-CG1 3.36Å; F43-I58 HydrophobicContact CE1-CD1 4.44Å; F43-I58 HydrophobicContact CE2-CD1 4.02Å; F43-I58 HydrophobicContact CE2-CG1 3.41Å; F43-I58 VanDerWaalsContact CE2-CG1 3.41Å; F43-I58 HydrophobicContact CG-CD1 3.56Å; F43-I58 HydrophobicContact CG-CG1 3.9Å; F43-I58 HydrophobicContact CZ-CD1 4.43Å; F43-I58 HydrophobicContact CZ-CG1 4.01Å; G54-I58 PolarHBondContact O-N 3.37Å; T55-I58 PolarHBondContact O-N 3.46Å; K56-I58 VanDerWaalsContact C-N 3.35Å; K56-I58 PolarHBondContact O-N 3.4Å; I58-V60 VanDerWaalsContact C-N 3.35Å; I58-V60 PolarHBondContact O-N 3.33Å; I58-A61 PolarHBondContact O-N 2.9Å; I58-V62 HydrophobicContact CG2-CG2 4.16Å; I58-V62 WeakPolarHBondContact O-CB 3.27Å; I58-V62 VanDerWaalsContact O-CG2 3.31Å; I58-V62 WeakPolarHBondContact O-CG2 3.43Å; I58-V62 PolarHBondContact O-N 3.39Å; I58-L269 HydrophobicContact CB-CD2 3.6Å; I58-L269 HydrophobicContact CG1-CD2 4.12Å; I58-L269 HydrophobicContact CG2-CB 4.34Å; I58-L269 HydrophobicContact CG2-CD2 3.61Å
59W93.5Very high92.7Very high11 Ų1122.5 Ų22.54%0.04212%0.115CC..Hα-helixtrans-57.4-50.4176.2-87.396.4000111.7T55 K56 A61 V62 I63 F193 I199 A202 Y207 I210 L266T55-W59 PolarHBondContact O-N 3.48Å; K56-W59 WeakPolarHBondContact O-CB 3.34Å; K56-W59 PolarHBondContact O-N 3.49Å; W59-A61 PolarHBondContact O-N 2.92Å; W59-V62 PolarHBondContact O-N 3.32Å; W59-I63 HydrophobicContact CE3-CG1 4.3Å; W59-I63 WeakPolarHBondContact O-CB 3.42Å; W59-I63 WeakPolarHBondContact O-CG1 3.32Å; W59-I63 PolarHBondContact O-N 2.94Å; W59-F193 HydrophobicContact CB-CD1 4.26Å; W59-F193 HydrophobicContact CB-CE1 4.03Å; W59-F193 HydrophobicContact CE3-CE1 4.28Å; W59-I199 HydrophobicContact CB-CG2 3.99Å; W59-I199 HydrophobicContact CD2-CG2 3.51Å; W59-I199 HydrophobicContact CE3-CG2 4.27Å; W59-I199 HydrophobicContact CG-CG2 3.33Å; W59-I199 HydrophobicContact CZ2-CG2 4.39Å; W59-A202 HydrophobicContact CZ2-CB 4.49Å; W59-Y207 AromaticContact CE2-CE1 3.46Å; W59-Y207 VanDerWaalsContact CE2-CE1 3.46Å; W59-Y207 AromaticContact CE2-CZ 3.79Å; W59-Y207 HydrophobicContact CH2-CD1 4.45Å; W59-Y207 AromaticContact CZ2-CD1 3.62Å; W59-Y207 HydrophobicContact CZ2-CD1 3.62Å; W59-Y207 HydrophobicContact CZ2-CD2 4.48Å; W59-Y207 AromaticContact CZ2-CE1 3.35Å; W59-Y207 HydrophobicContact CZ2-CE1 3.35Å; W59-Y207 HydrophobicContact CZ2-CE2 4.26Å; W59-Y207 HydrophobicContact CZ2-CG 4.18Å; W59-Y207 AromaticContact CZ2-CZ 3.7Å; W59-Y207 AromaticContact NE1-CE1 3.23Å; W59-Y207 AromaticContact NE1-CZ 3.31Å; W59-Y207 VanDerWaalsContact NE1-CZ 3.31Å; W59-Y207 PolarHBondContact NE1-OH 3.45Å; W59-I210 HydrophobicContact CH2-CB 4.16Å; W59-I210 HydrophobicContact CH2-CG1 3.99Å; W59-I210 HydrophobicContact CH2-CG2 4.18Å; W59-I210 HydrophobicContact CZ3-CB 4.35Å; W59-I210 HydrophobicContact CZ3-CG1 4.24Å; W59-I210 HydrophobicContact CZ3-CG2 3.88Å; W59-L266 HydrophobicContact CD2-CD1 3.77Å; W59-L266 HydrophobicContact CE3-CD1 4.04Å; W59-L266 HydrophobicContact CG-CD1 4.29Å; W59-L266 HydrophobicContact CH2-CD1 4.23Å; W59-L266 HydrophobicContact CH2-CD2 4.44Å; W59-L266 HydrophobicContact CZ2-CD1 3.97Å; W59-L266 HydrophobicContact CZ3-CD1 4.28Å; W59-L266 HydrophobicContact CZ3-CD2 4.31Å
60V93.8Very high92.9Very high0 Ų018.2 Ų18.20%09%0.093CC..Hα-helixtrans-63.5-41.5-179.8169.10000111.2K56 I58 G64 C121 V125 A190 F193K56-V60 HydrophobicContact CG-CG2 4.02Å; K56-V60 WeakPolarHBondContact O-CB 3.28Å; K56-V60 VanDerWaalsContact O-CG2 3.26Å; K56-V60 WeakPolarHBondContact O-CG2 3.43Å; K56-V60 PolarHBondContact O-N 3.26Å; I58-V60 VanDerWaalsContact C-N 3.35Å; I58-V60 PolarHBondContact O-N 3.33Å; V60-G64 WeakPolarHBondContact O-CA 3.21Å; V60-G64 PolarHBondContact O-N 2.73Å; V60-C121 HydrophobicContact CG1-CB 4.28Å; V60-C121 WeakPolarHBondContact CG1-SG 3.43Å; V60-C121 PolarHBondContact O-SG 3.27Å; V60-V125 HydrophobicContact CB-CG2 4.22Å; V60-V125 HydrophobicContact CG1-CG2 3.83Å; V60-V125 HydrophobicContact CG2-CG2 4.06Å; V60-A190 HydrophobicContact CG1-CB 4.14Å; V60-F193 HydrophobicContact CG2-CB 3.39Å; V60-F193 HydrophobicContact CG2-CD1 3.67Å; V60-F193 HydrophobicContact CG2-CD2 4.37Å; V60-F193 HydrophobicContact CG2-CG 3.56Å
61A94.1Very high93.1Very high6 Ų619.8 Ų19.85%0.0510%0.098CC..Hα-helixtrans-65.4-46.5176.100000112.8I38 F39 M57 I58 W59 D65 V122I38-A61 HydrophobicContact CD1-CB 4.25Å; I38-A61 HydrophobicContact CG2-CB 3.84Å; F39-A61 HydrophobicContact CZ-CB 4.23Å; M57-A61 VanDerWaalsContact O-CB 3.23Å; M57-A61 WeakPolarHBondContact O-CB 3.48Å; M57-A61 PolarHBondContact O-N 2.68Å; I58-A61 PolarHBondContact O-N 2.9Å; W59-A61 PolarHBondContact O-N 2.92Å; A61-D65 WeakPolarHBondContact O-CB 3.24Å; A61-D65 PolarHBondContact O-N 3.26Å; A61-V122 HydrophobicContact CB-CG2 4.07Å
62V94.6Very high93.3Very high0 Ų018.3 Ų18.30%09%0.091CC..Hα-helixtrans-65.7-47.7-179.3161.70000111.4F39 I58 W59 D65 W66 L214 N262 A265 L266F39-V62 HydrophobicContact CE1-CG2 4.45Å; F39-V62 HydrophobicContact CZ-CG2 4.4Å; I58-V62 HydrophobicContact CG2-CG2 4.16Å; I58-V62 WeakPolarHBondContact O-CB 3.27Å; I58-V62 VanDerWaalsContact O-CG2 3.31Å; I58-V62 WeakPolarHBondContact O-CG2 3.43Å; I58-V62 PolarHBondContact O-N 3.39Å; W59-V62 PolarHBondContact O-N 3.32Å; V62-D65 PolarHBondContact O-N 3.46Å; V62-W66 WeakPolarHBondContact O-CB 3.28Å; V62-W66 PolarHBondContact O-N 3.18Å; V62-L214 HydrophobicContact CG1-CD1 4.22Å; V62-N262 HydrophobicContact CB-CB 4.47Å; V62-N262 HydrophobicContact CG1-CB 4.05Å; V62-N262 HydrophobicContact CG2-CB 4.24Å; V62-N262 WeakPolarHBondContact CG2-O 3.4Å; V62-A265 HydrophobicContact CG2-CB 4.33Å; V62-L266 HydrophobicContact CG1-CB 4.11Å; V62-L266 HydrophobicContact CG1-CD2 4.07Å; V62-L266 HydrophobicContact CG2-CB 4.24Å
63I93.8Very high93.4Very high17 Ų1715.6 Ų15.69%0.0877%0.074CC..Hα-helixtrans-71.3-37.8-178.6-61.6-69.3000110.4W59 W66 F67 F193 L214W59-I63 HydrophobicContact CE3-CG1 4.3Å; W59-I63 WeakPolarHBondContact O-CB 3.42Å; W59-I63 WeakPolarHBondContact O-CG1 3.32Å; W59-I63 PolarHBondContact O-N 2.94Å; I63-W66 PolarHBondContact O-N 3.46Å; I63-F67 HydrophobicContact CG2-CD2 3.73Å; I63-F67 HydrophobicContact CG2-CE2 3.55Å; I63-F67 VanDerWaalsContact O-CD2 3.24Å; I63-F67 WeakPolarHBondContact O-CD2 3.12Å; I63-F67 PolarHBondContact O-N 2.83Å; I63-F193 HydrophobicContact CB-CE2 4.17Å; I63-F193 HydrophobicContact CB-CZ 3.77Å; I63-F193 HydrophobicContact CG1-CE1 4.25Å; I63-F193 HydrophobicContact CG1-CZ 3.69Å; I63-F193 HydrophobicContact CG2-CE2 3.78Å; I63-F193 HydrophobicContact CG2-CZ 3.71Å; I63-L214 HydrophobicContact CD1-CD1 3.78Å; I63-L214 HydrophobicContact CD1-CD2 3.9Å; I63-L214 HydrophobicContact CD1-CG 4.4Å
64G94.4Very high93.5Very high3 Ų319.2 Ų19.23%0.0319%0.092CC..Hα-helixtrans-60.1-48172.900000112.6V60 W66 F67 N68 M117V60-G64 WeakPolarHBondContact O-CA 3.21Å; V60-G64 PolarHBondContact O-N 2.73Å; G64-W66 VanDerWaalsContact C-N 3.32Å; G64-W66 PolarHBondContact O-N 3.16Å; G64-F67 PolarHBondContact O-N 3Å; G64-N68 PolarHBondContact O-N 3Å; G64-M117 WeakPolarHBondContact O-CE 3.4Å
65D93.8Very high93.5Very high30 Ų3023.1 Ų23.116%0.1611%0.112CC..Hα-helixtrans-70.1-29.7178.6-163.547.1000112A61 V62 N68 L69 R261 N262A61-D65 WeakPolarHBondContact O-CB 3.24Å; A61-D65 PolarHBondContact O-N 3.26Å; V62-D65 PolarHBondContact O-N 3.46Å; D65-N68 WeakPolarHBondContact O-CB 3.43Å; D65-N68 PolarHBondContact O-N 3.13Å; D65-L69 WeakPolarHBondContact O-CB 3.33Å; D65-L69 PolarHBondContact O-N 3.08Å; D65-R261 IonicContact OD2-NH2 3.55Å; D65-R261 PolarHBondContact OD2-NH2 2.99Å; D65-N262 WeakPolarHBondContact CB-ND2 3.38Å; D65-N262 PolarHBondContact OD2-ND2 3.12Å; D65-N262 PolarHBondContact OD2-OD1 2.91Å
66W95.3Very high93.4Very high19 Ų1925.7 Ų25.77%0.07212%0.123CC..Hα-helixtrans-65.9-43.5169.6-175.493.5000112.4V62 I63 G64 N68 L69 I70 L214 F217V62-W66 WeakPolarHBondContact O-CB 3.28Å; V62-W66 PolarHBondContact O-N 3.18Å; I63-W66 PolarHBondContact O-N 3.46Å; G64-W66 VanDerWaalsContact C-N 3.32Å; G64-W66 PolarHBondContact O-N 3.16Å; W66-N68 VanDerWaalsContact C-N 3.33Å; W66-N68 PolarHBondContact O-N 3.07Å; W66-L69 WeakPolarHBondContact O-CB 3.35Å; W66-L69 PolarHBondContact O-N 2.91Å; W66-I70 HydrophobicContact CD2-CG1 4.08Å; W66-I70 HydrophobicContact CE3-CG1 4.05Å; W66-I70 HydrophobicContact CH2-CG1 3.92Å; W66-I70 HydrophobicContact CZ2-CD1 4.19Å; W66-I70 HydrophobicContact CZ2-CG1 3.96Å; W66-I70 HydrophobicContact CZ3-CG1 3.96Å; W66-I70 WeakPolarHBondContact O-CG1 3.43Å; W66-I70 PolarHBondContact O-N 2.83Å; W66-L214 HydrophobicContact CD2-CD2 3.66Å; W66-L214 HydrophobicContact CE3-CD2 4.26Å; W66-L214 HydrophobicContact CG-CD2 3.77Å; W66-L214 HydrophobicContact CZ2-CD2 4.15Å; W66-L214 PolarHBondContact NE1-O 3.12Å; W66-F217 AromaticContact CH2-CD1 3.63Å; W66-F217 HydrophobicContact CH2-CD1 3.63Å; W66-F217 AromaticContact CH2-CE1 3.76Å; W66-F217 HydrophobicContact CH2-CE1 3.76Å; W66-F217 HydrophobicContact CH2-CG 4.15Å; W66-F217 HydrophobicContact CH2-CZ 4.39Å; W66-F217 HydrophobicContact CZ2-CB 4.02Å; W66-F217 AromaticContact CZ2-CD1 3.27Å; W66-F217 HydrophobicContact CZ2-CD1 3.27Å; W66-F217 AromaticContact CZ2-CE1 3.87Å; W66-F217 HydrophobicContact CZ2-CE1 3.87Å; W66-F217 AromaticContact CZ2-CG 3.76Å; W66-F217 HydrophobicContact CZ2-CG 3.76Å
67F95.1Very high93.3Very high75 Ų7525.2 Ų25.233%0.32912%0.123SC..Hα-helixtrans-64.2-39.1172.3-82.5-65000111.8I63 G64 L69 I70 F71 M117 V189I63-F67 HydrophobicContact CG2-CD2 3.73Å; I63-F67 HydrophobicContact CG2-CE2 3.55Å; I63-F67 VanDerWaalsContact O-CD2 3.24Å; I63-F67 WeakPolarHBondContact O-CD2 3.12Å; I63-F67 PolarHBondContact O-N 2.83Å; G64-F67 PolarHBondContact O-N 3Å; F67-L69 VanDerWaalsContact C-N 3.28Å; F67-L69 PolarHBondContact O-N 3.42Å; F67-I70 PolarHBondContact O-N 2.6Å; F67-F71 HydrophobicContact CB-CD2 4.45Å; F67-F71 HydrophobicContact CB-CE2 4.12Å; F67-F71 HydrophobicContact CD1-CE2 4.5Å; F67-F71 HydrophobicContact CD1-CZ 4.19Å; F67-F71 WeakPolarHBondContact O-CB 3.48Å; F67-F71 VanDerWaalsContact O-CD2 3.27Å; F67-F71 WeakPolarHBondContact O-CD2 3.25Å; F67-F71 VanDerWaalsContact O-CG 3.27Å; F67-F71 WeakPolarHBondContact O-CG 3.32Å; F67-F71 PolarHBondContact O-N 3.38Å; F67-M117 HydrophobicContact CB-CE 3.96Å; F67-V189 HydrophobicContact CD2-CG2 4.03Å
68N94.9Very high93.4Very high2 Ų227.9 Ų27.91%0.01114%0.135CC..Hα-helixtrans-56-45.4174.1-171.8-102.1000111.4G64 D65 W66 F71 K72 P112 M117G64-N68 PolarHBondContact O-N 3Å; D65-N68 WeakPolarHBondContact O-CB 3.43Å; D65-N68 PolarHBondContact O-N 3.13Å; W66-N68 VanDerWaalsContact C-N 3.33Å; W66-N68 PolarHBondContact O-N 3.07Å; N68-F71 PolarHBondContact O-N 3.07Å; N68-K72 WeakPolarHBondContact O-CB 3.25Å; N68-K72 VanDerWaalsContact O-CG 3.31Å; N68-K72 WeakPolarHBondContact O-CG 3.22Å; N68-K72 PolarHBondContact O-N 3.04Å; N68-K72 WeakPolarHBondContact OD1-CD 3.46Å; N68-K72 WeakPolarHBondContact OD1-CE 3.42Å; N68-K72 PolarHBondContact OD1-NZ 3.29Å; N68-P112 PolarHBondContact ND2-O 3.2Å; N68-M117 HydrophobicContact CB-SD 3.61Å
69L93.3Very high93.4Very high10 Ų1027.9 Ų27.95%0.05214%0.136CC..Hα-helixtrans-58.5-53176173.470.3000111.9D65 W66 F67 F71 K72 W73 P255 L259D65-L69 WeakPolarHBondContact O-CB 3.33Å; D65-L69 PolarHBondContact O-N 3.08Å; W66-L69 WeakPolarHBondContact O-CB 3.35Å; W66-L69 PolarHBondContact O-N 2.91Å; F67-L69 VanDerWaalsContact C-N 3.28Å; F67-L69 PolarHBondContact O-N 3.42Å; L69-F71 PolarHBondContact O-N 3.29Å; L69-K72 WeakPolarHBondContact O-CB 3.1Å; L69-K72 PolarHBondContact O-N 3.24Å; L69-W73 HydrophobicContact CD1-CD2 4.25Å; L69-W73 HydrophobicContact CD1-CH2 4.26Å; L69-W73 HydrophobicContact CD1-CZ2 3.77Å; L69-W73 HydrophobicContact CD2-CH2 4.16Å; L69-W73 HydrophobicContact CD2-CZ2 4.46Å; L69-W73 HydrophobicContact CD2-CZ3 4.35Å; L69-W73 HydrophobicContact CG-CD2 4.35Å; L69-W73 HydrophobicContact CG-CE3 4.29Å; L69-W73 HydrophobicContact CG-CH2 4.23Å; L69-W73 HydrophobicContact CG-CZ2 4.22Å; L69-W73 HydrophobicContact CG-CZ3 4.26Å; L69-W73 PolarHBondContact O-N 3.5Å; L69-W73 VanDerWaalsContact O-N 3.12Å; L69-P255 VanDerWaalsContact CD1-CA 3.47Å; L69-P255 HydrophobicContact CD1-CB 3.32Å; L69-P255 HydrophobicContact CD1-CG 4.37Å; L69-P255 WeakPolarHBondContact CD1-O 3.34Å; L69-L259 HydrophobicContact CD2-CB 3.91Å; L69-L259 HydrophobicContact CD2-CD1 4.07Å; L69-L259 HydrophobicContact CD2-CG 4.39Å
70I93.8Very high93.4Very high11 Ų1127.4 Ų27.46%0.05613%0.134CC..Hα-helixtrans-61.4-44.1-179.9-62.2-55.1000110.8W66 F67 K72 W73 I74 F217 F221W66-I70 HydrophobicContact CD2-CG1 4.08Å; W66-I70 HydrophobicContact CE3-CG1 4.05Å; W66-I70 HydrophobicContact CH2-CG1 3.92Å; W66-I70 HydrophobicContact CZ2-CD1 4.19Å; W66-I70 HydrophobicContact CZ2-CG1 3.96Å; W66-I70 HydrophobicContact CZ3-CG1 3.96Å; W66-I70 WeakPolarHBondContact O-CG1 3.43Å; W66-I70 PolarHBondContact O-N 2.83Å; F67-I70 PolarHBondContact O-N 2.6Å; I70-K72 PolarHBondContact O-N 2.77Å; I70-W73 HydrophobicContact CD1-CE3 3.87Å; I70-W73 HydrophobicContact CD1-CZ3 3.97Å; I70-W73 PolarHBondContact O-N 2.9Å; I70-I74 HydrophobicContact CG2-CD1 3.78Å; I70-I74 WeakPolarHBondContact O-CG1 3.41Å; I70-I74 PolarHBondContact O-N 3.32Å; I70-F217 HydrophobicContact CD1-CD1 4.12Å; I70-F217 HydrophobicContact CD1-CE1 4Å; I70-F217 HydrophobicContact CG1-CE1 4.41Å; I70-F221 HydrophobicContact CD1-CD1 4.26Å
71F94.2Very high93.3Very high77 Ų7727.5 Ų27.534%0.33813%0.134SC..Hα-helixtrans-65.8-36.6177.4-64.6-31.6000112.8F67 N68 L69 W73 I74 L75 P112F67-F71 HydrophobicContact CB-CD2 4.45Å; F67-F71 HydrophobicContact CB-CE2 4.12Å; F67-F71 HydrophobicContact CD1-CE2 4.5Å; F67-F71 HydrophobicContact CD1-CZ 4.19Å; F67-F71 WeakPolarHBondContact O-CB 3.48Å; F67-F71 VanDerWaalsContact O-CD2 3.27Å; F67-F71 WeakPolarHBondContact O-CD2 3.25Å; F67-F71 VanDerWaalsContact O-CG 3.27Å; F67-F71 WeakPolarHBondContact O-CG 3.32Å; F67-F71 PolarHBondContact O-N 3.38Å; N68-F71 PolarHBondContact O-N 3.07Å; L69-F71 PolarHBondContact O-N 3.29Å; F71-W73 VanDerWaalsContact C-N 3.27Å; F71-W73 PolarHBondContact O-N 3.4Å; F71-I74 PolarHBondContact O-N 3.45Å; F71-I74 VanDerWaalsContact O-N 3.14Å; F71-L75 HydrophobicContact CB-CD1 4.32Å; F71-L75 VanDerWaalsContact O-CB 3.29Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 VanDerWaalsContact O-CG 3.27Å; F71-L75 WeakPolarHBondContact O-CG 3.3Å; F71-L75 PolarHBondContact O-N 2.95Å; F71-P112 HydrophobicContact CB-CG 4.09Å; F71-P112 HydrophobicContact CD2-CG 4.33Å
72K92.8Very high93.2Very high23 Ų2327.2 Ų27.210%0.113%0.132CC..Hα-helixtrans-59.6-39.1173.1-83.4174.2174.31660112.8N68 L69 I70 F76 P109 S111 P112N68-K72 WeakPolarHBondContact O-CB 3.25Å; N68-K72 VanDerWaalsContact O-CG 3.31Å; N68-K72 WeakPolarHBondContact O-CG 3.22Å; N68-K72 PolarHBondContact O-N 3.04Å; N68-K72 WeakPolarHBondContact OD1-CD 3.46Å; N68-K72 WeakPolarHBondContact OD1-CE 3.42Å; N68-K72 PolarHBondContact OD1-NZ 3.29Å; L69-K72 WeakPolarHBondContact O-CB 3.1Å; L69-K72 PolarHBondContact O-N 3.24Å; I70-K72 PolarHBondContact O-N 2.77Å; K72-F76 PolarHBondContact O-N 3.43Å; K72-P109 HydrophobicContact CB-CB 4.05Å; K72-P109 HydrophobicContact CB-CG 4.19Å; K72-P109 WeakPolarHBondContact CD-O 3.49Å; K72-P109 WeakPolarHBondContact CE-O 3.43Å; K72-P109 HydrophobicContact CG-CB 4.26Å; K72-S111 WeakPolarHBondContact CA-O 3.33Å; K72-S111 VanDerWaalsContact CG-O 3.26Å; K72-S111 WeakPolarHBondContact CG-O 3.34Å; K72-P112 VanDerWaalsContact CE-O 3.27Å; K72-P112 WeakPolarHBondContact CE-O 3.4Å
73W90.9Very high93.2Very high2 Ų227.7 Ų27.71%0.00813%0.134CC..Hα-helixtrans-72.7-27.1175.6-70-20.1000113.7L69 I70 F71 F76 A218 F221 L232 P255 F256L69-W73 HydrophobicContact CD1-CD2 4.25Å; L69-W73 HydrophobicContact CD1-CH2 4.26Å; L69-W73 HydrophobicContact CD1-CZ2 3.77Å; L69-W73 HydrophobicContact CD2-CH2 4.16Å; L69-W73 HydrophobicContact CD2-CZ2 4.46Å; L69-W73 HydrophobicContact CD2-CZ3 4.35Å; L69-W73 HydrophobicContact CG-CD2 4.35Å; L69-W73 HydrophobicContact CG-CE3 4.29Å; L69-W73 HydrophobicContact CG-CH2 4.23Å; L69-W73 HydrophobicContact CG-CZ2 4.22Å; L69-W73 HydrophobicContact CG-CZ3 4.26Å; L69-W73 PolarHBondContact O-N 3.5Å; L69-W73 VanDerWaalsContact O-N 3.12Å; I70-W73 HydrophobicContact CD1-CE3 3.87Å; I70-W73 HydrophobicContact CD1-CZ3 3.97Å; I70-W73 PolarHBondContact O-N 2.9Å; F71-W73 VanDerWaalsContact C-N 3.27Å; F71-W73 PolarHBondContact O-N 3.4Å; W73-F76 WeakPolarHBondContact O-CE2 3.49Å; W73-F76 WeakPolarHBondContact O-CZ 3.45Å; W73-A218 HydrophobicContact CH2-CB 4.26Å; W73-A218 HydrophobicContact CZ3-CB 4.07Å; W73-A218 WeakPolarHBondContact CZ3-O 3.44Å; W73-F221 HydrophobicContact CB-CD1 4.48Å; W73-F221 HydrophobicContact CB-CE1 3.84Å; W73-F221 AromaticContact CE3-CD1 3.58Å; W73-F221 HydrophobicContact CE3-CD1 3.58Å; W73-F221 HydrophobicContact CE3-CE1 4.05Å; W73-F221 HydrophobicContact CZ3-CD1 4.12Å; W73-L232 HydrophobicContact CB-CD2 3.73Å; W73-L232 HydrophobicContact CD2-CD1 4.24Å; W73-L232 HydrophobicContact CD2-CD2 4.47Å; W73-L232 HydrophobicContact CG-CD1 4.31Å; W73-L232 HydrophobicContact CG-CD2 3.71Å; W73-P255 HydrophobicContact CZ2-CB 3.88Å; W73-F256 HydrophobicContact CH2-CE1 4.42Å; W73-F256 HydrophobicContact CH2-CZ 4.39Å; W73-F256 HydrophobicContact CZ2-CE2 4.33Å; W73-F256 HydrophobicContact CZ2-CZ 4.21Å
74I91.9Very high93Very high89 Ų8927 Ų2746%0.45613%0.13SC..Hα-helixtrans-83.3-39.8176.9-67.9167.1000111.7I70 F71 F76 F221I70-I74 HydrophobicContact CG2-CD1 3.78Å; I70-I74 WeakPolarHBondContact O-CG1 3.41Å; I70-I74 PolarHBondContact O-N 3.32Å; F71-I74 PolarHBondContact O-N 3.45Å; F71-I74 VanDerWaalsContact O-N 3.14Å; I74-F76 WeakPolarHBondContact O-CD2 3.23Å; I74-F221 HydrophobicContact CD1-CZ 4.16Å; I74-F221 HydrophobicContact CG1-CE1 4.2Å; I74-F221 HydrophobicContact CG1-CZ 3.65Å
75L92Very high92.8Very high82 Ų8230.8 Ų30.843%0.42915%0.147SC..Hα-helixtrans-89.1-14.3-167.8-65.2175.9000114.4F71 G77 L181F71-L75 HydrophobicContact CB-CD1 4.32Å; F71-L75 VanDerWaalsContact O-CB 3.29Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 VanDerWaalsContact O-CG 3.27Å; F71-L75 WeakPolarHBondContact O-CG 3.3Å; F71-L75 PolarHBondContact O-N 2.95Å; L75-G77 PolarHBondContact O-N 3.25Å; L75-L181 HydrophobicContact CD1-CD2 3.95Å
76F89.6Confident92.5Very high64 Ų6432 Ų3228%0.28115%0.152SC..  trans4640.1179.4-68.2-91.4000113.7K72 W73 I74 H78 I230 L232 W234K72-F76 PolarHBondContact O-N 3.43Å; W73-F76 WeakPolarHBondContact O-CE2 3.49Å; W73-F76 WeakPolarHBondContact O-CZ 3.45Å; I74-F76 WeakPolarHBondContact O-CD2 3.23Å; F76-H78 PolarHBondContact O-N 3.11Å; F76-I230 HydrophobicContact CE1-CG2 3.54Å; F76-I230 HydrophobicContact CE2-CG2 4.12Å; F76-I230 HydrophobicContact CZ-CG2 3.17Å; F76-L232 HydrophobicContact CE1-CD2 4.24Å; F76-L232 HydrophobicContact CZ-CD2 3.94Å; F76-W234 HydrophobicContact CB-CZ2 4.27Å; F76-W234 AromaticContact CD1-CD1 3.76Å; F76-W234 AromaticContact CD1-CE2 3.92Å; F76-W234 HydrophobicContact CD1-CZ2 4.47Å; F76-W234 AromaticContact CD1-NE1 3.29Å; F76-W234 VanDerWaalsContact CD1-NE1 3.29Å; F76-W234 AromaticContact CE1-CD1 3.86Å; F76-W234 AromaticContact CE1-NE1 3.77Å; F76-W234 WeakPolarHBondContact O-CZ2 3.27Å
77G91.6Very high92Very high8 Ų832.1 Ų32.18%0.08215%0.154CC..PPolyproline II helixtrans-67.3125.5-173.800000112.7L75 G110L75-G77 PolarHBondContact O-N 3.25Å; G77-G110 PolarHBondContact O-N 3.42Å
78H93.5Very high91.4Very high56 Ų5636.5 Ų36.526%0.25918%0.178SC..PPolyproline II helixtrans-71.2158.8168.4-73.8-105.3000111.7F76 W82 W83 Q178 W234F76-H78 PolarHBondContact O-N 3.11Å; H78-W82 AromaticContact CG-NE1 3.78Å; H78-W82 AromaticContact ND1-CD1 3.71Å; H78-W82 AromaticContact ND1-NE1 3.36Å; H78-W82 PolarHBondContact ND1-NE1 3.18Å; H78-W83 HydrophobicContact CB-CB 4.03Å; H78-W83 HydrophobicContact CB-CG 4.24Å; H78-W83 AromaticContact CG-CD1 3.91Å; H78-Q178 PolarHBondContact O-NE2 3.02Å; H78-W234 AromaticContact CD2-CH2 3.97Å; H78-W234 AromaticContact CE1-CZ3 3.76Å; H78-W234 AromaticContact ND1-CZ3 3.94Å
79R94.4Very high90.9Very high1 Ų139.8 Ų39.80%0.00420%0.195CC..PPolyproline II helixtrans-103149.7169.8-65.6-176.9-171.3-101.78.8110.6Y81 W82 W83 E106 G108 P109 T173 H174R79-Y81 HydrophobicContact CB-CD1 3.94Å; R79-Y81 HydrophobicContact CB-CE1 3.91Å; R79-Y81 HydrophobicContact CG-CE1 4.49Å; R79-Y81 PolarHBondContact O-N 3.42Å; R79-W82 HydrophobicContact CB-CD2 3.86Å; R79-W82 HydrophobicContact CB-CE3 4.04Å; R79-W82 HydrophobicContact CB-CH2 3.79Å; R79-W82 HydrophobicContact CB-CZ2 3.6Å; R79-W82 HydrophobicContact CB-CZ3 4.01Å; R79-W82 VanDerWaalsContact CD-CZ3 3.46Å; R79-W82 HydrophobicContact CG-CE3 4.47Å; R79-W82 HydrophobicContact CG-CH2 3.37Å; R79-W82 HydrophobicContact CG-CZ2 3.44Å; R79-W82 VanDerWaalsContact CG-CZ2 3.44Å; R79-W82 HydrophobicContact CG-CZ3 3.93Å; R79-W82 VanDerWaalsContact N-CZ2 3.31Å; R79-W82 VanDerWaalsContact N-NE1 3.13Å; R79-W82 PolarHBondContact O-N 2.66Å; R79-W83 WeakPolarHBondContact O-CB 3.5Å; R79-W83 PolarHBondContact O-N 2.97Å; R79-E106 IonicContact CZ-OE2 3.68Å; R79-E106 IonicContact NH1-OE2 3.94Å; R79-E106 PolarHBondContact NH1-OE2 3.45Å; R79-E106 IonicContact NH2-OE2 3.88Å; R79-E106 PolarHBondContact NH2-OE2 3.37Å; R79-G108 PolarHBondContact NE-O 3.35Å; R79-G108 PolarHBondContact NH2-O 3.34Å; R79-P109 PolarHBondContact NH2-O 3.32Å; R79-T173 WeakPolarHBondContact CG-O 3.45Å; R79-T173 PolarHBondContact NH1-O 2.83Å; R79-H174 PolarHBondContact NH1-CE1 2.9Å; R79-H174 PolarHBondContact NH1-NE2 3.42Å
80P94.2Very high90Very high0 Ų040.9 Ų40.90%020%0.198CC..Hα-helixtrans-54.7-47.7-176.6-23.729.9000114.2I12 W82 W83 V84 L98 A172 F175I12-P80 HydrophobicContact CD1-CB 3.4Å; I12-P80 HydrophobicContact CD1-CG 3.46Å; I12-P80 VanDerWaalsContact CD1-CG 3.46Å; P80-W82 VanDerWaalsContact C-N 3.33Å; P80-W82 PolarHBondContact O-N 2.87Å; P80-W83 PolarHBondContact O-N 3.28Å; P80-V84 PolarHBondContact O-N 3Å; P80-V84 VanDerWaalsContact O-N 3.14Å; P80-L98 HydrophobicContact CB-CD1 3.86Å; P80-A172 HydrophobicContact CB-CB 4.42Å; P80-A172 WeakPolarHBondContact CD-O 3.49Å; P80-A172 WeakPolarHBondContact CG-O 2.83Å; P80-F175 HydrophobicContact CB-CD1 4.38Å; P80-F175 HydrophobicContact CB-CE1 3.93Å; P80-F175 HydrophobicContact CB-CE2 4.5Å; P80-F175 HydrophobicContact CB-CZ 4.01Å; P80-F175 HydrophobicContact CG-CD1 3.84Å; P80-F175 HydrophobicContact CG-CD2 4.06Å; P80-F175 HydrophobicContact CG-CE1 3.86Å; P80-F175 HydrophobicContact CG-CE2 4.08Å; P80-F175 HydrophobicContact CG-CG 3.96Å; P80-F175 HydrophobicContact CG-CZ 3.99Å
81Y91.4Very high88.2Confident2 Ų245.2 Ų45.21%0.00823%0.227CC..Hα-helixtrans-63.6-31.4-171.476.4-93.5000114.6R79 T104 E106 A239 W242R79-Y81 HydrophobicContact CB-CD1 3.94Å; R79-Y81 HydrophobicContact CB-CE1 3.91Å; R79-Y81 HydrophobicContact CG-CE1 4.49Å; R79-Y81 PolarHBondContact O-N 3.42Å; Y81-T104 HydrophobicContact CD1-CG2 3.84Å; Y81-T104 HydrophobicContact CE1-CG2 4.39Å; Y81-T104 HydrophobicContact CG-CG2 4.07Å; Y81-E106 PolarHBondContact OH-O 3.42Å; Y81-A239 WeakPolarHBondContact OH-CA 3.27Å; Y81-A239 WeakPolarHBondContact OH-CB 3.29Å; Y81-W242 HydrophobicContact CD2-CB 4.33Å; Y81-W242 HydrophobicContact CE2-CB 4.33Å
82W92Very high86.4Confident0 Ų049.3 Ų49.30%025%0.252CS..Hα-helixtrans-94.3-31173.165.964.7000112.6H78 R79 P80 V84 Q85 E86 K238 A239 W242H78-W82 AromaticContact CG-NE1 3.78Å; H78-W82 AromaticContact ND1-CD1 3.71Å; H78-W82 AromaticContact ND1-NE1 3.36Å; H78-W82 PolarHBondContact ND1-NE1 3.18Å; R79-W82 HydrophobicContact CB-CD2 3.86Å; R79-W82 HydrophobicContact CB-CE3 4.04Å; R79-W82 HydrophobicContact CB-CH2 3.79Å; R79-W82 HydrophobicContact CB-CZ2 3.6Å; R79-W82 HydrophobicContact CB-CZ3 4.01Å; R79-W82 VanDerWaalsContact CD-CZ3 3.46Å; R79-W82 HydrophobicContact CG-CE3 4.47Å; R79-W82 HydrophobicContact CG-CH2 3.37Å; R79-W82 HydrophobicContact CG-CZ2 3.44Å; R79-W82 VanDerWaalsContact CG-CZ2 3.44Å; R79-W82 HydrophobicContact CG-CZ3 3.93Å; R79-W82 VanDerWaalsContact N-CZ2 3.31Å; R79-W82 VanDerWaalsContact N-NE1 3.13Å; R79-W82 PolarHBondContact O-N 2.66Å; P80-W82 VanDerWaalsContact C-N 3.33Å; P80-W82 PolarHBondContact O-N 2.87Å; W82-V84 VanDerWaalsContact C-N 3.29Å; W82-V84 PolarHBondContact O-N 3.49Å; W82-Q85 PolarHBondContact O-N 3.32Å; W82-Q85 VanDerWaalsContact O-N 3.16Å; W82-E86 PolarHBondContact O-N 3.4Å; W82-K238 HydrophobicContact CD2-CB 4.12Å; W82-K238 HydrophobicContact CE3-CB 4.26Å; W82-K238 HydrophobicContact CG-CB 4.23Å; W82-A239 HydrophobicContact CE3-CB 4.41Å; W82-A239 HydrophobicContact CZ3-CB 3.98Å; W82-W242 HydrophobicContact CB-CB 3.85Å; W82-W242 HydrophobicContact CB-CG 3.91Å
83W93.4Very high84.7Confident11 Ų1155.2 Ų55.24%0.04228%0.28CS..Hα-helixtrans-62.3-40.6-177.3179.681000111.4H5 V9 H78 R79 P80 Q85 E86 T87 I89 Y90 F175H5-W83 HydrophobicContact CB-CD2 3.79Å; H5-W83 VanDerWaalsContact CB-CE2 3.49Å; H5-W83 HydrophobicContact CB-CE3 3.9Å; H5-W83 HydrophobicContact CB-CH2 3.44Å; H5-W83 VanDerWaalsContact CB-CH2 3.44Å; H5-W83 HydrophobicContact CB-CZ2 3.33Å; H5-W83 HydrophobicContact CB-CZ3 3.73Å; H5-W83 AromaticContact CG-CE2 3.84Å; H5-W83 AromaticContact ND1-CD1 3.56Å; H5-W83 AromaticContact ND1-CD2 3.9Å; H5-W83 AromaticContact ND1-CE2 3.4Å; H5-W83 AromaticContact ND1-CZ2 3.94Å; H5-W83 AromaticContact ND1-NE1 3.15Å; H5-W83 PolarHBondContact ND1-NE1 3.33Å; H5-W83 VanDerWaalsContact ND1-NE1 3.15Å; V9-W83 HydrophobicContact CG2-CE3 3.88Å; V9-W83 HydrophobicContact CG2-CZ3 3.7Å; H78-W83 HydrophobicContact CB-CB 4.03Å; H78-W83 HydrophobicContact CB-CG 4.24Å; H78-W83 AromaticContact CG-CD1 3.91Å; R79-W83 WeakPolarHBondContact O-CB 3.5Å; R79-W83 PolarHBondContact O-N 2.97Å; P80-W83 PolarHBondContact O-N 3.28Å; W83-Q85 PolarHBondContact O-N 3.31Å; W83-E86 PolarHBondContact O-N 2.81Å; W83-T87 HydrophobicContact CE3-CG2 4.41Å; W83-T87 HydrophobicContact CH2-CG2 4.16Å; W83-T87 HydrophobicContact CZ2-CG2 4.32Å; W83-T87 HydrophobicContact CZ3-CG2 4.2Å; W83-T87 WeakPolarHBondContact O-CB 3.44Å; W83-T87 WeakPolarHBondContact O-CG2 3.33Å; W83-T87 PolarHBondContact O-N 3.4Å; W83-I89 HydrophobicContact CH2-CD1 3.87Å; W83-I89 HydrophobicContact CZ2-CD1 3.74Å; W83-Y90 HydrophobicContact CZ3-CE2 4.35Å; W83-F175 HydrophobicContact CB-CE2 4.43Å; W83-F175 HydrophobicContact CB-CZ 4.18Å; W83-F175 HydrophobicContact CD2-CZ 4.08Å; W83-F175 AromaticContact CE3-CZ 3.96Å; W83-F175 HydrophobicContact CE3-CZ 3.96Å; W83-F175 HydrophobicContact CG-CZ 4.18Å
84V91.3Very high83.7Confident1 Ų160.8 Ų60.81%0.00632%0.32CS..Hα-helixtrans-62.5-24.3179.372.90000113.4V9 P80 W82 Y90 P96 L98V9-V84 HydrophobicContact CG1-CG2 4.45Å; P80-V84 PolarHBondContact O-N 3Å; P80-V84 VanDerWaalsContact O-N 3.14Å; W82-V84 VanDerWaalsContact C-N 3.29Å; W82-V84 PolarHBondContact O-N 3.49Å; V84-Y90 HydrophobicContact CG2-CE2 4.35Å; V84-P96 HydrophobicContact CG2-CB 3.81Å; V84-P96 HydrophobicContact CG2-CG 3.89Å; V84-P96 VanDerWaalsContact CG2-O 3.27Å; V84-P96 WeakPolarHBondContact CG2-O 2.99Å; V84-L98 HydrophobicContact CB-CD1 4.36Å; V84-L98 HydrophobicContact CG1-CD1 4.08Å; V84-L98 HydrophobicContact CG1-CG 4.42Å
85Q88.6Confident82.8Confident84 Ų8459 Ų5939%0.39332%0.315SS..Hα-helixtrans-89.5-24.4-179.9-58.4-63.9-23.800113.1W82 W83 W242W82-Q85 PolarHBondContact O-N 3.32Å; W82-Q85 VanDerWaalsContact O-N 3.16Å; W83-Q85 PolarHBondContact O-N 3.31Å; Q85-W242 HydrophobicContact CB-CD2 3.72Å; Q85-W242 HydrophobicContact CB-CE3 3.6Å; Q85-W242 HydrophobicContact CB-CG 4.49Å; Q85-W242 HydrophobicContact CB-CH2 3.65Å; Q85-W242 HydrophobicContact CB-CZ2 3.78Å; Q85-W242 HydrophobicContact CB-CZ3 3.57Å; Q85-W242 HydrophobicContact CG-CD2 4.04Å; Q85-W242 HydrophobicContact CG-CE3 3.64Å; Q85-W242 HydrophobicContact CG-CH2 4.46Å; Q85-W242 HydrophobicContact CG-CZ3 3.88Å
86E87.9Confident82.3Confident55 Ų5555.9 Ų55.926%0.25730%0.3SS..Hα-helixtrans-101.6-15.6-175.6-66-174.3148.700113.5W82 W83 K238 W242W82-E86 PolarHBondContact O-N 3.4Å; W83-E86 PolarHBondContact O-N 2.81Å; E86-K238 IonicContact OE1-NZ 2.79Å; E86-K238 PolarHBondContact OE1-NZ 3.04Å; E86-K238 WeakPolarHBondContact OE2-CD 3.3Å; E86-K238 WeakPolarHBondContact OE2-CE 3.26Å; E86-K238 IonicContact OE2-NZ 3.94Å; E86-K238 PolarHBondContact OE2-NZ 3.46Å; E86-W242 HydrophobicContact CG-CZ2 4.02Å; E86-W242 PolarHBondContact OE1-NE1 2.96Å; E86-W242 VanDerWaalsContact OE1-NE1 3.15Å
87T86.1Confident82.1Confident21 Ų2157.8 Ų57.813%0.12932%0.32CS..  trans-73.4136.5-177.8-172.20000112W83 I89 Y90W83-T87 HydrophobicContact CE3-CG2 4.41Å; W83-T87 HydrophobicContact CH2-CG2 4.16Å; W83-T87 HydrophobicContact CZ2-CG2 4.32Å; W83-T87 HydrophobicContact CZ3-CG2 4.2Å; W83-T87 WeakPolarHBondContact O-CB 3.44Å; W83-T87 WeakPolarHBondContact O-CG2 3.33Å; W83-T87 PolarHBondContact O-N 3.4Å; T87-I89 HydrophobicContact CG2-CB 4.49Å; T87-I89 PolarHBondContact O-N 3.47Å; T87-I89 WeakPolarHBondContact OG1-CD1 3.12Å; T87-I89 WeakPolarHBondContact OG1-CG1 3.46Å; T87-I89 PolarHBondContact OG1-N 3.23Å; T87-Y90 HydrophobicContact CG2-CD2 3.53Å; T87-Y90 HydrophobicContact CG2-CE2 3.72Å
88M82.5Confident82Confident167 Ų16758 Ų5882%0.82332%0.319SS*.THydrogen-bonded Turntrans-84.17.2176.7-60.9-64.3-177.300112.9Y90 P91M88-Y90 VanDerWaalsContact C-N 3.34Å; M88-P91 VanDerWaalsContact O-CD 3.26Å; M88-P91 WeakPolarHBondContact O-CD 3.27Å
89I82.4Confident81.9Confident71 Ų7158.2 Ų58.236%0.36432%0.32SS..THydrogen-bonded Turntrans-77.6-21.4-176.1-59.5163.7000112D2 W83 T87 P91D2-I89 HydrophobicContact CB-CD1 3.48Å; D2-I89 VanDerWaalsContact CB-CD1 3.48Å; W83-I89 HydrophobicContact CH2-CD1 3.87Å; W83-I89 HydrophobicContact CZ2-CD1 3.74Å; T87-I89 HydrophobicContact CG2-CB 4.49Å; T87-I89 PolarHBondContact O-N 3.47Å; T87-I89 WeakPolarHBondContact OG1-CD1 3.12Å; T87-I89 WeakPolarHBondContact OG1-CG1 3.46Å; T87-I89 PolarHBondContact OG1-N 3.23Å; I89-P91 WeakPolarHBondContact O-CD 3.45Å
90Y75Confident81.8Confident34 Ų3460.2 Ų60.213%0.13333%0.33CS..  trans-109.648.2178.9-53.1-68.6000113.5W83 V84 T87 M88 N92 P96W83-Y90 HydrophobicContact CZ3-CE2 4.35Å; V84-Y90 HydrophobicContact CG2-CE2 4.35Å; T87-Y90 HydrophobicContact CG2-CD2 3.53Å; T87-Y90 HydrophobicContact CG2-CE2 3.72Å; M88-Y90 VanDerWaalsContact C-N 3.34Å; Y90-N92 PolarHBondContact O-N 3.23Å; Y90-P96 HydrophobicContact CD1-CG 4.38Å; Y90-P96 HydrophobicContact CD2-CG 4.28Å; Y90-P96 HydrophobicContact CE1-CG 3.94Å; Y90-P96 HydrophobicContact CE2-CG 3.85Å
91P56.2Low81.7Confident101 Ų10160.8 Ų60.866%0.65633%0.332SS*.SBendtrans-73.1-13.4-170.629.8-30.2000113.3M88 I89M88-P91 VanDerWaalsContact O-CD 3.26Å; M88-P91 WeakPolarHBondContact O-CD 3.27Å; I89-P91 WeakPolarHBondContact O-CD 3.45Å
92N56.2Low81.5Confident163 Ų16364.2 Ų64.287%0.87236%0.355SS*.SBendtrans-132.54.6-176.9-72.1-25.6000114.6Y90Y90-N92 PolarHBondContact O-N 3.23Å
93Q58.3Low81.4Confident147 Ų14767.2 Ų67.269%0.68737%0.37SS*.SBendtrans-117.3141.7172.4-72.4177.7-8.100107S95Q93-S95 PolarHBondContact O-N 3.47Å
94S68.7Low81.2Confident120 Ų12066.7 Ų66.784%0.83937%0.368SS*.PPolyproline II helixtrans-52.1119.517134.10000108.5
95S73Confident81.1Confident51 Ų5166.6 Ų66.636%0.35737%0.368SS..PPolyproline II helixtrans-50.2135.8-177.5-54.30000109.5Q93 C97Q93-S95 PolarHBondContact O-N 3.47Å; S95-C97 PolarHBondContact O-N 3.13Å
96P82Confident81.1Confident16 Ų1663.1 Ų63.110%0.10435%0.351CS..PPolyproline II helixtrans-51.6119.8-178-24.929.6000111V9 V84 Y90 L98V9-P96 HydrophobicContact CG1-CB 3.58Å; V9-P96 HydrophobicContact CG1-CG 3.91Å; V84-P96 HydrophobicContact CG2-CB 3.81Å; V84-P96 HydrophobicContact CG2-CG 3.89Å; V84-P96 VanDerWaalsContact CG2-O 3.27Å; V84-P96 WeakPolarHBondContact CG2-O 2.99Å; Y90-P96 HydrophobicContact CD1-CG 4.38Å; Y90-P96 HydrophobicContact CD2-CG 4.28Å; Y90-P96 HydrophobicContact CE1-CG 3.94Å; Y90-P96 HydrophobicContact CE2-CG 3.85Å; P96-L98 PolarHBondContact O-N 3.4Å
97C84.7Confident81Confident104 Ų10460.6 Ų60.670%0.70334%0.339SS*.PPolyproline II helixtrans-75.7124.5176.9-169.10000108.8S95S95-C97 PolarHBondContact O-N 3.13Å
98L91Very high81Confident14 Ų1459.6 Ų59.67%0.07333%0.334CS..  trans-112.2128.2174.2-60.4-179.7000108.5V9 I12 Q13 P80 V84 P96 A172V9-L98 HydrophobicContact CG1-CD2 4.19Å; I12-L98 HydrophobicContact CB-CD2 4.15Å; I12-L98 HydrophobicContact CG2-CD2 3.76Å; Q13-L98 HydrophobicContact CG-CD2 3.7Å; P80-L98 HydrophobicContact CB-CD1 3.86Å; V84-L98 HydrophobicContact CB-CD1 4.36Å; V84-L98 HydrophobicContact CG1-CD1 4.08Å; V84-L98 HydrophobicContact CG1-CG 4.42Å; P96-L98 PolarHBondContact O-N 3.4Å; L98-A172 HydrophobicContact CB-CB 4.17Å; L98-A172 HydrophobicContact CD1-CB 4.32Å
99E91.5Very high81.5Confident59 Ų5951.7 Ų51.728%0.27630%0.295SS..  trans-67.3136.1175.8-60.7-170.9176.300109.9Q16 R20 F101Q16-E99 PolarHBondContact NE2-O 3.29Å; R20-E99 IonicContact CZ-OE1 3.4Å; R20-E99 IonicContact CZ-OE2 3.9Å; R20-E99 IonicContact NH1-OE1 2.76Å; R20-E99 PolarHBondContact NH1-OE1 2.98Å; R20-E99 IonicContact NH1-OE2 3.95Å; R20-E99 IonicContact NH2-OE1 3.69Å; R20-E99 IonicContact NH2-OE2 3.99Å; E99-F101 HydrophobicContact CB-CE2 4.09Å; E99-F101 HydrophobicContact CB-CZ 4.09Å
100Q91.7Very high81.9Confident43 Ų4348.3 Ų48.320%0.20128%0.277CS..  trans-109.6143.4174.9-60.6-170.827.900110T104 C105 W242 A244 W248Q100-T104 HydrophobicContact CB-CG2 4.18Å; Q100-T104 HydrophobicContact CG-CG2 4.1Å; Q100-C105 PolarHBondContact OE1-SG 3.2Å; Q100-W242 PolarHBondContact NE2-O 3.18Å; Q100-A244 HydrophobicContact CB-CB 4.2Å; Q100-A244 HydrophobicContact CG-CB 4.46Å; Q100-W248 HydrophobicContact CB-CZ3 4.25Å
101F90.9Very high82.8Confident13 Ų1347.1 Ų47.16%0.05727%0.274CS..  trans-122.2166.8-179.2-57.6-87.5000109.9Q23 E99 I103 T104 F170 I171Q23-F101 HydrophobicContact CG-CE1 4.14Å; E99-F101 HydrophobicContact CB-CE2 4.09Å; E99-F101 HydrophobicContact CB-CZ 4.09Å; F101-I103 PolarHBondContact O-N 3.44Å; F101-T104 PolarHBondContact N-OG1 3.28Å; F101-T104 VanDerWaalsContact O-CB 3.26Å; F101-T104 WeakPolarHBondContact O-CB 3.39Å; F101-T104 PolarHBondContact O-N 3.27Å; F101-T104 PolarHBondContact O-OG1 3.07Å; F101-F170 HydrophobicContact CE1-CE1 4.23Å; F101-F170 HydrophobicContact CE2-CD1 4.26Å; F101-F170 AromaticContact CE2-CE1 3.91Å; F101-F170 HydrophobicContact CE2-CE1 3.91Å; F101-F170 HydrophobicContact CZ-CD1 4.36Å; F101-F170 AromaticContact CZ-CE1 3.56Å; F101-F170 HydrophobicContact CZ-CE1 3.56Å; F101-F170 HydrophobicContact CZ-CZ 4.07Å; F101-I171 HydrophobicContact CD2-CB 3.85Å; F101-I171 HydrophobicContact CD2-CG2 3.88Å; F101-I171 HydrophobicContact CE2-CB 4.49Å; F101-I171 HydrophobicContact CE2-CG2 4.4Å; F101-I171 HydrophobicContact CG-CG2 4.31Å
102P89Confident84.6Confident74 Ų7442.3 Ų42.348%0.48124%0.243SC..THydrogen-bonded Turntrans-54.7-23.5179.3-2936.4000115.6W248P102-W248 HydrophobicContact CB-CD2 4.4Å; P102-W248 HydrophobicContact CB-CG 4.29Å; P102-W248 HydrophobicContact CG-CD2 4.47Å; P102-W248 HydrophobicContact CG-CZ2 4.18Å
103I88.4Confident86.5Confident62 Ų6234.5 Ų34.532%0.31820%0.201SC..THydrogen-bonded Turntrans-101.47.8179.159.6167.5000113.7F101 I171F101-I103 PolarHBondContact O-N 3.44Å; I103-I171 HydrophobicContact CD1-CD1 3.68Å; I103-I171 HydrophobicContact CD1-CG2 4.3Å; I103-I171 HydrophobicContact CG1-CD1 3.81Å; I103-I171 HydrophobicContact CG1-CG2 4.46Å
104T90.5Very high88.1Confident0 Ų027.9 Ų27.90%017%0.172CC..THydrogen-bonded Turntrans-77.3-43-177.9-63.10000112.5Y81 Q100 F101 E106 I171 T173Y81-T104 HydrophobicContact CD1-CG2 3.84Å; Y81-T104 HydrophobicContact CE1-CG2 4.39Å; Y81-T104 HydrophobicContact CG-CG2 4.07Å; Q100-T104 HydrophobicContact CB-CG2 4.18Å; Q100-T104 HydrophobicContact CG-CG2 4.1Å; F101-T104 PolarHBondContact N-OG1 3.28Å; F101-T104 VanDerWaalsContact O-CB 3.26Å; F101-T104 WeakPolarHBondContact O-CB 3.39Å; F101-T104 PolarHBondContact O-N 3.27Å; F101-T104 PolarHBondContact O-OG1 3.07Å; T104-E106 VanDerWaalsContact C-N 3.27Å; T104-E106 PolarHBondContact O-N 2.99Å; T104-I171 WeakPolarHBondContact CB-O 3.32Å; T104-I171 WeakPolarHBondContact CG2-O 3.48Å; T104-I171 PolarHBondContact OG1-O 2.96Å; T104-T173 WeakPolarHBondContact CA-OG1 3.3Å; T104-T173 PolarHBondContact O-OG1 2.89Å
105C89.4Confident89.3Confident0 Ų023.2 Ų23.20%014%0.137CC..  trans-82.565.6-169.9-54.70000113.3Q100 C243 W248 N250Q100-C105 PolarHBondContact OE1-SG 3.2Å; C105-C243 HydrophobicContact CB-CB 3.75Å; C105-C243 WeakPolarHBondContact CB-SG 3.35Å; C105-C243 WeakPolarHBondContact SG-CA 3.44Å; C105-C243 WeakPolarHBondContact SG-CB 3.26Å; C105-C243 CovalentContact SG-SG 2.02Å; C105-C243 PolarHBondContact SG-SG 2.96Å; C105-W248 HydrophobicContact CB-CB 4.4Å; C105-W248 WeakPolarHBondContact CB-O 3.4Å; C105-N250 PolarHBondContact O-N 3.03Å; C105-N250 VanDerWaalsContact O-N 3.12Å
106E88.3Confident90.4Very high11 Ų1120.8 Ų20.85%0.05112%0.12CC..BIsolated β-bridgetrans-74.6146.2166.6-67-171.1179.500111.3R79 Y81 T104 H115 R168 T173 H174 T253R79-E106 IonicContact CZ-OE2 3.68Å; R79-E106 IonicContact NH1-OE2 3.94Å; R79-E106 PolarHBondContact NH1-OE2 3.45Å; R79-E106 IonicContact NH2-OE2 3.88Å; R79-E106 PolarHBondContact NH2-OE2 3.37Å; Y81-E106 PolarHBondContact OH-O 3.42Å; T104-E106 VanDerWaalsContact C-N 3.27Å; T104-E106 PolarHBondContact O-N 2.99Å; E106-H115 IonicContact OE1-CE1 3.27Å; E106-H115 PolarHBondContact OE1-CE1 3.07Å; E106-H115 VanDerWaalsContact OE1-CE1 3.27Å; E106-H115 IonicContact OE1-ND1 3.49Å; E106-H115 PolarHBondContact OE1-ND1 3.32Å; E106-R168 IonicContact OE1-CZ 3.77Å; E106-R168 IonicContact OE1-NH2 2.61Å; E106-R168 PolarHBondContact OE1-NH2 2.93Å; E106-T173 HydrophobicContact CB-CG2 4.35Å; E106-T173 HydrophobicContact CG-CG2 3.91Å; E106-H174 IonicContact OE2-NE2 3.89Å; E106-T253 HydrophobicContact CG-CG2 4.24Å
107T86.1Confident91.1Very high1 Ų120 Ų201%0.00612%0.115CC..  trans-97.3-21.4-170.553.40000114.3S235 A239 I249 N250 T253 T254T107-S235 CarbonylContact O-C 3.29Å; T107-S235 WeakPolarHBondContact O-CB 3.39Å; T107-S235 PolarHBondContact O-OG 3.27Å; T107-A239 HydrophobicContact CG2-CB 4.21Å; T107-I249 HydrophobicContact CG2-CG2 3.68Å; T107-N250 WeakPolarHBondContact CG2-O 3.41Å; T107-N250 PolarHBondContact OG1-O 2.97Å; T107-T253 PolarHBondContact N-OG1 3.43Å; T107-T253 PolarHBondContact OG1-OG1 3.37Å; T107-T253 VanDerWaalsContact OG1-OG1 3.08Å; T107-T254 WeakPolarHBondContact OG1-CG2 3.46Å; T107-T254 PolarHBondContact OG1-N 2.91Å
108G86.2Confident91.5Very high1 Ų115.6 Ų15.61%0.019%0.087CC..SBendtrans-78.9167.9175.400000113.9R79R79-G108 PolarHBondContact NE-O 3.35Å; R79-G108 PolarHBondContact NH2-O 3.34Å
109P91.4Very high91.7Very high0 Ų015.1 Ų15.10%09%0.085CC..  trans-59.3155.3173.3-23.233.8000113.2K72 R79 W234K72-P109 HydrophobicContact CB-CB 4.05Å; K72-P109 HydrophobicContact CB-CG 4.19Å; K72-P109 WeakPolarHBondContact CD-O 3.49Å; K72-P109 WeakPolarHBondContact CE-O 3.43Å; K72-P109 HydrophobicContact CG-CB 4.26Å; R79-P109 PolarHBondContact NH2-O 3.32Å; P109-W234 HydrophobicContact CB-CZ2 4.33Å
110G91.1Very high92Very high0 Ų012.3 Ų12.30%07%0.072CC..  trans-84.4-18.6-171.900000116.2G77 P112 H174 Q178G77-G110 PolarHBondContact O-N 3.42Å; G110-P112 CarbonylContact O-C 3.59Å; G110-H174 PolarHBondContact O-CE1 3.31Å; G110-H174 PolarHBondContact O-ND1 3.34Å; G110-Q178 VanDerWaalsContact O-CD 3.24Å; G110-Q178 PolarHBondContact O-OE1 3.34Å; G110-Q178 VanDerWaalsContact O-OE1 3.12Å
111S93.4Very high92.1Very high9 Ų910.3 Ų10.36%0.0636%0.062CC..SBendtrans-119.5127.2-172.2-166.30000112.7K72K72-S111 WeakPolarHBondContact CA-O 3.33Å; K72-S111 VanDerWaalsContact CG-O 3.26Å; K72-S111 WeakPolarHBondContact CG-O 3.34Å
112P95.7Very high92.2Very high0 Ų09.7 Ų9.70%06%0.06CC..SBendcis-80164.7-10.126.3-22.5000112.3N68 F71 K72 G110 G114 M117 L181N68-P112 PolarHBondContact ND2-O 3.2Å; F71-P112 HydrophobicContact CB-CG 4.09Å; F71-P112 HydrophobicContact CD2-CG 4.33Å; K72-P112 VanDerWaalsContact CE-O 3.27Å; K72-P112 WeakPolarHBondContact CE-O 3.4Å; G110-P112 CarbonylContact O-C 3.59Å; P112-G114 PolarHBondContact O-N 3.29Å; P112-M117 HydrophobicContact CG-SD 4.42Å; P112-L181 HydrophobicContact CB-CB 4.31Å; P112-L181 HydrophobicContact CB-CD2 4.06Å; P112-L181 HydrophobicContact CB-CG 3.99Å
113S95.6Very high92.5Very high0 Ų08.3 Ų8.30%05%0.045CC..  trans-63.3119.2177.2174.10000111.7A116 M117 H174 Q178S113-A116 PolarHBondContact OG-N 3.43Å; S113-M117 VanDerWaalsContact O-CB 3.26Å; S113-M117 WeakPolarHBondContact O-CB 3.33Å; S113-M117 PolarHBondContact O-N 3.23Å; S113-H174 PolarHBondContact OG-CD2 3.34Å; S113-H174 PolarHBondContact OG-NE2 2.88Å; S113-Q178 PolarHBondContact N-O 3.47Å
114G92.6Very high92.9Very high7 Ų76.8 Ų6.87%0.0724%0.035CC..Hα-helixtrans-68.7-33.9179.100000113P112 G118P112-G114 PolarHBondContact O-N 3.29Å; G114-G118 PolarHBondContact O-N 3.24Å
115H93.3Very high93Very high22 Ų226.8 Ų6.810%0.1024%0.035CC..Hα-helixtrans-65.1-51.2174.9-7968.4000110.8G33 E106 M117 G118 S119 R168G33-H115 PolarHBondContact O-CD2 3.48Å; E106-H115 IonicContact OE1-CE1 3.27Å; E106-H115 PolarHBondContact OE1-CE1 3.07Å; E106-H115 VanDerWaalsContact OE1-CE1 3.27Å; E106-H115 IonicContact OE1-ND1 3.49Å; E106-H115 PolarHBondContact OE1-ND1 3.32Å; H115-M117 VanDerWaalsContact C-N 3.34Å; H115-M117 PolarHBondContact O-N 3.43Å; H115-G118 PolarHBondContact O-N 2.88Å; H115-S119 VanDerWaalsContact O-CB 3.27Å; H115-S119 WeakPolarHBondContact O-CB 3.36Å; H115-S119 PolarHBondContact O-N 2.94Å; H115-S119 PolarHBondContact O-OG 3.46Å; H115-R168 HydrophobicContact CB-CG 4.11Å; H115-R168 PolarHBondContact CE1-NH2 2.97Å
116A96.1Very high93.2Very high0 Ų07.5 Ų7.50%04%0.039CC..Hα-helixtrans-65.1-38.5-179.500000112.3S113 S119 S120 V179 V183S113-A116 PolarHBondContact OG-N 3.43Å; A116-S119 PolarHBondContact O-OG 2.96Å; A116-S120 VanDerWaalsContact O-CB 3.26Å; A116-S120 WeakPolarHBondContact O-CB 3.31Å; A116-S120 PolarHBondContact O-N 2.89Å; A116-S120 VanDerWaalsContact O-N 3.09Å; A116-S120 PolarHBondContact O-OG 3Å; A116-V179 HydrophobicContact CB-CB 4.27Å; A116-V183 HydrophobicContact CB-CG2 4.05Å
117M96.1Very high93.5Very high1 Ų17.3 Ų7.31%0.0054%0.039CC..Hα-helixtrans-67.7-50.3176-171.7170.5178.400111.7G64 F67 N68 P112 S113 H115 S119 S120 C121 G182 A185 V189G64-M117 WeakPolarHBondContact O-CE 3.4Å; F67-M117 HydrophobicContact CB-CE 3.96Å; N68-M117 HydrophobicContact CB-SD 3.61Å; P112-M117 HydrophobicContact CG-SD 4.42Å; S113-M117 VanDerWaalsContact O-CB 3.26Å; S113-M117 WeakPolarHBondContact O-CB 3.33Å; S113-M117 PolarHBondContact O-N 3.23Å; H115-M117 VanDerWaalsContact C-N 3.34Å; H115-M117 PolarHBondContact O-N 3.43Å; M117-S119 PolarHBondContact O-N 3.5Å; M117-S120 PolarHBondContact O-OG 3.5Å; M117-C121 WeakPolarHBondContact O-CB 3.27Å; M117-C121 PolarHBondContact O-N 2.95Å; M117-G182 WeakPolarHBondContact CA-O 3.41Å; M117-G182 WeakPolarHBondContact CB-O 3.27Å; M117-A185 HydrophobicContact CE-CB 3.83Å; M117-A185 HydrophobicContact CG-CB 4.35Å; M117-A185 HydrophobicContact SD-CB 3.9Å; M117-V189 HydrophobicContact CE-CG2 4.06Å
118G94.1Very high93.9Very high11 Ų118.5 Ų8.511%0.1135%0.046CC..Hα-helixtrans-62.1-44.4179.200000112.9G114 H115 V122G114-G118 PolarHBondContact O-N 3.24Å; H115-G118 PolarHBondContact O-N 2.88Å; G118-V122 PolarHBondContact O-N 3.39Å
119S95.1Very high94.1Very high4 Ų48.8 Ų8.83%0.0285%0.048CC..Hα-helixtrans-63.7-51.4178.766.10000111.6H115 A116 M117 C121 V122 W123 Q161H115-S119 VanDerWaalsContact O-CB 3.27Å; H115-S119 WeakPolarHBondContact O-CB 3.36Å; H115-S119 PolarHBondContact O-N 2.94Å; H115-S119 PolarHBondContact O-OG 3.46Å; A116-S119 PolarHBondContact O-OG 2.96Å; M117-S119 PolarHBondContact O-N 3.5Å; S119-C121 VanDerWaalsContact C-N 3.31Å; S119-C121 PolarHBondContact O-N 3.29Å; S119-V122 PolarHBondContact O-N 2.73Å; S119-W123 VanDerWaalsContact O-CB 3.29Å; S119-W123 WeakPolarHBondContact O-CB 3.37Å; S119-W123 PolarHBondContact O-N 2.69Å; S119-Q161 PolarHBondContact OG-OE1 3.26Å
120S96.3Very high94.1Very high0 Ų010.1 Ų10.10%06%0.059CC..Hα-helixtrans-61.4-41.8-179.457.10000111.7A116 M117 V122 Y124 Q161 V183A116-S120 VanDerWaalsContact O-CB 3.26Å; A116-S120 WeakPolarHBondContact O-CB 3.31Å; A116-S120 PolarHBondContact O-N 2.89Å; A116-S120 VanDerWaalsContact O-N 3.09Å; A116-S120 PolarHBondContact O-OG 3Å; M117-S120 PolarHBondContact O-OG 3.5Å; S120-V122 PolarHBondContact O-N 3.49Å; S120-Y124 WeakPolarHBondContact O-CB 3.37Å; S120-Y124 PolarHBondContact O-N 3.14Å; S120-Q161 VanDerWaalsContact N-OE1 3.16Å; S120-V183 PolarHBondContact OG-O 3.47Å
121C94.4Very high94Very high0 Ų010.8 Ų10.80%06%0.063CC..Hα-helixtrans-57.2-49.4178.9-156.30000112.2V60 M117 S119 V125 G186 A190V60-C121 HydrophobicContact CG1-CB 4.28Å; V60-C121 WeakPolarHBondContact CG1-SG 3.43Å; V60-C121 PolarHBondContact O-SG 3.27Å; M117-C121 WeakPolarHBondContact O-CB 3.27Å; M117-C121 PolarHBondContact O-N 2.95Å; S119-C121 VanDerWaalsContact C-N 3.31Å; S119-C121 PolarHBondContact O-N 3.29Å; C121-V125 PolarHBondContact O-N 2.94Å; C121-G186 PolarHBondContact SG-O 3.38Å; C121-A190 WeakPolarHBondContact O-CB 3.41Å
122V93.6Very high93.6Very high0 Ų013.9 Ų13.90%08%0.084CC..Hα-helixtrans-77.9-41.6-177.71700000112.6I38 M57 A61 G118 S119 S120 Y124 V125 M126I38-V122 HydrophobicContact CB-CG2 4.38Å; I38-V122 HydrophobicContact CD1-CB 4.32Å; I38-V122 HydrophobicContact CD1-CG2 3.55Å; I38-V122 HydrophobicContact CG1-CB 4.24Å; I38-V122 HydrophobicContact CG1-CG1 4.38Å; I38-V122 HydrophobicContact CG1-CG2 3.77Å; I38-V122 HydrophobicContact CG2-CG1 4.39Å; I38-V122 HydrophobicContact CG2-CG2 3.71Å; M57-V122 HydrophobicContact CE-CG1 3.83Å; M57-V122 HydrophobicContact CG-CG1 3.82Å; M57-V122 HydrophobicContact CG-CG2 4.13Å; M57-V122 HydrophobicContact SD-CG1 3.74Å; A61-V122 HydrophobicContact CB-CG2 4.07Å; G118-V122 PolarHBondContact O-N 3.39Å; S119-V122 PolarHBondContact O-N 2.73Å; S120-V122 PolarHBondContact O-N 3.49Å; V122-Y124 PolarHBondContact O-N 2.93Å; V122-V125 PolarHBondContact O-N 3.35Å; V122-M126 HydrophobicContact CG1-CE 4.26Å; V122-M126 HydrophobicContact CG1-CG 4.48Å; V122-M126 HydrophobicContact CG1-SD 4.49Å; V122-M126 WeakPolarHBondContact O-CG 3.16Å; V122-M126 PolarHBondContact O-N 3.14Å
123W95.1Very high92.8Very high46 Ų4619.7 Ų19.717%0.17411%0.107CC..Hα-helixtrans-64-32.7177.4-80.582.4000112.1Y42 S119 M126 V127 F157 I160Y42-W123 HydrophobicContact CE1-CZ2 4.11Å; S119-W123 VanDerWaalsContact O-CB 3.29Å; S119-W123 WeakPolarHBondContact O-CB 3.37Å; S119-W123 PolarHBondContact O-N 2.69Å; W123-M126 HydrophobicContact CB-CE 4.09Å; W123-M126 HydrophobicContact CD2-CE 3.27Å; W123-M126 HydrophobicContact CE3-CE 3.61Å; W123-M126 HydrophobicContact CG-CE 3.49Å; W123-M126 VanDerWaalsContact CG-CE 3.49Å; W123-M126 HydrophobicContact CH2-CE 4.33Å; W123-M126 HydrophobicContact CZ2-CE 4.08Å; W123-M126 HydrophobicContact CZ3-CE 4.12Å; W123-M126 PolarHBondContact O-N 2.88Å; W123-V127 VanDerWaalsContact O-CG2 3.32Å; W123-V127 WeakPolarHBondContact O-CG2 3.24Å; W123-V127 PolarHBondContact O-N 3.29Å; W123-F157 HydrophobicContact CB-CD2 3.75Å; W123-F157 HydrophobicContact CB-CE2 3.82Å; W123-I160 HydrophobicContact CD2-CD1 4.28Å; W123-I160 HydrophobicContact CD2-CG2 4.38Å; W123-I160 HydrophobicContact CE3-CD1 3.8Å; W123-I160 HydrophobicContact CH2-CD1 3.24Å; W123-I160 HydrophobicContact CZ2-CD1 3.74Å; W123-I160 HydrophobicContact CZ2-CG2 4.34Å; W123-I160 HydrophobicContact CZ3-CD1 3.27Å
124Y95.8Very high91.7Very high29 Ų2921.5 Ų21.511%0.11412%0.118CC..Hα-helixtrans-59.6-50.2172-167.9-76000111S120 V122 M126 V127 T128 W154 M187 A190 E191S120-Y124 WeakPolarHBondContact O-CB 3.37Å; S120-Y124 PolarHBondContact O-N 3.14Å; V122-Y124 PolarHBondContact O-N 2.93Å; Y124-M126 VanDerWaalsContact C-N 3.29Å; Y124-M126 PolarHBondContact O-N 3.49Å; Y124-V127 PolarHBondContact O-N 3.04Å; Y124-T128 HydrophobicContact CD1-CG2 3.78Å; Y124-T128 HydrophobicContact CE1-CG2 3.52Å; Y124-T128 WeakPolarHBondContact O-CG2 3.44Å; Y124-T128 PolarHBondContact O-N 3.49Å; Y124-T128 PolarHBondContact O-OG1 3.27Å; Y124-W154 AromaticContact CD2-CH2 3.54Å; Y124-W154 HydrophobicContact CD2-CH2 3.54Å; Y124-W154 HydrophobicContact CD2-CZ3 4.07Å; Y124-W154 AromaticContact CE2-CH2 3.34Å; Y124-W154 HydrophobicContact CE2-CH2 3.34Å; Y124-W154 HydrophobicContact CE2-CZ2 4.26Å; Y124-W154 HydrophobicContact CE2-CZ3 4.12Å; Y124-W154 HydrophobicContact CG-CH2 4.27Å; Y124-W154 AromaticContact CZ-CH2 3.89Å; Y124-M187 HydrophobicContact CD2-CB 4.06Å; Y124-M187 HydrophobicContact CD2-CE 4.05Å; Y124-M187 HydrophobicContact CD2-CG 3.91Å; Y124-M187 HydrophobicContact CE2-CB 4.24Å; Y124-M187 HydrophobicContact CE2-CE 3.85Å; Y124-M187 HydrophobicContact CE2-CG 4.41Å; Y124-A190 HydrophobicContact CD1-CB 3.59Å; Y124-A190 HydrophobicContact CE1-CB 4.4Å; Y124-A190 HydrophobicContact CG-CB 3.75Å; Y124-E191 HydrophobicContact CE1-CB 4.33Å; Y124-E191 VanDerWaalsContact CE1-OE2 3.32Å; Y124-E191 WeakPolarHBondContact CE1-OE2 3.27Å; Y124-E191 VanDerWaalsContact CZ-OE2 3.25Å; Y124-E191 PolarHBondContact OH-OE2 3.01Å
125V93.9Very high90.3Very high1 Ų125.7 Ų25.71%0.00614%0.142CC..Hα-helixtrans-59.6-39.5176.9174.10000111.9V53 K56 V60 C121 V122 T128 A129 A190V53-V125 HydrophobicContact CG1-CG1 4.18Å; K56-V125 HydrophobicContact CD-CG1 4.24Å; K56-V125 HydrophobicContact CG-CG1 4.4Å; V60-V125 HydrophobicContact CB-CG2 4.22Å; V60-V125 HydrophobicContact CG1-CG2 3.83Å; V60-V125 HydrophobicContact CG2-CG2 4.06Å; C121-V125 PolarHBondContact O-N 2.94Å; V122-V125 PolarHBondContact O-N 3.35Å; V125-T128 PolarHBondContact O-OG1 2.89Å; V125-A129 WeakPolarHBondContact O-CB 3.27Å; V125-A129 PolarHBondContact O-N 3.03Å; V125-A190 HydrophobicContact CG2-CB 4.2Å
126M93.6Very high88.6Confident14 Ų1427.7 Ų27.77%0.06917%0.169CC..Hα-helixtrans-65-42.3177-66.2-168.5-67.200111.9Y42 W46 M57 V122 W123 Y124 A130Y42-M126 HydrophobicContact CD1-CE 4.22Å; Y42-M126 HydrophobicContact CD1-SD 4.08Å; Y42-M126 HydrophobicContact CE1-CE 4.45Å; Y42-M126 HydrophobicContact CG-SD 4.38Å; W46-M126 HydrophobicContact CD2-CG 4.45Å; W46-M126 HydrophobicContact CZ2-CB 3.77Å; W46-M126 HydrophobicContact CZ2-CG 4.02Å; W46-M126 VanDerWaalsContact NE1-CG 3.27Å; W46-M126 PolarHBondContact NE1-SD 3.46Å; M57-M126 HydrophobicContact CE-CG 3.57Å; M57-M126 HydrophobicContact CE-SD 4.04Å; V122-M126 HydrophobicContact CG1-CE 4.26Å; V122-M126 HydrophobicContact CG1-CG 4.48Å; V122-M126 HydrophobicContact CG1-SD 4.49Å; V122-M126 WeakPolarHBondContact O-CG 3.16Å; V122-M126 PolarHBondContact O-N 3.14Å; W123-M126 HydrophobicContact CB-CE 4.09Å; W123-M126 HydrophobicContact CD2-CE 3.27Å; W123-M126 HydrophobicContact CE3-CE 3.61Å; W123-M126 HydrophobicContact CG-CE 3.49Å; W123-M126 VanDerWaalsContact CG-CE 3.49Å; W123-M126 HydrophobicContact CH2-CE 4.33Å; W123-M126 HydrophobicContact CZ2-CE 4.08Å; W123-M126 HydrophobicContact CZ3-CE 4.12Å; W123-M126 PolarHBondContact O-N 2.88Å; Y124-M126 VanDerWaalsContact C-N 3.29Å; Y124-M126 PolarHBondContact O-N 3.49Å; M126-A130 VanDerWaalsContact O-CB 3.27Å; M126-A130 WeakPolarHBondContact O-CB 3.44Å; M126-A130 PolarHBondContact O-N 2.88Å
127V94.8Very high86.9Confident8 Ų836.1 Ų36.15%0.04820%0.201CC..Hα-helixtrans-66.9-47.7178.4168.10000111.2W123 Y124 A129 A130 L131 L153 W154 F157W123-V127 VanDerWaalsContact O-CG2 3.32Å; W123-V127 WeakPolarHBondContact O-CG2 3.24Å; W123-V127 PolarHBondContact O-N 3.29Å; Y124-V127 PolarHBondContact O-N 3.04Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.28Å; V127-A130 PolarHBondContact O-N 3.49Å; V127-L131 HydrophobicContact CG1-CD1 3.86Å; V127-L131 WeakPolarHBondContact O-CB 3.41Å; V127-L131 VanDerWaalsContact O-CG 3.3Å; V127-L131 WeakPolarHBondContact O-CG 3.44Å; V127-L131 PolarHBondContact O-N 3.38Å; V127-L153 HydrophobicContact CG1-CB 3.98Å; V127-L153 HydrophobicContact CG2-CB 4.43Å; V127-W154 HydrophobicContact CG1-CD2 4.13Å; V127-W154 HydrophobicContact CG1-CG 4.47Å; V127-W154 HydrophobicContact CG1-CZ2 4.08Å; V127-F157 HydrophobicContact CG2-CB 4.18Å; V127-F157 HydrophobicContact CG2-CD2 4.45Å
128T92.9Very high85Confident25 Ų2546.4 Ų46.415%0.15325%0.245CC..Hα-helixtrans-65.4-39.5179.1610000111.7Y124 V125 L131 S132 E194Y124-T128 HydrophobicContact CD1-CG2 3.78Å; Y124-T128 HydrophobicContact CE1-CG2 3.52Å; Y124-T128 WeakPolarHBondContact O-CG2 3.44Å; Y124-T128 PolarHBondContact O-N 3.49Å; Y124-T128 PolarHBondContact O-OG1 3.27Å; V125-T128 PolarHBondContact O-OG1 2.89Å; T128-L131 PolarHBondContact O-N 2.88Å; T128-S132 PolarHBondContact O-N 2.9Å; T128-E194 WeakPolarHBondContact CB-OE2 3.4Å; T128-E194 PolarHBondContact OG1-OE2 2.98Å
129A91Very high83.9Confident7 Ų751.8 Ų51.86%0.05827%0.272CS..Hα-helixtrans-61.2-47.8173.200000112W46 V53 V125 V127 L131 S132 Y133W46-A129 HydrophobicContact CH2-CB 4.13Å; W46-A129 HydrophobicContact CZ3-CB 3.87Å; V53-A129 HydrophobicContact CB-CB 4.3Å; V53-A129 HydrophobicContact CG1-CB 3.59Å; V53-A129 HydrophobicContact CG2-CB 3.65Å; V125-A129 WeakPolarHBondContact O-CB 3.27Å; V125-A129 PolarHBondContact O-N 3.03Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.28Å; A129-L131 VanDerWaalsContact C-N 3.3Å; A129-L131 PolarHBondContact O-N 3.47Å; A129-S132 PolarHBondContact O-N 3.34Å; A129-S132 PolarHBondContact O-OG 2.93Å; A129-Y133 WeakPolarHBondContact O-CD2 3.23Å
130A91.1Very high82.7Confident28 Ų2860.8 Ų60.823%0.23131%0.31CS..Hα-helixtrans-60.3-39.4177.700000112.2W46 M126 V127 Y133 L153W46-A130 HydrophobicContact CH2-CB 4.31Å; M126-A130 VanDerWaalsContact O-CB 3.27Å; M126-A130 WeakPolarHBondContact O-CB 3.44Å; M126-A130 PolarHBondContact O-N 2.88Å; V127-A130 PolarHBondContact O-N 3.49Å; A130-Y133 PolarHBondContact O-N 3.23Å; A130-L153 HydrophobicContact CB-CD1 3.74Å
131L89.9Confident81.4Confident15 Ų1565.4 Ų65.48%0.07934%0.343CS..Hα-helixtrans-68.1-37.4176.1-71.8168.3000112.8V127 T128 A129 Y133 T134 V135 T149 W150 L153V127-L131 HydrophobicContact CG1-CD1 3.86Å; V127-L131 WeakPolarHBondContact O-CB 3.41Å; V127-L131 VanDerWaalsContact O-CG 3.3Å; V127-L131 WeakPolarHBondContact O-CG 3.44Å; V127-L131 PolarHBondContact O-N 3.38Å; T128-L131 PolarHBondContact O-N 2.88Å; A129-L131 VanDerWaalsContact C-N 3.3Å; A129-L131 PolarHBondContact O-N 3.47Å; L131-Y133 PolarHBondContact O-N 2.87Å; L131-Y133 VanDerWaalsContact O-N 3.11Å; L131-T134 PolarHBondContact O-N 3.36Å; L131-T134 PolarHBondContact O-OG1 2.9Å; L131-V135 PolarHBondContact O-N 3.48Å; L131-T149 HydrophobicContact CD2-CG2 4.14Å; L131-W150 HydrophobicContact CD1-CG 4.46Å; L131-W150 HydrophobicContact CD2-CB 3.92Å; L131-L153 HydrophobicContact CD2-CD1 3.83Å; L131-L153 HydrophobicContact CG-CD1 3.83Å
132S85.1Confident80.4Confident74 Ų7465.7 Ų65.752%0.51735%0.345SS..Hα-helixtrans-58.7-28.2178.975.20000113.1T128 A129 T134T128-S132 PolarHBondContact O-N 2.9Å; A129-S132 PolarHBondContact O-N 3.34Å; A129-S132 PolarHBondContact O-OG 2.93Å; S132-T134 VanDerWaalsContact C-N 3.33Å; S132-T134 PolarHBondContact O-N 3.39Å
133Y79.1Confident79.8Confident121 Ų12170.5 Ų70.548%0.47537%0.374SS..THydrogen-bonded Turntrans-70.8-25.4176-73-68.2000114N50 A129 A130 L131N50-Y133 VanDerWaalsContact CB-OH 3.24Å; N50-Y133 WeakPolarHBondContact CB-OH 3.49Å; N50-Y133 PolarHBondContact ND2-OH 2.97Å; A129-Y133 WeakPolarHBondContact O-CD2 3.23Å; A130-Y133 PolarHBondContact O-N 3.23Å; L131-Y133 PolarHBondContact O-N 2.87Å; L131-Y133 VanDerWaalsContact O-N 3.11Å
134T71.2Confident79.2Confident38 Ų3872.5 Ų72.523%0.23339%0.392CS..THydrogen-bonded Turntrans-90.5-13.7-177.560.70000113.1L131 S132 G136 H146 T149L131-T134 PolarHBondContact O-N 3.36Å; L131-T134 PolarHBondContact O-OG1 2.9Å; S132-T134 VanDerWaalsContact C-N 3.33Å; S132-T134 PolarHBondContact O-N 3.39Å; T134-G136 VanDerWaalsContact C-N 3.3Å; T134-G136 PolarHBondContact O-N 3.36Å; T134-H146 PolarHBondContact OG1-CD2 3.46Å; T134-H146 VanDerWaalsContact OG1-CD2 3.29Å; T134-T149 HydrophobicContact CG2-CG2 4.17Å
135V64.8Low78.6Confident95 Ų9575.2 Ų75.258%0.57641%0.408SS*.THydrogen-bonded Turntrans-71.8-18.7-179175.90000113.3L131 W137 H146L131-V135 PolarHBondContact O-N 3.48Å; V135-W137 PolarHBondContact O-N 3.38Å; V135-H146 WeakPolarHBondContact CG2-NE2 3.34Å
136G57.6Low78.2Confident65 Ų6577.9 Ų77.967%0.6742%0.42SS*.THydrogen-bonded Turntrans-70.4-2-174.500000116.4T134T134-G136 VanDerWaalsContact C-N 3.3Å; T134-G136 PolarHBondContact O-N 3.36Å
137W58.7Low78Confident177 Ų17786.5 Ų86.567%0.6745%0.452SS*.  trans-105.7115.6-169.1-71.232.7000110.2V135 D139 A142V135-W137 PolarHBondContact O-N 3.38Å; W137-D139 PolarHBondContact O-N 2.86Å; W137-A142 HydrophobicContact CB-CB 3.3Å; W137-A142 HydrophobicContact CE3-CB 4.38Å; W137-A142 HydrophobicContact CG-CB 4.4Å; W137-A142 VanDerWaalsContact O-CB 3.29Å; W137-A142 WeakPolarHBondContact O-CB 3.26Å
138K56.2Low77.8Confident216 Ų21691.5 Ų91.594%0.93948%0.477SS*.  trans-83.93.2-170.7-71.3-173177.2-178.70115.6
139D72.6Confident77.6Confident124 Ų12491.9 Ų91.966%0.66348%0.48SS*.SBendtrans-88.3151.9-176.3-82.2-35.1000113.8W137 S141 A142 V143W137-D139 PolarHBondContact O-N 2.86Å; D139-S141 PolarHBondContact O-N 2.94Å; D139-A142 HydrophobicContact CB-CB 4.41Å; D139-A142 WeakPolarHBondContact O-CA 3.32Å; D139-A142 WeakPolarHBondContact O-CB 3.3Å; D139-A142 PolarHBondContact O-N 3.31Å; D139-V143 PolarHBondContact O-N 3.46Å
140K68.6Low77.7Confident193 Ų19397.7 Ų97.784%0.83950%0.5SS*.Hα-helixtrans-55.7-34.6174.1-75.3-176.8178.3177.80112.8A142 V143 T144K140-A142 VanDerWaalsContact C-N 3.3Å; K140-A142 PolarHBondContact O-N 3.19Å; K140-V143 PolarHBondContact O-N 3.47Å; K140-T144 PolarHBondContact O-N 2.77Å
141S68.9Low77.9Confident98 Ų9899.2 Ų99.269%0.68551%0.51SS*.Hα-helixtrans-63.6-36.2173.1-175.40000112D139 T144 L145D139-S141 PolarHBondContact O-N 2.94Å; S141-T144 PolarHBondContact O-N 2.83Å; S141-L145 WeakPolarHBondContact O-CB 3.39Å; S141-L145 PolarHBondContact O-N 3.23Å
142A74.2Confident78.2Confident6 Ų6105 Ų1055%0.0553%0.534CS..Hα-helixtrans-70.8-31.3178.800000113.4W137 D139 K140 L145 H146W137-A142 HydrophobicContact CB-CB 3.3Å; W137-A142 HydrophobicContact CE3-CB 4.38Å; W137-A142 HydrophobicContact CG-CB 4.4Å; W137-A142 VanDerWaalsContact O-CB 3.29Å; W137-A142 WeakPolarHBondContact O-CB 3.26Å; D139-A142 HydrophobicContact CB-CB 4.41Å; D139-A142 WeakPolarHBondContact O-CA 3.32Å; D139-A142 WeakPolarHBondContact O-CB 3.3Å; D139-A142 PolarHBondContact O-N 3.31Å; K140-A142 VanDerWaalsContact C-N 3.3Å; K140-A142 PolarHBondContact O-N 3.19Å; A142-L145 PolarHBondContact O-N 3.2Å; A142-H146 VanDerWaalsContact O-CB 3.25Å; A142-H146 WeakPolarHBondContact O-CB 3.43Å; A142-H146 PolarHBondContact O-N 3.32Å
143V79.8Confident78.7Confident100 Ų100103.1 Ų103.161%0.60652%0.518SS*.Hα-helixtrans-64.7-44.3173.6178.80000111D139 K140 H146 R147D139-V143 PolarHBondContact O-N 3.46Å; K140-V143 PolarHBondContact O-N 3.47Å; V143-H146 PolarHBondContact O-N 3.39Å; V143-R147 PolarHBondContact O-N 3.37Å
144T82.6Confident79.5Confident88 Ų8899 Ų9954%0.5450%0.502SS..Hα-helixtrans-64.2-44.8176.1-54.90000111.1K140 S141 R147 L148K140-T144 PolarHBondContact O-N 2.77Å; S141-T144 PolarHBondContact O-N 2.83Å; T144-R147 PolarHBondContact O-N 3.44Å; T144-L148 HydrophobicContact CG2-CD1 4.35Å; T144-L148 WeakPolarHBondContact O-CG 3.17Å; T144-L148 PolarHBondContact O-N 3.3Å
145L83.9Confident80.8Confident86 Ų86100 Ų10045%0.4551%0.51SS..Hα-helixtrans-60.7-46.8176.4-177.962000111.6S141 A142 R147 L148 T149S141-L145 WeakPolarHBondContact O-CB 3.39Å; S141-L145 PolarHBondContact O-N 3.23Å; A142-L145 PolarHBondContact O-N 3.2Å; L145-R147 VanDerWaalsContact C-N 3.31Å; L145-R147 PolarHBondContact O-N 3.21Å; L145-L148 PolarHBondContact O-N 3.47Å; L145-T149 PolarHBondContact O-N 3.43Å; L145-T149 PolarHBondContact O-OG1 2.97Å
146H86Confident82.3Confident58 Ų5897.6 Ų97.627%0.26950%0.496SS..Hα-helixtrans-57.4-43.9176.3174.8-85.8000111.5T134 V135 A142 V143 L148 T149 W150T134-H146 PolarHBondContact OG1-CD2 3.46Å; T134-H146 VanDerWaalsContact OG1-CD2 3.29Å; V135-H146 WeakPolarHBondContact CG2-NE2 3.34Å; A142-H146 VanDerWaalsContact O-CB 3.25Å; A142-H146 WeakPolarHBondContact O-CB 3.43Å; A142-H146 PolarHBondContact O-N 3.32Å; V143-H146 PolarHBondContact O-N 3.39Å; H146-L148 PolarHBondContact O-N 3.09Å; H146-T149 PolarHBondContact O-N 3.07Å; H146-W150 VanDerWaalsContact O-CB 3.23Å; H146-W150 WeakPolarHBondContact O-CB 3.06Å; H146-W150 PolarHBondContact O-N 3.29Å
147R88.2Confident84.2Confident194 Ų19494.5 Ų94.573%0.73246%0.464SS*.Hα-helixtrans-63.7-41177.3-171.5177.6-178.1176.80.8112.4V143 T144 L145 W150 S151V143-R147 PolarHBondContact O-N 3.37Å; T144-R147 PolarHBondContact O-N 3.44Å; L145-R147 VanDerWaalsContact C-N 3.31Å; L145-R147 PolarHBondContact O-N 3.21Å; R147-W150 PolarHBondContact O-N 2.99Å; R147-S151 WeakPolarHBondContact O-CB 3.24Å; R147-S151 PolarHBondContact O-N 3.5Å
148L90.3Very high86Confident113 Ų11391 Ų9159%0.59245%0.451SS*.Hα-helixtrans-65.2-46175.7-71.1172.4000111.3T144 L145 H146 W150 S151 F152T144-L148 HydrophobicContact CG2-CD1 4.35Å; T144-L148 WeakPolarHBondContact O-CG 3.17Å; T144-L148 PolarHBondContact O-N 3.3Å; L145-L148 PolarHBondContact O-N 3.47Å; H146-L148 PolarHBondContact O-N 3.09Å; L148-W150 VanDerWaalsContact C-N 3.34Å; L148-W150 PolarHBondContact O-N 3.49Å; L148-S151 PolarHBondContact O-N 2.97Å; L148-F152 WeakPolarHBondContact O-CB 3.48Å; L148-F152 PolarHBondContact O-N 2.76Å
149T90Very high88Confident34 Ų3486 Ų8621%0.20943%0.433CS..Hα-helixtrans-61.7-41.9175.9-55.10000111.5L131 T134 L145 H146 F152 L153L131-T149 HydrophobicContact CD2-CG2 4.14Å; T134-T149 HydrophobicContact CG2-CG2 4.17Å; L145-T149 PolarHBondContact O-N 3.43Å; L145-T149 PolarHBondContact O-OG1 2.97Å; H146-T149 PolarHBondContact O-N 3.07Å; T149-F152 PolarHBondContact O-N 3.29Å; T149-L153 HydrophobicContact CG2-CD1 3.71Å; T149-L153 HydrophobicContact CG2-CG 4.09Å; T149-L153 WeakPolarHBondContact O-CB 3.32Å; T149-L153 VanDerWaalsContact O-CG 3.31Å; T149-L153 WeakPolarHBondContact O-CG 3.38Å; T149-L153 PolarHBondContact O-N 2.96Å
150W93.6Very high89Confident128 Ų12881.1 Ų81.149%0.48541%0.407SS..Hα-helixtrans-57.2-52.7173.5-176.495.3000111.4L131 H146 R147 L148 F152 L153 W154L131-W150 HydrophobicContact CD1-CG 4.46Å; L131-W150 HydrophobicContact CD2-CB 3.92Å; H146-W150 VanDerWaalsContact O-CB 3.23Å; H146-W150 WeakPolarHBondContact O-CB 3.06Å; H146-W150 PolarHBondContact O-N 3.29Å; R147-W150 PolarHBondContact O-N 2.99Å; L148-W150 VanDerWaalsContact C-N 3.34Å; L148-W150 PolarHBondContact O-N 3.49Å; W150-F152 VanDerWaalsContact C-N 3.31Å; W150-F152 PolarHBondContact O-N 3.39Å; W150-L153 PolarHBondContact O-N 3.39Å; W150-W154 AromaticContact CD1-CD1 3.69Å; W150-W154 AromaticContact CD1-NE1 3.66Å; W150-W154 AromaticContact CD2-CD1 3.65Å; W150-W154 AromaticContact CE2-CD1 3.34Å; W150-W154 AromaticContact CE2-NE1 3.59Å; W150-W154 AromaticContact CG-CD1 3.84Å; W150-W154 AromaticContact CZ2-CD1 3.81Å; W150-W154 HydrophobicContact CZ2-CG 4.46Å; W150-W154 AromaticContact NE1-CD1 3.39Å; W150-W154 AromaticContact NE1-NE1 3.2Å; W150-W154 VanDerWaalsContact NE1-NE1 3.2Å; W150-W154 WeakPolarHBondContact O-CB 3.11Å; W150-W154 VanDerWaalsContact O-CD1 3.23Å; W150-W154 PolarHBondContact O-N 3.22Å; W150-W154 VanDerWaalsContact O-N 3.08Å
151S95Very high90.4Very high61 Ų6172 Ų7243%0.42737%0.367SS..Hα-helixtrans-60.5-43179.7-168.70000111.6R147 L148 S155R147-S151 WeakPolarHBondContact O-CB 3.24Å; R147-S151 PolarHBondContact O-N 3.5Å; L148-S151 PolarHBondContact O-N 2.97Å; S151-S155 VanDerWaalsContact O-CB 3.3Å; S151-S155 WeakPolarHBondContact O-CB 3.27Å; S151-S155 PolarHBondContact O-N 2.88Å; S151-S155 PolarHBondContact O-OG 2.89Å
152F95.5Very high91.7Very high135 Ų13571.7 Ų71.759%0.59236%0.357SS*.Hα-helixtrans-65-52.2-179.8176.6-103.4000112.1L148 T149 W150 W154 S155 V156L148-F152 WeakPolarHBondContact O-CB 3.48Å; L148-F152 PolarHBondContact O-N 2.76Å; T149-F152 PolarHBondContact O-N 3.29Å; W150-F152 VanDerWaalsContact C-N 3.31Å; W150-F152 PolarHBondContact O-N 3.39Å; F152-W154 PolarHBondContact O-N 3.48Å; F152-S155 WeakPolarHBondContact O-CB 3.38Å; F152-S155 PolarHBondContact O-N 3.49Å; F152-S155 VanDerWaalsContact O-N 3.17Å; F152-V156 HydrophobicContact CD1-CG2 4.48Å; F152-V156 HydrophobicContact CD2-CG2 4.46Å; F152-V156 HydrophobicContact CE1-CG2 4.08Å; F152-V156 HydrophobicContact CE2-CG2 4.06Å; F152-V156 HydrophobicContact CZ-CG2 3.86Å; F152-V156 WeakPolarHBondContact O-CG2 3.49Å; F152-V156 PolarHBondContact O-N 3.33Å
153L95.8Very high92.8Very high35 Ų3572.4 Ų72.418%0.18336%0.361CS..Hα-helixtrans-64.3-40.2-176.7-69.7178000112.2V127 A130 L131 T149 W150 V156 F157V127-L153 HydrophobicContact CG1-CB 3.98Å; V127-L153 HydrophobicContact CG2-CB 4.43Å; A130-L153 HydrophobicContact CB-CD1 3.74Å; L131-L153 HydrophobicContact CD2-CD1 3.83Å; L131-L153 HydrophobicContact CG-CD1 3.83Å; T149-L153 HydrophobicContact CG2-CD1 3.71Å; T149-L153 HydrophobicContact CG2-CG 4.09Å; T149-L153 WeakPolarHBondContact O-CB 3.32Å; T149-L153 VanDerWaalsContact O-CG 3.31Å; T149-L153 WeakPolarHBondContact O-CG 3.38Å; T149-L153 PolarHBondContact O-N 2.96Å; W150-L153 PolarHBondContact O-N 3.39Å; L153-V156 PolarHBondContact O-N 2.68Å; L153-F157 WeakPolarHBondContact O-CB 3.49Å; L153-F157 PolarHBondContact O-N 3.36Å
154W96.8Very high93.6Very high34 Ų3467.6 Ų67.613%0.12933%0.333CS..Hα-helixtrans-68.5-34.3174.5-79.6108.9000113Y124 V127 W150 F152 F157 W158 M187Y124-W154 AromaticContact CD2-CH2 3.54Å; Y124-W154 HydrophobicContact CD2-CH2 3.54Å; Y124-W154 HydrophobicContact CD2-CZ3 4.07Å; Y124-W154 AromaticContact CE2-CH2 3.34Å; Y124-W154 HydrophobicContact CE2-CH2 3.34Å; Y124-W154 HydrophobicContact CE2-CZ2 4.26Å; Y124-W154 HydrophobicContact CE2-CZ3 4.12Å; Y124-W154 HydrophobicContact CG-CH2 4.27Å; Y124-W154 AromaticContact CZ-CH2 3.89Å; V127-W154 HydrophobicContact CG1-CD2 4.13Å; V127-W154 HydrophobicContact CG1-CG 4.47Å; V127-W154 HydrophobicContact CG1-CZ2 4.08Å; W150-W154 AromaticContact CD1-CD1 3.69Å; W150-W154 AromaticContact CD1-NE1 3.66Å; W150-W154 AromaticContact CD2-CD1 3.65Å; W150-W154 AromaticContact CE2-CD1 3.34Å; W150-W154 AromaticContact CE2-NE1 3.59Å; W150-W154 AromaticContact CG-CD1 3.84Å; W150-W154 AromaticContact CZ2-CD1 3.81Å; W150-W154 HydrophobicContact CZ2-CG 4.46Å; W150-W154 AromaticContact NE1-CD1 3.39Å; W150-W154 AromaticContact NE1-NE1 3.2Å; W150-W154 VanDerWaalsContact NE1-NE1 3.2Å; W150-W154 WeakPolarHBondContact O-CB 3.11Å; W150-W154 VanDerWaalsContact O-CD1 3.23Å; W150-W154 PolarHBondContact O-N 3.22Å; W150-W154 VanDerWaalsContact O-N 3.08Å; F152-W154 PolarHBondContact O-N 3.48Å; W154-F157 HydrophobicContact CE3-CB 4.25Å; W154-F157 AromaticContact CE3-CD1 3.89Å; W154-F157 HydrophobicContact CE3-CD1 3.89Å; W154-F157 HydrophobicContact CE3-CG 4.11Å; W154-F157 AromaticContact CZ3-CD1 3.84Å; W154-F157 HydrophobicContact CZ3-CD1 3.84Å; W154-F157 HydrophobicContact CZ3-CE1 4.06Å; W154-F157 HydrophobicContact CZ3-CG 4.1Å; W154-F157 WeakPolarHBondContact O-CB 3.41Å; W154-F157 PolarHBondContact O-N 2.53Å; W154-W158 PolarHBondContact O-N 2.95Å; W154-M187 HydrophobicContact CZ3-CE 4.27Å
155S97.2Very high94.3Very high59 Ų5964.3 Ų64.341%0.41331%0.313SS..Hα-helixtrans-64.3-45.4173.4-60.30000111.1S151 F152 F157 W158 I159S151-S155 VanDerWaalsContact O-CB 3.3Å; S151-S155 WeakPolarHBondContact O-CB 3.27Å; S151-S155 PolarHBondContact O-N 2.88Å; S151-S155 PolarHBondContact O-OG 2.89Å; F152-S155 WeakPolarHBondContact O-CB 3.38Å; F152-S155 PolarHBondContact O-N 3.49Å; F152-S155 VanDerWaalsContact O-N 3.17Å; S155-F157 VanDerWaalsContact C-N 3.33Å; S155-F157 PolarHBondContact O-N 3.48Å; S155-W158 PolarHBondContact O-N 3.29Å; S155-I159 VanDerWaalsContact O-CG1 3.27Å; S155-I159 WeakPolarHBondContact O-CG1 3.13Å; S155-I159 PolarHBondContact O-N 3.41Å
156V96.6Very high95Very high46 Ų4663.4 Ų63.428%0.27931%0.308SS..Hα-helixtrans-59.8-43.9175.2172.20000110.9F152 L153 W158 I159 I160F152-V156 HydrophobicContact CD1-CG2 4.48Å; F152-V156 HydrophobicContact CD2-CG2 4.46Å; F152-V156 HydrophobicContact CE1-CG2 4.08Å; F152-V156 HydrophobicContact CE2-CG2 4.06Å; F152-V156 HydrophobicContact CZ-CG2 3.86Å; F152-V156 WeakPolarHBondContact O-CG2 3.49Å; F152-V156 PolarHBondContact O-N 3.33Å; L153-V156 PolarHBondContact O-N 2.68Å; V156-W158 PolarHBondContact O-N 2.97Å; V156-I159 PolarHBondContact O-N 3.11Å; V156-I160 HydrophobicContact CG1-CD1 3.82Å; V156-I160 WeakPolarHBondContact O-CG1 3.38Å; V156-I160 PolarHBondContact O-N 3.19Å
157F96.8Very high95.5Very high0 Ų060.6 Ų60.60%030%0.295CS..Hα-helixtrans-54-53.6174.8174.3-91.3000111.6W123 V127 L153 W154 S155 I159 I160 Q161 M187W123-F157 HydrophobicContact CB-CD2 3.75Å; W123-F157 HydrophobicContact CB-CE2 3.82Å; V127-F157 HydrophobicContact CG2-CB 4.18Å; V127-F157 HydrophobicContact CG2-CD2 4.45Å; L153-F157 WeakPolarHBondContact O-CB 3.49Å; L153-F157 PolarHBondContact O-N 3.36Å; W154-F157 HydrophobicContact CE3-CB 4.25Å; W154-F157 AromaticContact CE3-CD1 3.89Å; W154-F157 HydrophobicContact CE3-CD1 3.89Å; W154-F157 HydrophobicContact CE3-CG 4.11Å; W154-F157 AromaticContact CZ3-CD1 3.84Å; W154-F157 HydrophobicContact CZ3-CD1 3.84Å; W154-F157 HydrophobicContact CZ3-CE1 4.06Å; W154-F157 HydrophobicContact CZ3-CG 4.1Å; W154-F157 WeakPolarHBondContact O-CB 3.41Å; W154-F157 PolarHBondContact O-N 2.53Å; S155-F157 VanDerWaalsContact C-N 3.33Å; S155-F157 PolarHBondContact O-N 3.48Å; F157-I159 PolarHBondContact O-N 3.46Å; F157-I160 PolarHBondContact O-N 3.42Å; F157-Q161 HydrophobicContact CD1-CG 4.07Å; F157-Q161 HydrophobicContact CD2-CG 4.29Å; F157-Q161 HydrophobicContact CE1-CG 3.67Å; F157-Q161 HydrophobicContact CE2-CG 3.9Å; F157-Q161 HydrophobicContact CG-CG 4.36Å; F157-Q161 HydrophobicContact CZ-CG 3.57Å; F157-Q161 WeakPolarHBondContact O-CG 3.29Å; F157-Q161 PolarHBondContact O-N 2.89Å; F157-M187 HydrophobicContact CE1-CE 4.31Å; F157-M187 HydrophobicContact CE1-CG 4.5Å; F157-M187 HydrophobicContact CE1-SD 3.97Å; F157-M187 HydrophobicContact CZ-CG 3.98Å; F157-M187 HydrophobicContact CZ-SD 4.04Å
158W97.7Very high95.9Very high104 Ų10451.5 Ų51.539%0.39426%0.261SS..Hα-helixtrans-65.5-39.7-177.5-77.1117.3000112.8W154 S155 V156 I160 Q161 I162 V183 M187W154-W158 PolarHBondContact O-N 2.95Å; S155-W158 PolarHBondContact O-N 3.29Å; V156-W158 PolarHBondContact O-N 2.97Å; W158-I160 VanDerWaalsContact C-N 3.29Å; W158-I160 PolarHBondContact O-N 3.19Å; W158-Q161 PolarHBondContact O-N 3.14Å; W158-I162 VanDerWaalsContact O-CB 3.28Å; W158-I162 WeakPolarHBondContact O-CB 3.21Å; W158-I162 WeakPolarHBondContact O-CD1 3.42Å; W158-I162 WeakPolarHBondContact O-CG1 3.06Å; W158-I162 PolarHBondContact O-N 3.02Å; W158-V183 HydrophobicContact CH2-CG1 4.38Å; W158-V183 HydrophobicContact CZ3-CG1 4.05Å; W158-M187 HydrophobicContact CH2-CE 4.34Å; W158-M187 HydrophobicContact CH2-SD 3.81Å; W158-M187 HydrophobicContact CZ2-CE 4.09Å; W158-M187 HydrophobicContact CZ2-SD 4.15Å
159I97.1Very high96.2Very high110 Ų11046.4 Ų46.456%0.56423%0.234SC*.Hα-helixtrans-57.3-46.1175.1-70.6165.7000110.4S155 V156 F157 S163S155-I159 VanDerWaalsContact O-CG1 3.27Å; S155-I159 WeakPolarHBondContact O-CG1 3.13Å; S155-I159 PolarHBondContact O-N 3.41Å; V156-I159 PolarHBondContact O-N 3.11Å; F157-I159 PolarHBondContact O-N 3.46Å; I159-S163 VanDerWaalsContact O-CB 3.28Å; I159-S163 WeakPolarHBondContact O-CB 3.19Å; I159-S163 PolarHBondContact O-N 3.49Å; I159-S163 PolarHBondContact O-OG 2.72Å
160I95.4Very high96.5Very high22 Ų2244.8 Ų44.811%0.11322%0.224CC..Hα-helixtrans-67-48.1179.2-67.6172.7000110.7M29 V32 W123 V156 F157 W158 I162 S163 V164M29-I160 HydrophobicContact CE-CG2 4.22Å; V32-I160 HydrophobicContact CG1-CG2 4.42Å; W123-I160 HydrophobicContact CD2-CD1 4.28Å; W123-I160 HydrophobicContact CD2-CG2 4.38Å; W123-I160 HydrophobicContact CE3-CD1 3.8Å; W123-I160 HydrophobicContact CH2-CD1 3.24Å; W123-I160 HydrophobicContact CZ2-CD1 3.74Å; W123-I160 HydrophobicContact CZ2-CG2 4.34Å; W123-I160 HydrophobicContact CZ3-CD1 3.27Å; V156-I160 HydrophobicContact CG1-CD1 3.82Å; V156-I160 WeakPolarHBondContact O-CG1 3.38Å; V156-I160 PolarHBondContact O-N 3.19Å; F157-I160 PolarHBondContact O-N 3.42Å; W158-I160 VanDerWaalsContact C-N 3.29Å; W158-I160 PolarHBondContact O-N 3.19Å; I160-I162 PolarHBondContact O-N 3.25Å; I160-S163 PolarHBondContact O-N 3.35Å; I160-V164 HydrophobicContact CG2-CG2 4.35Å; I160-V164 VanDerWaalsContact O-CG2 3.3Å; I160-V164 WeakPolarHBondContact O-CG2 3.26Å; I160-V164 PolarHBondContact O-N 2.9Å
161Q96.9Very high96.5Very high1 Ų138.7 Ų38.71%0.00520%0.201CC..Hα-helixtrans-63.9-42.3-178.7-63.1-39.6-5100112.3S119 S120 F157 W158 S163 V164 C165 V183S119-Q161 PolarHBondContact OG-OE1 3.26Å; S120-Q161 VanDerWaalsContact N-OE1 3.16Å; F157-Q161 HydrophobicContact CD1-CG 4.07Å; F157-Q161 HydrophobicContact CD2-CG 4.29Å; F157-Q161 HydrophobicContact CE1-CG 3.67Å; F157-Q161 HydrophobicContact CE2-CG 3.9Å; F157-Q161 HydrophobicContact CG-CG 4.36Å; F157-Q161 HydrophobicContact CZ-CG 3.57Å; F157-Q161 WeakPolarHBondContact O-CG 3.29Å; F157-Q161 PolarHBondContact O-N 2.89Å; W158-Q161 PolarHBondContact O-N 3.14Å; Q161-S163 VanDerWaalsContact C-N 3.33Å; Q161-S163 PolarHBondContact O-N 3.43Å; Q161-V164 PolarHBondContact O-N 2.91Å; Q161-C165 WeakPolarHBondContact O-CB 3.31Å; Q161-C165 PolarHBondContact O-N 3.4Å; Q161-C165 PolarHBondContact O-SG 2.65Å; Q161-V183 HydrophobicContact CB-CG2 4.47Å
162I97.4Very high96.5Very high92 Ų9235.8 Ų35.847%0.47218%0.181SC..Hα-helixtrans-61.7-44.7175.8-69.5167.2000109.9W158 I160 V164 C165 I166W158-I162 VanDerWaalsContact O-CB 3.28Å; W158-I162 WeakPolarHBondContact O-CB 3.21Å; W158-I162 WeakPolarHBondContact O-CD1 3.42Å; W158-I162 WeakPolarHBondContact O-CG1 3.06Å; W158-I162 PolarHBondContact O-N 3.02Å; I160-I162 PolarHBondContact O-N 3.25Å; I162-V164 PolarHBondContact O-N 2.85Å; I162-C165 WeakPolarHBondContact O-CB 3.27Å; I162-C165 PolarHBondContact O-N 2.85Å; I162-I166 HydrophobicContact CG2-CD1 3.66Å; I162-I166 HydrophobicContact CG2-CG1 4.27Å; I162-I166 VanDerWaalsContact O-CG1 3.32Å; I162-I166 WeakPolarHBondContact O-CG1 3.24Å; I162-I166 PolarHBondContact O-N 3.29Å
163S96.6Very high96.4Very high20 Ų2029.4 Ų29.414%0.1415%0.153CC..Hα-helixtrans-63.4-42.2178.7-60.10000112.6I159 I160 Q161 S167I159-S163 VanDerWaalsContact O-CB 3.28Å; I159-S163 WeakPolarHBondContact O-CB 3.19Å; I159-S163 PolarHBondContact O-N 3.49Å; I159-S163 PolarHBondContact O-OG 2.72Å; I160-S163 PolarHBondContact O-N 3.35Å; Q161-S163 VanDerWaalsContact C-N 3.33Å; Q161-S163 PolarHBondContact O-N 3.43Å; S163-S167 VanDerWaalsContact O-CB 3.24Å; S163-S167 WeakPolarHBondContact O-CB 3.27Å; S163-S167 PolarHBondContact O-N 2.69Å
164V96.8Very high96.4Very high0 Ų027.7 Ų27.70%014%0.144CC..Hα-helixtrans-61.2-45.9172.9172.40000110.1M29 I160 Q161 I162 S167 R168M29-V164 HydrophobicContact CE-CG2 4.35Å; I160-V164 HydrophobicContact CG2-CG2 4.35Å; I160-V164 VanDerWaalsContact O-CG2 3.3Å; I160-V164 WeakPolarHBondContact O-CG2 3.26Å; I160-V164 PolarHBondContact O-N 2.9Å; Q161-V164 PolarHBondContact O-N 2.91Å; I162-V164 PolarHBondContact O-N 2.85Å; V164-S167 WeakPolarHBondContact O-CB 3.48Å; V164-S167 PolarHBondContact O-N 3.45Å; V164-R168 HydrophobicContact CG1-CG 4.45Å; V164-R168 WeakPolarHBondContact O-CG 3.45Å; V164-R168 PolarHBondContact O-N 3.19Å
165C97.4Very high96.4Very high18 Ų1826.1 Ų26.112%0.12214%0.138CC..Hα-helixtrans-61.5-50179.5-70.70000112.2Q161 I162 S167 R168 V169 V179 V183Q161-C165 WeakPolarHBondContact O-CB 3.31Å; Q161-C165 PolarHBondContact O-N 3.4Å; Q161-C165 PolarHBondContact O-SG 2.65Å; I162-C165 WeakPolarHBondContact O-CB 3.27Å; I162-C165 PolarHBondContact O-N 2.85Å; C165-S167 VanDerWaalsContact C-N 3.26Å; C165-S167 PolarHBondContact O-N 3.01Å; C165-R168 PolarHBondContact O-N 3.49Å; C165-V169 WeakPolarHBondContact O-CG2 3.29Å; C165-V169 PolarHBondContact O-N 3.38Å; C165-V169 VanDerWaalsContact O-N 3.09Å; C165-V179 HydrophobicContact CB-CB 4.03Å; C165-V179 HydrophobicContact CB-CG2 3.82Å; C165-V183 VanDerWaalsContact SG-CG2 3.53Å
166I97.3Very high96.4Very high67 Ų6724.5 Ų24.534%0.34413%0.126SC..Hα-helixtrans-58.5-43.8177.1-67.9170000109.7L15 L26 I162 R168 V169 F170L15-I166 HydrophobicContact CD1-CG2 4.37Å; L15-I166 HydrophobicContact CD2-CG2 4.18Å; L26-I166 HydrophobicContact CD2-CG2 3.86Å; I162-I166 HydrophobicContact CG2-CD1 3.66Å; I162-I166 HydrophobicContact CG2-CG1 4.27Å; I162-I166 VanDerWaalsContact O-CG1 3.32Å; I162-I166 WeakPolarHBondContact O-CG1 3.24Å; I162-I166 PolarHBondContact O-N 3.29Å; I166-R168 PolarHBondContact O-N 3.3Å; I166-V169 PolarHBondContact O-N 3.22Å; I166-F170 VanDerWaalsContact O-CB 3.32Å; I166-F170 WeakPolarHBondContact O-CB 3.5Å; I166-F170 PolarHBondContact O-N 3.28Å
167S97.2Very high96.3Very high0 Ų024.5 Ų24.50%012%0.123CC..Hα-helixtrans-57-49.6176.4171.90000112.4L26 S30 S163 V164 C165 V169 F170 I171L26-S167 WeakPolarHBondContact O-CB 3.37Å; L26-S167 PolarHBondContact O-OG 3.08Å; S30-S167 WeakPolarHBondContact CB-OG 3.31Å; S30-S167 PolarHBondContact N-OG 3.1Å; S30-S167 PolarHBondContact OG-OG 3.19Å; S163-S167 VanDerWaalsContact O-CB 3.24Å; S163-S167 WeakPolarHBondContact O-CB 3.27Å; S163-S167 PolarHBondContact O-N 2.69Å; V164-S167 WeakPolarHBondContact O-CB 3.48Å; V164-S167 PolarHBondContact O-N 3.45Å; C165-S167 VanDerWaalsContact C-N 3.26Å; C165-S167 PolarHBondContact O-N 3.01Å; S167-V169 VanDerWaalsContact C-N 3.27Å; S167-V169 PolarHBondContact O-N 3.12Å; S167-F170 PolarHBondContact O-N 3.45Å; S167-I171 WeakPolarHBondContact O-CG1 3.22Å; S167-I171 PolarHBondContact O-N 3.41Å; S167-I171 VanDerWaalsContact O-N 3.08Å
168R96.4Very high96.4Very high3 Ų324.5 Ų24.51%0.01112%0.123CC..Hα-helixtrans-63.5-31179.6-62.9-41-72173.2-3.1113.5S30 E106 H115 V164 C165 I166 I171 T173 H174 V179S30-R168 VanDerWaalsContact OG-CD 3.31Å; S30-R168 WeakPolarHBondContact OG-CD 3.42Å; S30-R168 PolarHBondContact OG-NH1 2.88Å; E106-R168 IonicContact OE1-CZ 3.77Å; E106-R168 IonicContact OE1-NH2 2.61Å; E106-R168 PolarHBondContact OE1-NH2 2.93Å; H115-R168 HydrophobicContact CB-CG 4.11Å; H115-R168 PolarHBondContact CE1-NH2 2.97Å; V164-R168 HydrophobicContact CG1-CG 4.45Å; V164-R168 WeakPolarHBondContact O-CG 3.45Å; V164-R168 PolarHBondContact O-N 3.19Å; C165-R168 PolarHBondContact O-N 3.49Å; I166-R168 PolarHBondContact O-N 3.3Å; R168-I171 VanDerWaalsContact CZ-CD1 3.5Å; R168-T173 PolarHBondContact O-N 3.13Å; R168-H174 HydrophobicContact CB-CB 4.4Å; R168-H174 PolarHBondContact O-N 2.88Å; R168-V179 HydrophobicContact CB-CG1 3.86Å
169V97.1Very high96.3Very high6 Ų619.8 Ų19.84%0.03611%0.105CC..Hα-helixtrans-75.2-45.9174.8177.80000110I11 I12 L15 C165 I166 S167 I171 A172 P176 V179I11-V169 HydrophobicContact CG2-CG1 4.24Å; I12-V169 HydrophobicContact CD1-CG1 4.48Å; I12-V169 HydrophobicContact CG1-CG1 3.51Å; I12-V169 WeakPolarHBondContact CG1-O 3.4Å; L15-V169 HydrophobicContact CD1-CB 4.17Å; L15-V169 HydrophobicContact CD1-CG1 3.7Å; C165-V169 WeakPolarHBondContact O-CG2 3.29Å; C165-V169 PolarHBondContact O-N 3.38Å; C165-V169 VanDerWaalsContact O-N 3.09Å; I166-V169 PolarHBondContact O-N 3.22Å; S167-V169 VanDerWaalsContact C-N 3.27Å; S167-V169 PolarHBondContact O-N 3.12Å; V169-I171 VanDerWaalsContact C-N 3.33Å; V169-I171 PolarHBondContact O-N 3.25Å; V169-A172 WeakPolarHBondContact O-CA 3.13Å; V169-A172 PolarHBondContact O-N 3.45Å; V169-P176 HydrophobicContact CG1-CG 4.2Å; V169-P176 HydrophobicContact CG2-CG 4.32Å; V169-V179 HydrophobicContact CG2-CG1 4.31Å; V169-V179 HydrophobicContact CG2-CG2 3.95Å
170F96.3Very high96.3Very high0 Ų018.9 Ų18.90%010%0.101CC..Hα-helixtrans-56.3-43178.9175.2-90.1000112.8L15 Q16 Q23 L26 F101 I166 S167 A172L15-F170 HydrophobicContact CB-CD2 4.16Å; L15-F170 WeakPolarHBondContact O-CE2 3.48Å; Q16-F170 HydrophobicContact CG-CD2 4.3Å; Q16-F170 HydrophobicContact CG-CE2 4.36Å; Q16-F170 WeakPolarHBondContact CG-O 3.19Å; Q16-F170 PolarHBondContact NE2-O 3.22Å; Q23-F170 HydrophobicContact CB-CE1 4.29Å; Q23-F170 HydrophobicContact CB-CZ 4.15Å; Q23-F170 HydrophobicContact CG-CE1 4.2Å; Q23-F170 HydrophobicContact CG-CZ 4.48Å; L26-F170 HydrophobicContact CB-CD1 4.28Å; L26-F170 HydrophobicContact CD1-CB 3.88Å; L26-F170 HydrophobicContact CD1-CD1 3.84Å; L26-F170 HydrophobicContact CD1-CD2 3.47Å; L26-F170 VanDerWaalsContact CD1-CD2 3.47Å; L26-F170 HydrophobicContact CD1-CE1 4.25Å; L26-F170 HydrophobicContact CD1-CE2 3.9Å; L26-F170 HydrophobicContact CD1-CG 3.45Å; L26-F170 VanDerWaalsContact CD1-CG 3.45Å; L26-F170 HydrophobicContact CD1-CZ 4.28Å; F101-F170 HydrophobicContact CE1-CE1 4.23Å; F101-F170 HydrophobicContact CE2-CD1 4.26Å; F101-F170 AromaticContact CE2-CE1 3.91Å; F101-F170 HydrophobicContact CE2-CE1 3.91Å; F101-F170 HydrophobicContact CZ-CD1 4.36Å; F101-F170 AromaticContact CZ-CE1 3.56Å; F101-F170 HydrophobicContact CZ-CE1 3.56Å; F101-F170 HydrophobicContact CZ-CZ 4.07Å; I166-F170 VanDerWaalsContact O-CB 3.32Å; I166-F170 WeakPolarHBondContact O-CB 3.5Å; I166-F170 PolarHBondContact O-N 3.28Å; S167-F170 PolarHBondContact O-N 3.45Å; F170-A172 PolarHBondContact O-N 3.39Å; F170-A172 VanDerWaalsContact O-N 3.16Å
171I94.1Very high96.4Very high0 Ų021.6 Ų21.60%012%0.115CC..THydrogen-bonded Turntrans-77.78.6178.264.9169.1000113.9F101 I103 T104 S167 R168 V169 T173F101-I171 HydrophobicContact CD2-CB 3.85Å; F101-I171 HydrophobicContact CD2-CG2 3.88Å; F101-I171 HydrophobicContact CE2-CB 4.49Å; F101-I171 HydrophobicContact CE2-CG2 4.4Å; F101-I171 HydrophobicContact CG-CG2 4.31Å; I103-I171 HydrophobicContact CD1-CD1 3.68Å; I103-I171 HydrophobicContact CD1-CG2 4.3Å; I103-I171 HydrophobicContact CG1-CD1 3.81Å; I103-I171 HydrophobicContact CG1-CG2 4.46Å; T104-I171 WeakPolarHBondContact CB-O 3.32Å; T104-I171 WeakPolarHBondContact CG2-O 3.48Å; T104-I171 PolarHBondContact OG1-O 2.96Å; S167-I171 WeakPolarHBondContact O-CG1 3.22Å; S167-I171 PolarHBondContact O-N 3.41Å; S167-I171 VanDerWaalsContact O-N 3.08Å; R168-I171 VanDerWaalsContact CZ-CD1 3.5Å; V169-I171 VanDerWaalsContact C-N 3.33Å; V169-I171 PolarHBondContact O-N 3.25Å; I171-T173 WeakPolarHBondContact CD1-OG1 3.48Å; I171-T173 VanDerWaalsContact CG1-OG1 3.26Å; I171-T173 WeakPolarHBondContact CG1-OG1 3.4Å; I171-T173 PolarHBondContact O-N 2.71Å; I171-T173 VanDerWaalsContact O-N 3.15Å; I171-T173 PolarHBondContact O-OG1 3.32Å
172A94.1Very high96.4Very high0 Ų021.5 Ų21.50%012%0.115CC..THydrogen-bonded Turntrans58.922.6179.600000115.5I12 P80 L98 V169 F170I12-A172 HydrophobicContact CG2-CB 4.1Å; P80-A172 HydrophobicContact CB-CB 4.42Å; P80-A172 WeakPolarHBondContact CD-O 3.49Å; P80-A172 WeakPolarHBondContact CG-O 2.83Å; L98-A172 HydrophobicContact CB-CB 4.17Å; L98-A172 HydrophobicContact CD1-CB 4.32Å; V169-A172 WeakPolarHBondContact O-CA 3.13Å; V169-A172 PolarHBondContact O-N 3.45Å; F170-A172 PolarHBondContact O-N 3.39Å; F170-A172 VanDerWaalsContact O-N 3.16Å
173T92.8Very high96.4Very high0 Ų017.6 Ų17.60%010%0.095CC..SBendtrans-86.4-27.3-179.4-54.70000112.7R79 T104 E106 R168 I171R79-T173 WeakPolarHBondContact CG-O 3.45Å; R79-T173 PolarHBondContact NH1-O 2.83Å; T104-T173 WeakPolarHBondContact CA-OG1 3.3Å; T104-T173 PolarHBondContact O-OG1 2.89Å; E106-T173 HydrophobicContact CB-CG2 4.35Å; E106-T173 HydrophobicContact CG-CG2 3.91Å; R168-T173 PolarHBondContact O-N 3.13Å; I171-T173 WeakPolarHBondContact CD1-OG1 3.48Å; I171-T173 VanDerWaalsContact CG1-OG1 3.26Å; I171-T173 WeakPolarHBondContact CG1-OG1 3.4Å; I171-T173 PolarHBondContact O-N 2.71Å; I171-T173 VanDerWaalsContact O-N 3.15Å; I171-T173 PolarHBondContact O-OG1 3.32Å
174H96.4Very high96.5Very high0 Ų022.2 Ų22.20%011%0.113CC..SBendtrans-141.2150.4-178.9-71-71.4000112.7R79 E106 G110 S113 R168 Q178 V179R79-H174 PolarHBondContact NH1-CE1 2.9Å; R79-H174 PolarHBondContact NH1-NE2 3.42Å; E106-H174 IonicContact OE2-NE2 3.89Å; G110-H174 PolarHBondContact O-CE1 3.31Å; G110-H174 PolarHBondContact O-ND1 3.34Å; S113-H174 PolarHBondContact OG-CD2 3.34Å; S113-H174 PolarHBondContact OG-NE2 2.88Å; R168-H174 HydrophobicContact CB-CB 4.4Å; R168-H174 PolarHBondContact O-N 2.88Å; H174-Q178 HydrophobicContact CB-CB 4.41Å; H174-Q178 PolarHBondContact ND1-OE1 3.4Å; H174-V179 HydrophobicContact CB-CG1 3.69Å
175F96.9Very high96.5Very high0 Ų022.9 Ų22.90%012%0.118CC..  trans-80156.9166.9-70-70.3000111.7H5 V9 I12 P80 W83 H177 Q178 V179H5-F175 HydrophobicContact CB-CE1 4.03Å; H5-F175 HydrophobicContact CB-CE2 4.34Å; H5-F175 HydrophobicContact CB-CZ 3.8Å; H5-F175 AromaticContact CD2-CD2 3.72Å; H5-F175 AromaticContact CD2-CE2 3.62Å; H5-F175 AromaticContact CD2-CZ 3.95Å; H5-F175 AromaticContact CG-CE2 3.82Å; H5-F175 AromaticContact CG-CZ 3.8Å; H5-F175 AromaticContact NE2-CD2 3.97Å; H5-F175 AromaticContact NE2-CE2 3.89Å; H5-F175 WeakPolarHBondContact O-CE1 3.38Å; V9-F175 HydrophobicContact CG2-CE1 3.98Å; I12-F175 HydrophobicContact CD1-CD1 4.4Å; P80-F175 HydrophobicContact CB-CD1 4.38Å; P80-F175 HydrophobicContact CB-CE1 3.93Å; P80-F175 HydrophobicContact CB-CE2 4.5Å; P80-F175 HydrophobicContact CB-CZ 4.01Å; P80-F175 HydrophobicContact CG-CD1 3.84Å; P80-F175 HydrophobicContact CG-CD2 4.06Å; P80-F175 HydrophobicContact CG-CE1 3.86Å; P80-F175 HydrophobicContact CG-CE2 4.08Å; P80-F175 HydrophobicContact CG-CG 3.96Å; P80-F175 HydrophobicContact CG-CZ 3.99Å; W83-F175 HydrophobicContact CB-CE2 4.43Å; W83-F175 HydrophobicContact CB-CZ 4.18Å; W83-F175 HydrophobicContact CD2-CZ 4.08Å; W83-F175 AromaticContact CE3-CZ 3.96Å; W83-F175 HydrophobicContact CE3-CZ 3.96Å; W83-F175 HydrophobicContact CG-CZ 4.18Å; F175-H177 VanDerWaalsContact C-N 3.33Å; F175-H177 WeakPolarHBondContact CB-CE1 3.37Å; F175-H177 WeakPolarHBondContact CB-ND1 3.11Å; F175-H177 AromaticContact CD2-CE1 3.99Å; F175-H177 AromaticContact CG-CE1 3.89Å; F175-H177 PolarHBondContact O-N 3.5Å; F175-Q178 HydrophobicContact CB-CG 4.13Å; F175-Q178 WeakPolarHBondContact O-CB 3.18Å; F175-Q178 PolarHBondContact O-N 2.9Å; F175-V179 PolarHBondContact O-N 3.14Å
176P96.9Very high96.4Very high26 Ų2622 Ų2217%0.16911%0.112CC..Hα-helixtrans-53.6-43.2179.3-29.436.2000114.3I11 V169 Q178 V179 I180I11-P176 HydrophobicContact CB-CG 4.38Å; I11-P176 HydrophobicContact CD1-CG 3.92Å; I11-P176 HydrophobicContact CG2-CG 4.15Å; V169-P176 HydrophobicContact CG1-CG 4.2Å; V169-P176 HydrophobicContact CG2-CG 4.32Å; P176-Q178 VanDerWaalsContact C-N 3.26Å; P176-Q178 PolarHBondContact O-N 2.98Å; P176-V179 WeakPolarHBondContact O-CG2 3.34Å; P176-V179 PolarHBondContact O-N 3.02Å; P176-I180 WeakPolarHBondContact O-CD1 3.45Å; P176-I180 VanDerWaalsContact O-CG1 3.24Å; P176-I180 WeakPolarHBondContact O-CG1 3.37Å; P176-I180 PolarHBondContact O-N 2.83Å; P176-I180 VanDerWaalsContact O-N 3.1Å
177H95.5Very high96.4Very high46 Ų4620.4 Ų20.421%0.21310%0.104CC..Hα-helixtrans-64.1-30.5178.969.1-87000112.9L4 H5 F175 L181L4-H177 HydrophobicContact CD2-CB 4.11Å; H5-H177 AromaticContact CD2-CE1 3.66Å; H5-H177 AromaticContact NE2-CE1 3.72Å; F175-H177 VanDerWaalsContact C-N 3.33Å; F175-H177 WeakPolarHBondContact CB-CE1 3.37Å; F175-H177 WeakPolarHBondContact CB-ND1 3.11Å; F175-H177 AromaticContact CD2-CE1 3.99Å; F175-H177 AromaticContact CG-CE1 3.89Å; F175-H177 PolarHBondContact O-N 3.5Å; H177-L181 VanDerWaalsContact O-CB 3.28Å; H177-L181 WeakPolarHBondContact O-CB 3.39Å; H177-L181 PolarHBondContact O-N 2.89Å
178Q97.1Very high96.3Very high0 Ų026.2 Ų26.20%013%0.134CC..Hα-helixtrans-73.6-36.1-178.9-60.3176.5-25.400112H78 G110 S113 H174 F175 P176 G182H78-Q178 PolarHBondContact O-NE2 3.02Å; G110-Q178 VanDerWaalsContact O-CD 3.24Å; G110-Q178 PolarHBondContact O-OE1 3.34Å; G110-Q178 VanDerWaalsContact O-OE1 3.12Å; S113-Q178 PolarHBondContact N-O 3.47Å; H174-Q178 HydrophobicContact CB-CB 4.41Å; H174-Q178 PolarHBondContact ND1-OE1 3.4Å; F175-Q178 HydrophobicContact CB-CG 4.13Å; F175-Q178 WeakPolarHBondContact O-CB 3.18Å; F175-Q178 PolarHBondContact O-N 2.9Å; P176-Q178 VanDerWaalsContact C-N 3.26Å; P176-Q178 PolarHBondContact O-N 2.98Å; Q178-G182 PolarHBondContact O-N 3.4Å; Q178-G182 VanDerWaalsContact O-N 3.07Å
179V97.4Very high96.2Very high4 Ų426.9 Ų26.92%0.02414%0.138CC..Hα-helixtrans-73.8-40.4176-620000111.1A116 C165 R168 V169 H174 F175 P176 G182 V183A116-V179 HydrophobicContact CB-CB 4.27Å; C165-V179 HydrophobicContact CB-CB 4.03Å; C165-V179 HydrophobicContact CB-CG2 3.82Å; R168-V179 HydrophobicContact CB-CG1 3.86Å; V169-V179 HydrophobicContact CG2-CG1 4.31Å; V169-V179 HydrophobicContact CG2-CG2 3.95Å; H174-V179 HydrophobicContact CB-CG1 3.69Å; F175-V179 PolarHBondContact O-N 3.14Å; P176-V179 WeakPolarHBondContact O-CG2 3.34Å; P176-V179 PolarHBondContact O-N 3.02Å; V179-G182 PolarHBondContact O-N 3.05Å; V179-V183 WeakPolarHBondContact O-CG2 3.33Å; V179-V183 PolarHBondContact O-N 2.98Å
180I97.1Very high96.1Very high92 Ų9226.6 Ų26.647%0.47214%0.137SC..Hα-helixtrans-60.5-49.6175-66.4167.3000110.5P176 G182 V183 F184P176-I180 WeakPolarHBondContact O-CD1 3.45Å; P176-I180 VanDerWaalsContact O-CG1 3.24Å; P176-I180 WeakPolarHBondContact O-CG1 3.37Å; P176-I180 PolarHBondContact O-N 2.83Å; P176-I180 VanDerWaalsContact O-N 3.1Å; I180-G182 VanDerWaalsContact C-N 3.25Å; I180-G182 PolarHBondContact O-N 2.85Å; I180-V183 PolarHBondContact O-N 3.3Å; I180-F184 HydrophobicContact CG2-CD2 3.73Å; I180-F184 HydrophobicContact CG2-CE2 3.53Å; I180-F184 VanDerWaalsContact O-CD2 3.26Å; I180-F184 WeakPolarHBondContact O-CD2 3.41Å; I180-F184 PolarHBondContact O-N 3.37Å; I180-F184 VanDerWaalsContact O-N 3.13Å
181L97Very high95.9Very high78 Ų7829.7 Ų29.741%0.40815%0.151SC..Hα-helixtrans-59.4-38.8176.3-177.762.3000111.7L75 P112 H177 A185L75-L181 HydrophobicContact CD1-CD2 3.95Å; P112-L181 HydrophobicContact CB-CB 4.31Å; P112-L181 HydrophobicContact CB-CD2 4.06Å; P112-L181 HydrophobicContact CB-CG 3.99Å; H177-L181 VanDerWaalsContact O-CB 3.28Å; H177-L181 WeakPolarHBondContact O-CB 3.39Å; H177-L181 PolarHBondContact O-N 2.89Å; L181-A185 VanDerWaalsContact O-CB 3.27Å; L181-A185 WeakPolarHBondContact O-CB 3.36Å; L181-A185 PolarHBondContact O-N 2.92Å
182G97Very high95.8Very high0 Ų032.2 Ų32.20%017%0.172CC..Hα-helixtrans-58.9-49.7174.800000112.6M117 Q178 V179 I180 F184 A185 G186M117-G182 WeakPolarHBondContact CA-O 3.41Å; M117-G182 WeakPolarHBondContact CB-O 3.27Å; Q178-G182 PolarHBondContact O-N 3.4Å; Q178-G182 VanDerWaalsContact O-N 3.07Å; V179-G182 PolarHBondContact O-N 3.05Å; I180-G182 VanDerWaalsContact C-N 3.25Å; I180-G182 PolarHBondContact O-N 2.85Å; G182-F184 PolarHBondContact O-N 3.44Å; G182-A185 PolarHBondContact O-N 2.87Å; G182-G186 PolarHBondContact O-N 3.35Å
183V97.8Very high95.5Very high9 Ų933.7 Ų33.76%0.05518%0.179CC..Hα-helixtrans-58.8-49.7178.71750000111.3A116 S120 W158 Q161 C165 V179 I180 A185 G186 M187A116-V183 HydrophobicContact CB-CG2 4.05Å; S120-V183 PolarHBondContact OG-O 3.47Å; W158-V183 HydrophobicContact CH2-CG1 4.38Å; W158-V183 HydrophobicContact CZ3-CG1 4.05Å; Q161-V183 HydrophobicContact CB-CG2 4.47Å; C165-V183 VanDerWaalsContact SG-CG2 3.53Å; V179-V183 WeakPolarHBondContact O-CG2 3.33Å; V179-V183 PolarHBondContact O-N 2.98Å; I180-V183 PolarHBondContact O-N 3.3Å; V183-A185 PolarHBondContact O-N 3.38Å; V183-G186 PolarHBondContact O-N 3.29Å; V183-M187 HydrophobicContact CG1-CG 4.43Å; V183-M187 HydrophobicContact CG1-SD 3.92Å; V183-M187 WeakPolarHBondContact O-CG 3.26Å; V183-M187 PolarHBondContact O-N 3.04Å
184F97.3Very high95.1Very high118 Ų11837.3 Ų37.352%0.51820%0.196SC..Hα-helixtrans-62.5-44.9179.8-76.1-64.7000112.3I180 G182 G186 M187 L188I180-F184 HydrophobicContact CG2-CD2 3.73Å; I180-F184 HydrophobicContact CG2-CE2 3.53Å; I180-F184 VanDerWaalsContact O-CD2 3.26Å; I180-F184 WeakPolarHBondContact O-CD2 3.41Å; I180-F184 PolarHBondContact O-N 3.37Å; I180-F184 VanDerWaalsContact O-N 3.13Å; G182-F184 PolarHBondContact O-N 3.44Å; F184-G186 VanDerWaalsContact C-N 3.31Å; F184-G186 PolarHBondContact O-N 3.41Å; F184-M187 PolarHBondContact O-N 3.39Å; F184-L188 WeakPolarHBondContact O-CB 3.22Å; F184-L188 VanDerWaalsContact O-CG 3.27Å; F184-L188 WeakPolarHBondContact O-CG 3.31Å; F184-L188 PolarHBondContact O-N 3.28Å
185A96.8Very high94.5Very high13 Ų1343.7 Ų43.711%0.10723%0.225CC..Hα-helixtrans-61.3-40.5177.500000111.9M117 L181 G182 V183 L188 V189M117-A185 HydrophobicContact CE-CB 3.83Å; M117-A185 HydrophobicContact CG-CB 4.35Å; M117-A185 HydrophobicContact SD-CB 3.9Å; L181-A185 VanDerWaalsContact O-CB 3.27Å; L181-A185 WeakPolarHBondContact O-CB 3.36Å; L181-A185 PolarHBondContact O-N 2.92Å; G182-A185 PolarHBondContact O-N 2.87Å; V183-A185 PolarHBondContact O-N 3.38Å; A185-L188 PolarHBondContact O-N 3.49Å; A185-V189 WeakPolarHBondContact O-CG2 3.29Å; A185-V189 PolarHBondContact O-N 2.93Å; A185-V189 VanDerWaalsContact O-N 3.07Å
186G96.2Very high93.6Very high0 Ų046.7 Ų46.70%024%0.243CC..Hα-helixtrans-65.8-44.3177.800000112.6C121 G182 V183 F184 L188 V189 A190C121-G186 PolarHBondContact SG-O 3.38Å; G182-G186 PolarHBondContact O-N 3.35Å; V183-G186 PolarHBondContact O-N 3.29Å; F184-G186 VanDerWaalsContact C-N 3.31Å; F184-G186 PolarHBondContact O-N 3.41Å; G186-L188 PolarHBondContact O-N 3.49Å; G186-V189 PolarHBondContact O-N 3.03Å; G186-A190 WeakPolarHBondContact O-CB 3.02Å; G186-A190 PolarHBondContact O-N 3.45Å
187M96.4Very high92.2Very high33 Ų3349.7 Ų49.716%0.16326%0.263CS..Hα-helixtrans-62-42.9175.3-67.8177.967.100112.1Y124 W154 F157 W158 V183 F184 V189 A190 E191Y124-M187 HydrophobicContact CD2-CB 4.06Å; Y124-M187 HydrophobicContact CD2-CE 4.05Å; Y124-M187 HydrophobicContact CD2-CG 3.91Å; Y124-M187 HydrophobicContact CE2-CB 4.24Å; Y124-M187 HydrophobicContact CE2-CE 3.85Å; Y124-M187 HydrophobicContact CE2-CG 4.41Å; W154-M187 HydrophobicContact CZ3-CE 4.27Å; F157-M187 HydrophobicContact CE1-CE 4.31Å; F157-M187 HydrophobicContact CE1-CG 4.5Å; F157-M187 HydrophobicContact CE1-SD 3.97Å; F157-M187 HydrophobicContact CZ-CG 3.98Å; F157-M187 HydrophobicContact CZ-SD 4.04Å; W158-M187 HydrophobicContact CH2-CE 4.34Å; W158-M187 HydrophobicContact CH2-SD 3.81Å; W158-M187 HydrophobicContact CZ2-CE 4.09Å; W158-M187 HydrophobicContact CZ2-SD 4.15Å; V183-M187 HydrophobicContact CG1-CG 4.43Å; V183-M187 HydrophobicContact CG1-SD 3.92Å; V183-M187 WeakPolarHBondContact O-CG 3.26Å; V183-M187 PolarHBondContact O-N 3.04Å; F184-M187 PolarHBondContact O-N 3.39Å; M187-V189 PolarHBondContact O-N 2.93Å; M187-A190 PolarHBondContact O-N 3.39Å; M187-E191 WeakPolarHBondContact O-CB 3.27Å; M187-E191 PolarHBondContact O-N 2.7Å
188L96.1Very high90.6Very high123 Ų12350.8 Ų50.864%0.64428%0.28SS*.Hα-helixtrans-62.3-42.7178.1-73.5171.3000112.1F184 A185 G186 A192F184-L188 WeakPolarHBondContact O-CB 3.22Å; F184-L188 VanDerWaalsContact O-CG 3.27Å; F184-L188 WeakPolarHBondContact O-CG 3.31Å; F184-L188 PolarHBondContact O-N 3.28Å; A185-L188 PolarHBondContact O-N 3.49Å; G186-L188 PolarHBondContact O-N 3.49Å; L188-A192 WeakPolarHBondContact O-CB 3.31Å; L188-A192 PolarHBondContact O-N 3.19Å
189V94.6Very high89.3Confident16 Ų1651.9 Ų51.910%0.09729%0.286CS..Hα-helixtrans-63.3-46.6175.3172.60000110.4F67 M117 A185 G186 M187 E191 A192 F193F67-V189 HydrophobicContact CD2-CG2 4.03Å; M117-V189 HydrophobicContact CE-CG2 4.06Å; A185-V189 WeakPolarHBondContact O-CG2 3.29Å; A185-V189 PolarHBondContact O-N 2.93Å; A185-V189 VanDerWaalsContact O-N 3.07Å; G186-V189 PolarHBondContact O-N 3.03Å; M187-V189 PolarHBondContact O-N 2.93Å; V189-E191 PolarHBondContact O-N 3.2Å; V189-A192 PolarHBondContact O-N 3.39Å; V189-F193 HydrophobicContact CG1-CD2 4.21Å; V189-F193 HydrophobicContact CG1-CE2 4.25Å; V189-F193 WeakPolarHBondContact O-CD2 3.39Å; V189-F193 PolarHBondContact O-N 3.45Å
190A93.9Very high87.8Confident0 Ų056.3 Ų56.30%031%0.306CS..Hα-helixtrans-61.3-42.9179.300000112.6V60 C121 Y124 V125 G186 M187 F193 E194V60-A190 HydrophobicContact CG1-CB 4.14Å; C121-A190 WeakPolarHBondContact O-CB 3.41Å; Y124-A190 HydrophobicContact CD1-CB 3.59Å; Y124-A190 HydrophobicContact CE1-CB 4.4Å; Y124-A190 HydrophobicContact CG-CB 3.75Å; V125-A190 HydrophobicContact CG2-CB 4.2Å; G186-A190 WeakPolarHBondContact O-CB 3.02Å; G186-A190 PolarHBondContact O-N 3.45Å; M187-A190 PolarHBondContact O-N 3.39Å; A190-F193 PolarHBondContact O-N 3.37Å; A190-E194 PolarHBondContact O-N 3.48Å; A190-E194 VanDerWaalsContact O-N 3.07Å
191E93.4Very high86.5Confident65 Ų6557.9 Ų57.930%0.30432%0.321SS..Hα-helixtrans-64.7-43.9177.7-176.861.7-164.600111.8Y124 M187 V189 F193 E194 H195Y124-E191 HydrophobicContact CE1-CB 4.33Å; Y124-E191 VanDerWaalsContact CE1-OE2 3.32Å; Y124-E191 WeakPolarHBondContact CE1-OE2 3.27Å; Y124-E191 VanDerWaalsContact CZ-OE2 3.25Å; Y124-E191 PolarHBondContact OH-OE2 3.01Å; M187-E191 WeakPolarHBondContact O-CB 3.27Å; M187-E191 PolarHBondContact O-N 2.7Å; V189-E191 PolarHBondContact O-N 3.2Å; E191-F193 PolarHBondContact O-N 2.95Å; E191-E194 VanDerWaalsContact O-CB 3.28Å; E191-E194 WeakPolarHBondContact O-CB 3.27Å; E191-E194 PolarHBondContact O-N 3.37Å; E191-H195 PolarHBondContact O-CD2 3.04Å; E191-H195 VanDerWaalsContact O-CD2 3.24Å; E191-H195 PolarHBondContact O-N 2.93Å; E191-H195 IonicContact OE1-CD2 3.85Å; E191-H195 IonicContact OE1-CE1 2.77Å; E191-H195 IonicContact OE1-NE2 2.6Å; E191-H195 PolarHBondContact OE1-NE2 2.9Å
192A91.5Very high85.7Confident54 Ų5454.9 Ų54.945%0.44631%0.307SS..Hα-helixtrans-57.9-35176.100000112.5L188 V189 T196L188-A192 WeakPolarHBondContact O-CB 3.31Å; L188-A192 PolarHBondContact O-N 3.19Å; V189-A192 PolarHBondContact O-N 3.39Å; A192-T196 PolarHBondContact O-OG1 3.32Å
193F87.4Confident85.2Confident30 Ų3057.9 Ų57.913%0.13233%0.328CS..Hα-helixtrans-80.1-19.3177-83.8-110.2000113.5K56 W59 V60 I63 V189 A190 E191 H195 T196 I199K56-F193 WeakPolarHBondContact CE-O 3.32Å; W59-F193 HydrophobicContact CB-CD1 4.26Å; W59-F193 HydrophobicContact CB-CE1 4.03Å; W59-F193 HydrophobicContact CE3-CE1 4.28Å; V60-F193 HydrophobicContact CG2-CB 3.39Å; V60-F193 HydrophobicContact CG2-CD1 3.67Å; V60-F193 HydrophobicContact CG2-CD2 4.37Å; V60-F193 HydrophobicContact CG2-CG 3.56Å; I63-F193 HydrophobicContact CB-CE2 4.17Å; I63-F193 HydrophobicContact CB-CZ 3.77Å; I63-F193 HydrophobicContact CG1-CE1 4.25Å; I63-F193 HydrophobicContact CG1-CZ 3.69Å; I63-F193 HydrophobicContact CG2-CE2 3.78Å; I63-F193 HydrophobicContact CG2-CZ 3.71Å; V189-F193 HydrophobicContact CG1-CD2 4.21Å; V189-F193 HydrophobicContact CG1-CE2 4.25Å; V189-F193 WeakPolarHBondContact O-CD2 3.39Å; V189-F193 PolarHBondContact O-N 3.45Å; A190-F193 PolarHBondContact O-N 3.37Å; E191-F193 PolarHBondContact O-N 2.95Å; F193-H195 VanDerWaalsContact C-N 3.29Å; F193-T196 PolarHBondContact O-N 3.17Å; F193-I199 HydrophobicContact CD1-CD1 3.22Å; F193-I199 HydrophobicContact CE1-CD1 3.3Å; F193-I199 HydrophobicContact CG-CD1 4.18Å; F193-I199 HydrophobicContact CZ-CD1 4.3Å
194E84.8Confident84.8Confident76 Ų7660 Ų6036%0.35534%0.339SS..Hα-helixtrans-63.2-39168.6-163.667.6-106.500111K56 T128 A190 E191 T196K56-E194 IonicContact NZ-OE1 2.62Å; K56-E194 PolarHBondContact NZ-OE1 3.13Å; K56-E194 IonicContact NZ-OE2 2.83Å; K56-E194 PolarHBondContact NZ-OE2 3.39Å; T128-E194 WeakPolarHBondContact CB-OE2 3.4Å; T128-E194 PolarHBondContact OG1-OE2 2.98Å; A190-E194 PolarHBondContact O-N 3.48Å; A190-E194 VanDerWaalsContact O-N 3.07Å; E191-E194 VanDerWaalsContact O-CB 3.28Å; E191-E194 WeakPolarHBondContact O-CB 3.27Å; E191-E194 PolarHBondContact O-N 3.37Å; E194-T196 VanDerWaalsContact C-N 3.27Å; E194-T196 PolarHBondContact O-N 2.96Å
195H82.3Confident84.5Confident134 Ų13464 Ų6462%0.6235%0.35SS*.THydrogen-bonded Turntrans-84.77179.5-62.2-69.7000114.3E191 F193 P197E191-H195 PolarHBondContact O-CD2 3.04Å; E191-H195 VanDerWaalsContact O-CD2 3.24Å; E191-H195 PolarHBondContact O-N 2.93Å; E191-H195 IonicContact OE1-CD2 3.85Å; E191-H195 IonicContact OE1-CE1 2.77Å; E191-H195 IonicContact OE1-NE2 2.6Å; E191-H195 PolarHBondContact OE1-NE2 2.9Å; F193-H195 VanDerWaalsContact C-N 3.29Å; H195-P197 VanDerWaalsContact O-CD 3.3Å; H195-P197 WeakPolarHBondContact O-CD 3.2Å
196T78.8Confident84.2Confident63 Ų6367.5 Ų67.539%0.38737%0.365SS..  trans-120.675.6-177-510000112.1A192 F193 E194 A198 I199A192-T196 PolarHBondContact O-OG1 3.32Å; F193-T196 PolarHBondContact O-N 3.17Å; E194-T196 VanDerWaalsContact C-N 3.27Å; E194-T196 PolarHBondContact O-N 2.96Å; T196-A198 PolarHBondContact O-N 3.35Å; T196-I199 HydrophobicContact CG2-CD1 3.77Å; T196-I199 HydrophobicContact CG2-CG1 4.02Å
197P66.8Low84Confident89 Ų8967.6 Ų67.658%0.57837%0.366SS*.G310 helixtrans-68.2-18.8-176.926.1-33.9000114H195 I199 Q200H195-P197 VanDerWaalsContact O-CD 3.3Å; H195-P197 WeakPolarHBondContact O-CD 3.2Å; P197-I199 PolarHBondContact O-N 3.3Å; P197-Q200 WeakPolarHBondContact O-CB 3.26Å; P197-Q200 WeakPolarHBondContact O-CG 3.1Å; P197-Q200 PolarHBondContact O-N 2.94Å; P197-Q200 VanDerWaalsContact O-N 3.11Å
198A62.5Low83.8Confident70 Ų7069.2 Ų69.258%0.57937%0.374SS*.G310 helixtrans-58.8-18.3-178.200000114.4T196 Q200T196-A198 PolarHBondContact O-N 3.35Å; A198-Q200 VanDerWaalsContact C-N 3.28Å; A198-Q200 PolarHBondContact O-N 2.93Å
199I70.6Confident83.7Confident23 Ų2370.2 Ų70.212%0.11837%0.373CS..G310 helixtrans-70.8-26.6-179.4-65.9165.7000111.8W59 F193 T196 P197 T201 A202W59-I199 HydrophobicContact CB-CG2 3.99Å; W59-I199 HydrophobicContact CD2-CG2 3.51Å; W59-I199 HydrophobicContact CE3-CG2 4.27Å; W59-I199 HydrophobicContact CG-CG2 3.33Å; W59-I199 HydrophobicContact CZ2-CG2 4.39Å; F193-I199 HydrophobicContact CD1-CD1 3.22Å; F193-I199 HydrophobicContact CE1-CD1 3.3Å; F193-I199 HydrophobicContact CG-CD1 4.18Å; F193-I199 HydrophobicContact CZ-CD1 4.3Å; T196-I199 HydrophobicContact CG2-CD1 3.77Å; T196-I199 HydrophobicContact CG2-CG1 4.02Å; P197-I199 PolarHBondContact O-N 3.3Å; I199-T201 VanDerWaalsContact C-N 3.33Å; I199-T201 PolarHBondContact O-N 2.8Å; I199-A202 WeakPolarHBondContact O-CB 3.42Å
200Q66.2Low83.6Confident96 Ų9671.1 Ų71.145%0.44938%0.377SS..G310 helixtrans-73.8-25.6-174.5-56.4177.32.400112.8V52 P197 A198V52-Q200 HydrophobicContact CG1-CB 4.36Å; V52-Q200 HydrophobicContact CG1-CG 3.69Å; V52-Q200 VanDerWaalsContact CG1-OE1 3.29Å; P197-Q200 WeakPolarHBondContact O-CB 3.26Å; P197-Q200 WeakPolarHBondContact O-CG 3.1Å; P197-Q200 PolarHBondContact O-N 2.94Å; P197-Q200 VanDerWaalsContact O-N 3.11Å; A198-Q200 VanDerWaalsContact C-N 3.28Å; A198-Q200 PolarHBondContact O-N 2.93Å
201T69Low83.7Confident126 Ų12671.8 Ų71.877%0.77338%0.381SS*.G310 helixtrans-110.817.4-17953.80000112.7I199 S203I199-T201 VanDerWaalsContact C-N 3.33Å; I199-T201 PolarHBondContact O-N 2.8Å; T201-S203 PolarHBondContact O-N 3.47Å
202A80.5Confident83.7Confident15 Ų1573.2 Ų73.212%0.12439%0.39CS..  trans-61.8126.3-177.300000112W59 I199 M206 Y207W59-A202 HydrophobicContact CZ2-CB 4.49Å; I199-A202 WeakPolarHBondContact O-CB 3.42Å; A202-M206 HydrophobicContact CB-CB 4.23Å; A202-M206 HydrophobicContact CB-CG 4.23Å; A202-Y207 HydrophobicContact CB-CD2 4.2Å; A202-Y207 HydrophobicContact CB-CE2 3.71Å; A202-Y207 WeakPolarHBondContact O-CE2 3.39Å
203S86.9Confident83.9Confident63 Ų6376 Ų7644%0.44139%0.392SS..  trans-69.6158172.766.80000111.6T201 R205 M206 Y207T201-S203 PolarHBondContact O-N 3.47Å; S203-R205 PolarHBondContact O-N 3.37Å; S203-R205 VanDerWaalsContact O-N 3.11Å; S203-M206 WeakPolarHBondContact O-CA 3.27Å; S203-M206 VanDerWaalsContact O-CB 3.32Å; S203-M206 WeakPolarHBondContact O-CB 3.3Å; S203-M206 PolarHBondContact O-N 3.28Å; S203-Y207 WeakPolarHBondContact O-CD2 3.32Å; S203-Y207 PolarHBondContact O-N 3.48Å
204L89.4Confident84.3Confident53 Ų5374.8 Ų74.828%0.27739%0.388SS..Hα-helixtrans-51.5-36.7174.4-177.963.2000112.9M206 Y207 I208 L271 N274L204-M206 VanDerWaalsContact C-N 3.27Å; L204-M206 PolarHBondContact O-N 3.5Å; L204-Y207 PolarHBondContact O-N 3.02Å; L204-I208 HydrophobicContact CD1-CD1 4.46Å; L204-I208 HydrophobicContact CG-CD1 4.04Å; L204-I208 WeakPolarHBondContact O-CG1 3.15Å; L204-I208 PolarHBondContact O-N 3.03Å; L204-L271 HydrophobicContact CD1-CD2 3.98Å; L204-L271 HydrophobicContact CD2-CD2 4.33Å; L204-N274 HydrophobicContact CB-CB 4.06Å; L204-N274 PolarHBondContact N-OD1 3.38Å
205R89.7Confident84.8Confident201 Ų20175.4 Ų75.476%0.75839%0.389SS*.Hα-helixtrans-60.1-37.1176.1-66.9-177.5-177.2171.80.7112.1S203 K209S203-R205 PolarHBondContact O-N 3.37Å; S203-R205 VanDerWaalsContact O-N 3.11Å; R205-K209 WeakPolarHBondContact O-CB 3.32Å; R205-K209 VanDerWaalsContact O-CG 3.29Å; R205-K209 WeakPolarHBondContact O-CG 3.49Å; R205-K209 PolarHBondContact O-N 3.5Å
206M90.4Very high85.4Confident87 Ų8774.2 Ų74.243%0.42939%0.386SS..Hα-helixtrans-68.1-44.1176.8-173.361.2176.900111.2A202 S203 L204 I208 K209 I210A202-M206 HydrophobicContact CB-CB 4.23Å; A202-M206 HydrophobicContact CB-CG 4.23Å; S203-M206 WeakPolarHBondContact O-CA 3.27Å; S203-M206 VanDerWaalsContact O-CB 3.32Å; S203-M206 WeakPolarHBondContact O-CB 3.3Å; S203-M206 PolarHBondContact O-N 3.28Å; L204-M206 VanDerWaalsContact C-N 3.27Å; L204-M206 PolarHBondContact O-N 3.5Å; M206-I208 VanDerWaalsContact C-N 3.33Å; M206-I208 PolarHBondContact O-N 3Å; M206-K209 PolarHBondContact O-N 2.86Å; M206-I210 HydrophobicContact CE-CD1 3.84Å; M206-I210 HydrophobicContact CE-CG1 3.87Å; M206-I210 HydrophobicContact CG-CG1 4.47Å; M206-I210 WeakPolarHBondContact O-CG1 3.23Å; M206-I210 PolarHBondContact O-N 3.46Å; M206-I210 HydrophobicContact SD-CG1 4.27Å
207Y92.2Very high86.2Confident2 Ų275.4 Ų75.41%0.00839%0.386CS..Hα-helixtrans-57.6-44.9174.5-78.7-89000112W59 A202 S203 L204 N211 L266 L269W59-Y207 AromaticContact CE2-CE1 3.46Å; W59-Y207 VanDerWaalsContact CE2-CE1 3.46Å; W59-Y207 AromaticContact CE2-CZ 3.79Å; W59-Y207 HydrophobicContact CH2-CD1 4.45Å; W59-Y207 AromaticContact CZ2-CD1 3.62Å; W59-Y207 HydrophobicContact CZ2-CD1 3.62Å; W59-Y207 HydrophobicContact CZ2-CD2 4.48Å; W59-Y207 AromaticContact CZ2-CE1 3.35Å; W59-Y207 HydrophobicContact CZ2-CE1 3.35Å; W59-Y207 HydrophobicContact CZ2-CE2 4.26Å; W59-Y207 HydrophobicContact CZ2-CG 4.18Å; W59-Y207 AromaticContact CZ2-CZ 3.7Å; W59-Y207 AromaticContact NE1-CE1 3.23Å; W59-Y207 AromaticContact NE1-CZ 3.31Å; W59-Y207 VanDerWaalsContact NE1-CZ 3.31Å; W59-Y207 PolarHBondContact NE1-OH 3.45Å; A202-Y207 HydrophobicContact CB-CD2 4.2Å; A202-Y207 HydrophobicContact CB-CE2 3.71Å; A202-Y207 WeakPolarHBondContact O-CE2 3.39Å; S203-Y207 WeakPolarHBondContact O-CD2 3.32Å; S203-Y207 PolarHBondContact O-N 3.48Å; L204-Y207 PolarHBondContact O-N 3.02Å; Y207-N211 WeakPolarHBondContact O-CB 3.5Å; Y207-N211 PolarHBondContact O-N 2.82Å; Y207-N211 PolarHBondContact O-ND2 3.18Å; Y207-L266 HydrophobicContact CD1-CD1 3.83Å; Y207-L266 HydrophobicContact CD1-CG 4.06Å; Y207-L266 WeakPolarHBondContact CD1-O 3.21Å; Y207-L266 HydrophobicContact CE1-CD1 3.83Å; Y207-L269 HydrophobicContact CE1-CD2 4.13Å; Y207-L269 HydrophobicContact CE1-CG 4.27Å
208I93.1Very high87.5Confident67 Ų6771.1 Ų71.134%0.34436%0.359SS..Hα-helixtrans-64.5-46.8177.7-66169.6000110.7L204 M206 I210 N211 L212 F267L204-I208 HydrophobicContact CD1-CD1 4.46Å; L204-I208 HydrophobicContact CG-CD1 4.04Å; L204-I208 WeakPolarHBondContact O-CG1 3.15Å; L204-I208 PolarHBondContact O-N 3.03Å; M206-I208 VanDerWaalsContact C-N 3.33Å; M206-I208 PolarHBondContact O-N 3Å; I208-I210 PolarHBondContact O-N 3Å; I208-N211 PolarHBondContact O-N 3.39Å; I208-L212 HydrophobicContact CG2-CD1 3.91Å; I208-L212 HydrophobicContact CG2-CG 4.38Å; I208-L212 WeakPolarHBondContact O-CG 3.46Å; I208-L212 PolarHBondContact O-N 2.88Å; I208-F267 HydrophobicContact CG1-CE2 4.35Å
209K93.8Very high88.9Confident144 Ų14470.9 Ų70.963%0.62635%0.347SS*.Hα-helixtrans-58.7-45.8178.1-78.7-179.7178.7-171.20112.3R205 M206 L212 F213R205-K209 WeakPolarHBondContact O-CB 3.32Å; R205-K209 VanDerWaalsContact O-CG 3.29Å; R205-K209 WeakPolarHBondContact O-CG 3.49Å; R205-K209 PolarHBondContact O-N 3.5Å; M206-K209 PolarHBondContact O-N 2.86Å; K209-L212 PolarHBondContact O-N 3.22Å; K209-F213 WeakPolarHBondContact O-CB 3.27Å; K209-F213 PolarHBondContact O-N 3.06Å
210I93.3Very high90Very high35 Ų3571.2 Ų71.218%0.17936%0.357CS..Hα-helixtrans-66.1-44178.1-66.3-61.4000111W59 M206 I208 L212 F213 L214 L266W59-I210 HydrophobicContact CH2-CB 4.16Å; W59-I210 HydrophobicContact CH2-CG1 3.99Å; W59-I210 HydrophobicContact CH2-CG2 4.18Å; W59-I210 HydrophobicContact CZ3-CB 4.35Å; W59-I210 HydrophobicContact CZ3-CG1 4.24Å; W59-I210 HydrophobicContact CZ3-CG2 3.88Å; M206-I210 HydrophobicContact CE-CD1 3.84Å; M206-I210 HydrophobicContact CE-CG1 3.87Å; M206-I210 HydrophobicContact CG-CG1 4.47Å; M206-I210 WeakPolarHBondContact O-CG1 3.23Å; M206-I210 PolarHBondContact O-N 3.46Å; M206-I210 HydrophobicContact SD-CG1 4.27Å; I208-I210 PolarHBondContact O-N 3Å; I210-L212 VanDerWaalsContact C-N 3.34Å; I210-L212 PolarHBondContact O-N 2.96Å; I210-F213 PolarHBondContact O-N 3.07Å; I210-L214 HydrophobicContact CG2-CD1 3.81Å; I210-L214 HydrophobicContact CG2-CG 4.01Å; I210-L214 VanDerWaalsContact O-CG 3.27Å; I210-L214 WeakPolarHBondContact O-CG 3.25Å; I210-L214 PolarHBondContact O-N 3.15Å; I210-L266 HydrophobicContact CG2-CD2 3.87Å
211N94.4Very high91.3Very high14 Ų1469.1 Ų69.18%0.07535%0.346CS..Hα-helixtrans-56.5-48175.3-89.2-77.6000112Y207 I208 F213 L214 F215 L263 L266 F267Y207-N211 WeakPolarHBondContact O-CB 3.5Å; Y207-N211 PolarHBondContact O-N 2.82Å; Y207-N211 PolarHBondContact O-ND2 3.18Å; I208-N211 PolarHBondContact O-N 3.39Å; N211-F213 VanDerWaalsContact C-N 3.35Å; N211-F213 PolarHBondContact O-N 3.08Å; N211-L214 PolarHBondContact O-N 3.47Å; N211-F215 WeakPolarHBondContact O-CB 3.41Å; N211-F215 PolarHBondContact O-N 3.4Å; N211-L263 HydrophobicContact CB-CD2 4.25Å; N211-L263 VanDerWaalsContact O-CD2 3.3Å; N211-L263 WeakPolarHBondContact O-CD2 3Å; N211-L263 WeakPolarHBondContact OD1-CA 3.43Å; N211-L263 WeakPolarHBondContact OD1-CD2 3.47Å; N211-L263 PolarHBondContact OD1-O 3.31Å; N211-L266 WeakPolarHBondContact ND2-CG 3.4Å; N211-F267 PolarHBondContact ND2-N 3.36Å
212L94.8Very high92.3Very high95 Ų9565 Ų6550%0.49732%0.317SS..Hα-helixtrans-61.2-43.9176.7-71.1172.4000111.4I208 K209 I210 F215 I216I208-L212 HydrophobicContact CG2-CD1 3.91Å; I208-L212 HydrophobicContact CG2-CG 4.38Å; I208-L212 WeakPolarHBondContact O-CG 3.46Å; I208-L212 PolarHBondContact O-N 2.88Å; K209-L212 PolarHBondContact O-N 3.22Å; I210-L212 VanDerWaalsContact C-N 3.34Å; I210-L212 PolarHBondContact O-N 2.96Å; L212-F215 PolarHBondContact O-N 3.33Å; L212-I216 HydrophobicContact CB-CD1 4.44Å; L212-I216 VanDerWaalsContact O-CB 3.3Å; L212-I216 WeakPolarHBondContact O-CB 3.47Å; L212-I216 WeakPolarHBondContact O-CD1 3.15Å; L212-I216 WeakPolarHBondContact O-CG1 3.41Å; L212-I216 PolarHBondContact O-N 3.5Å
213F95.7Very high92.8Very high112 Ų11268.3 Ų68.349%0.49133%0.332SS..Hα-helixtrans-59.6-51176.7172-98.7000112K209 I210 N211 F215 I216 F217K209-F213 WeakPolarHBondContact O-CB 3.27Å; K209-F213 PolarHBondContact O-N 3.06Å; I210-F213 PolarHBondContact O-N 3.07Å; N211-F213 VanDerWaalsContact C-N 3.35Å; N211-F213 PolarHBondContact O-N 3.08Å; F213-F215 VanDerWaalsContact C-N 3.3Å; F213-F215 PolarHBondContact O-N 3.25Å; F213-I216 PolarHBondContact O-N 2.91Å; F213-F217 HydrophobicContact CZ-CD2 4.27Å; F213-F217 WeakPolarHBondContact O-CB 3.49Å; F213-F217 PolarHBondContact O-N 3.28Å
214L95.4Very high93Very high6 Ų669.1 Ų69.13%0.03133%0.334CS..Hα-helixtrans-60.4-40.4-179.7-67175.2000111.7V62 I63 W66 I210 N211 A218 L263 L266V62-L214 HydrophobicContact CG1-CD1 4.22Å; I63-L214 HydrophobicContact CD1-CD1 3.78Å; I63-L214 HydrophobicContact CD1-CD2 3.9Å; I63-L214 HydrophobicContact CD1-CG 4.4Å; W66-L214 HydrophobicContact CD2-CD2 3.66Å; W66-L214 HydrophobicContact CE3-CD2 4.26Å; W66-L214 HydrophobicContact CG-CD2 3.77Å; W66-L214 HydrophobicContact CZ2-CD2 4.15Å; W66-L214 PolarHBondContact NE1-O 3.12Å; I210-L214 HydrophobicContact CG2-CD1 3.81Å; I210-L214 HydrophobicContact CG2-CG 4.01Å; I210-L214 VanDerWaalsContact O-CG 3.27Å; I210-L214 WeakPolarHBondContact O-CG 3.25Å; I210-L214 PolarHBondContact O-N 3.15Å; N211-L214 PolarHBondContact O-N 3.47Å; L214-A218 VanDerWaalsContact O-CB 3.29Å; L214-A218 WeakPolarHBondContact O-CB 3.46Å; L214-A218 PolarHBondContact O-N 3.23Å; L214-A218 VanDerWaalsContact O-N 3.14Å; L214-L263 HydrophobicContact CB-CD2 3.89Å; L214-L263 HydrophobicContact CD1-CD2 4.46Å; L214-L266 HydrophobicContact CD1-CD2 4.13Å
215F95Very high93Very high89 Ų8967.5 Ų67.539%0.3933%0.325SS..Hα-helixtrans-68.7-52.7177.5-178.4-108.1000112.2N211 L212 F213 F217 A218 L219 L259 L263N211-F215 WeakPolarHBondContact O-CB 3.41Å; N211-F215 PolarHBondContact O-N 3.4Å; L212-F215 PolarHBondContact O-N 3.33Å; F213-F215 VanDerWaalsContact C-N 3.3Å; F213-F215 PolarHBondContact O-N 3.25Å; F215-F217 VanDerWaalsContact C-N 3.31Å; F215-F217 PolarHBondContact O-N 3.16Å; F215-A218 PolarHBondContact O-N 3Å; F215-L219 HydrophobicContact CE1-CD2 4.12Å; F215-L219 HydrophobicContact CZ-CD2 4.25Å; F215-L219 VanDerWaalsContact O-CB 3.3Å; F215-L219 WeakPolarHBondContact O-CB 3.31Å; F215-L219 PolarHBondContact O-N 2.85Å; F215-L259 HydrophobicContact CD2-CD2 4.27Å; F215-L263 HydrophobicContact CB-CD1 3.73Å; F215-L263 HydrophobicContact CB-CD2 4.36Å; F215-L263 HydrophobicContact CD2-CD1 3.61Å; F215-L263 HydrophobicContact CG-CD1 4.07Å
216I95.4Very high93Very high109 Ų10963.9 Ų63.956%0.55932%0.315SS*.Hα-helixtrans-62.4-41.2-178.2-68.4167.3000110.3L212 F213 G220L212-I216 HydrophobicContact CB-CD1 4.44Å; L212-I216 VanDerWaalsContact O-CB 3.3Å; L212-I216 WeakPolarHBondContact O-CB 3.47Å; L212-I216 WeakPolarHBondContact O-CD1 3.15Å; L212-I216 WeakPolarHBondContact O-CG1 3.41Å; L212-I216 PolarHBondContact O-N 3.5Å; F213-I216 PolarHBondContact O-N 2.91Å; I216-G220 WeakPolarHBondContact O-CA 3.32Å; I216-G220 PolarHBondContact O-N 3.48Å
217F95.5Very high93.1Very high87 Ų8767 Ų6738%0.38233%0.333SS..Hα-helixtrans-63.6-49.6177-174.5-77.4000111.3W66 I70 F213 F215 L219 G220 F221W66-F217 AromaticContact CH2-CD1 3.63Å; W66-F217 HydrophobicContact CH2-CD1 3.63Å; W66-F217 AromaticContact CH2-CE1 3.76Å; W66-F217 HydrophobicContact CH2-CE1 3.76Å; W66-F217 HydrophobicContact CH2-CG 4.15Å; W66-F217 HydrophobicContact CH2-CZ 4.39Å; W66-F217 HydrophobicContact CZ2-CB 4.02Å; W66-F217 AromaticContact CZ2-CD1 3.27Å; W66-F217 HydrophobicContact CZ2-CD1 3.27Å; W66-F217 AromaticContact CZ2-CE1 3.87Å; W66-F217 HydrophobicContact CZ2-CE1 3.87Å; W66-F217 AromaticContact CZ2-CG 3.76Å; W66-F217 HydrophobicContact CZ2-CG 3.76Å; I70-F217 HydrophobicContact CD1-CD1 4.12Å; I70-F217 HydrophobicContact CD1-CE1 4Å; I70-F217 HydrophobicContact CG1-CE1 4.41Å; F213-F217 HydrophobicContact CZ-CD2 4.27Å; F213-F217 WeakPolarHBondContact O-CB 3.49Å; F213-F217 PolarHBondContact O-N 3.28Å; F215-F217 VanDerWaalsContact C-N 3.31Å; F215-F217 PolarHBondContact O-N 3.16Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 2.69Å; F217-G220 PolarHBondContact O-N 2.96Å; F217-F221 HydrophobicContact CD1-CB 4.48Å; F217-F221 HydrophobicContact CE1-CB 4.38Å; F217-F221 VanDerWaalsContact O-CB 3.22Å; F217-F221 WeakPolarHBondContact O-CB 3.45Å; F217-F221 PolarHBondContact O-N 3.08Å
218A93.8Very high93Very high0 Ų072.5 Ų72.50%036%0.361CS..Hα-helixtrans-63.4-41.3-179.500000111.8W73 L214 F215 Y222 L259W73-A218 HydrophobicContact CH2-CB 4.26Å; W73-A218 HydrophobicContact CZ3-CB 4.07Å; W73-A218 WeakPolarHBondContact CZ3-O 3.44Å; L214-A218 VanDerWaalsContact O-CB 3.29Å; L214-A218 WeakPolarHBondContact O-CB 3.46Å; L214-A218 PolarHBondContact O-N 3.23Å; L214-A218 VanDerWaalsContact O-N 3.14Å; F215-A218 PolarHBondContact O-N 3Å; A218-Y222 WeakPolarHBondContact O-CB 3.41Å; A218-Y222 PolarHBondContact O-N 3.38Å; A218-L259 HydrophobicContact CB-CD1 4.08Å; A218-L259 HydrophobicContact CB-CD2 3.65Å
219L92.5Very high92.8Very high64 Ų6476.7 Ų76.734%0.33539%0.385SS..Hα-helixtrans-65.6-46.3175.7-178.262.6000111.5F215 F217 F221 Y222 L223F215-L219 HydrophobicContact CE1-CD2 4.12Å; F215-L219 HydrophobicContact CZ-CD2 4.25Å; F215-L219 VanDerWaalsContact O-CB 3.3Å; F215-L219 WeakPolarHBondContact O-CB 3.31Å; F215-L219 PolarHBondContact O-N 2.85Å; F217-L219 VanDerWaalsContact C-N 3.34Å; F217-L219 PolarHBondContact O-N 2.69Å; L219-F221 PolarHBondContact O-N 3Å; L219-Y222 HydrophobicContact CD1-CD1 4.49Å; L219-Y222 WeakPolarHBondContact O-CB 3.21Å; L219-Y222 PolarHBondContact O-N 3.09Å; L219-L223 HydrophobicContact CD1-CD1 4.49Å; L219-L223 HydrophobicContact CD1-CG 4.43Å; L219-L223 HydrophobicContact CG-CD1 4.19Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.17Å; L219-L223 PolarHBondContact O-N 3.39Å
220G93.2Very high92.4Very high31 Ų3172.7 Ų72.732%0.3237%0.369SS..Hα-helixtrans-60.7-44.5177.300000111.8I216 F217 L223 V224I216-G220 WeakPolarHBondContact O-CA 3.32Å; I216-G220 PolarHBondContact O-N 3.48Å; F217-G220 PolarHBondContact O-N 2.96Å; G220-L223 PolarHBondContact O-N 2.95Å; G220-V224 VanDerWaalsContact O-CG2 3.3Å; G220-V224 WeakPolarHBondContact O-CG2 3.34Å; G220-V224 PolarHBondContact O-N 3.38Å
221F92.5Very high92Very high51 Ų5175.3 Ų75.322%0.22438%0.384CS..Hα-helixtrans-63-42.5176.2-171.3-108.1000112I70 W73 I74 F217 L219 V224 L225I70-F221 HydrophobicContact CD1-CD1 4.26Å; W73-F221 HydrophobicContact CB-CD1 4.48Å; W73-F221 HydrophobicContact CB-CE1 3.84Å; W73-F221 AromaticContact CE3-CD1 3.58Å; W73-F221 HydrophobicContact CE3-CD1 3.58Å; W73-F221 HydrophobicContact CE3-CE1 4.05Å; W73-F221 HydrophobicContact CZ3-CD1 4.12Å; I74-F221 HydrophobicContact CD1-CZ 4.16Å; I74-F221 HydrophobicContact CG1-CE1 4.2Å; I74-F221 HydrophobicContact CG1-CZ 3.65Å; F217-F221 HydrophobicContact CD1-CB 4.48Å; F217-F221 HydrophobicContact CE1-CB 4.38Å; F217-F221 VanDerWaalsContact O-CB 3.22Å; F217-F221 WeakPolarHBondContact O-CB 3.45Å; F217-F221 PolarHBondContact O-N 3.08Å; L219-F221 PolarHBondContact O-N 3Å; F221-V224 PolarHBondContact O-N 2.94Å; F221-L225 HydrophobicContact CD1-CD1 3.71Å; F221-L225 HydrophobicContact CE1-CD1 3.29Å; F221-L225 HydrophobicContact CE1-CG 4.4Å; F221-L225 HydrophobicContact CE2-CD1 4.19Å; F221-L225 HydrophobicContact CG-CD1 4.36Å; F221-L225 HydrophobicContact CZ-CD1 3.55Å; F221-L225 HydrophobicContact CZ-CG 4.36Å; F221-L225 WeakPolarHBondContact O-CG 3.46Å; F221-L225 PolarHBondContact O-N 2.94Å
222Y90.2Very high91.4Very high40 Ų4074.8 Ų74.816%0.15738%0.381CS..Hα-helixtrans-58.9-47.6171.9166.1-96.4000112.1A218 L219 V224 L225 K226 L232 F256A218-Y222 WeakPolarHBondContact O-CB 3.41Å; A218-Y222 PolarHBondContact O-N 3.38Å; L219-Y222 HydrophobicContact CD1-CD1 4.49Å; L219-Y222 WeakPolarHBondContact O-CB 3.21Å; L219-Y222 PolarHBondContact O-N 3.09Å; Y222-V224 PolarHBondContact O-N 3.46Å; Y222-L225 PolarHBondContact O-N 3.48Å; Y222-K226 HydrophobicContact CE1-CD 4.09Å; Y222-K226 WeakPolarHBondContact O-CB 3.4Å; Y222-K226 PolarHBondContact O-N 2.94Å; Y222-L232 HydrophobicContact CD2-CB 4.18Å; Y222-L232 HydrophobicContact CD2-CD1 3.48Å; Y222-L232 VanDerWaalsContact CD2-CD1 3.48Å; Y222-L232 HydrophobicContact CD2-CG 4.39Å; Y222-L232 HydrophobicContact CE2-CB 4.36Å; Y222-L232 HydrophobicContact CE2-CD1 4.34Å; Y222-L232 HydrophobicContact CG-CD1 4.19Å; Y222-F256 HydrophobicContact CD1-CZ 4.07Å; Y222-F256 AromaticContact CD2-CE2 3.86Å; Y222-F256 HydrophobicContact CD2-CE2 3.86Å; Y222-F256 AromaticContact CD2-CZ 3.5Å; Y222-F256 HydrophobicContact CD2-CZ 3.5Å; Y222-F256 VanDerWaalsContact CD2-CZ 3.5Å; Y222-F256 HydrophobicContact CE1-CZ 4.42Å; Y222-F256 AromaticContact CE2-CE2 3.97Å; Y222-F256 HydrophobicContact CE2-CE2 3.97Å; Y222-F256 AromaticContact CE2-CZ 3.92Å; Y222-F256 HydrophobicContact CE2-CZ 3.92Å; Y222-F256 HydrophobicContact CG-CE2 4.43Å; Y222-F256 AromaticContact CG-CZ 3.61Å; Y222-F256 HydrophobicContact CG-CZ 3.61Å
223L91.3Very high90.9Very high85 Ų8573.4 Ų73.445%0.44537%0.374SS..Hα-helixtrans-64-41.1-179.5-70.1174.2000111.6L219 G220 K226 L227L219-L223 HydrophobicContact CD1-CD1 4.49Å; L219-L223 HydrophobicContact CD1-CG 4.43Å; L219-L223 HydrophobicContact CG-CD1 4.19Å; L219-L223 VanDerWaalsContact O-CG 3.29Å; L219-L223 WeakPolarHBondContact O-CG 3.17Å; L219-L223 PolarHBondContact O-N 3.39Å; G220-L223 PolarHBondContact O-N 2.95Å; L223-K226 PolarHBondContact O-N 3.48Å; L223-L227 VanDerWaalsContact O-CG 3.28Å; L223-L227 WeakPolarHBondContact O-CG 3.5Å; L223-L227 PolarHBondContact O-N 2.93Å
224V92.6Very high90.5Very high79 Ų7969.9 Ų69.948%0.47936%0.357SS..Hα-helixtrans-61.3-48175.6168.90000111G220 F221 Y222 K226 L227 L228G220-V224 VanDerWaalsContact O-CG2 3.3Å; G220-V224 WeakPolarHBondContact O-CG2 3.34Å; G220-V224 PolarHBondContact O-N 3.38Å; F221-V224 PolarHBondContact O-N 2.94Å; Y222-V224 PolarHBondContact O-N 3.46Å; V224-K226 VanDerWaalsContact C-N 3.31Å; V224-K226 PolarHBondContact O-N 3.35Å; V224-L227 WeakPolarHBondContact O-CB 3.4Å; V224-L227 PolarHBondContact O-N 3.48Å; V224-L228 HydrophobicContact CG1-CD1 4.37Å; V224-L228 WeakPolarHBondContact O-CG 3.23Å; V224-L228 PolarHBondContact O-N 2.84Å; V224-L228 VanDerWaalsContact O-N 3.12Å
225L89.3Confident90.2Very high19 Ų1969.6 Ų69.610%0.09936%0.356CS..Hα-helixtrans-65.1-37.2178.9-71.6172.6000112F221 Y222 L227 L228 D229 I230 L232F221-L225 HydrophobicContact CD1-CD1 3.71Å; F221-L225 HydrophobicContact CE1-CD1 3.29Å; F221-L225 HydrophobicContact CE1-CG 4.4Å; F221-L225 HydrophobicContact CE2-CD1 4.19Å; F221-L225 HydrophobicContact CG-CD1 4.36Å; F221-L225 HydrophobicContact CZ-CD1 3.55Å; F221-L225 HydrophobicContact CZ-CG 4.36Å; F221-L225 WeakPolarHBondContact O-CG 3.46Å; F221-L225 PolarHBondContact O-N 2.94Å; Y222-L225 PolarHBondContact O-N 3.48Å; L225-L227 VanDerWaalsContact C-N 3.35Å; L225-L227 PolarHBondContact O-N 3.45Å; L225-L228 CarbonylContact O-C 3.59Å; L225-L228 PolarHBondContact O-N 2.79Å; L225-L228 VanDerWaalsContact O-N 3.16Å; L225-D229 PolarHBondContact O-N 3.48Å; L225-I230 HydrophobicContact CB-CB 4.41Å; L225-I230 HydrophobicContact CD2-CD1 3.9Å; L225-I230 WeakPolarHBondContact O-CB 3.31Å; L225-I230 PolarHBondContact O-N 2.96Å; L225-L232 HydrophobicContact CB-CD1 3.93Å; L225-L232 HydrophobicContact CB-CG 4.29Å; L225-L232 HydrophobicContact CD1-CD1 3.85Å; L225-L232 HydrophobicContact CD1-CD2 3.86Å; L225-L232 HydrophobicContact CD1-CG 4.28Å
226K88.6Confident89.9Confident125 Ų12566.5 Ų66.554%0.54334%0.344SS..Hα-helixtrans-63.3-38.7172.9-171.1177.9-1741740112.5Y222 L223 V224 L228 D229Y222-K226 HydrophobicContact CE1-CD 4.09Å; Y222-K226 WeakPolarHBondContact O-CB 3.4Å; Y222-K226 PolarHBondContact O-N 2.94Å; L223-K226 PolarHBondContact O-N 3.48Å; V224-K226 VanDerWaalsContact C-N 3.31Å; V224-K226 PolarHBondContact O-N 3.35Å; K226-L228 PolarHBondContact O-N 3.47Å; K226-D229 PolarHBondContact O-N 2.91Å; K226-D229 VanDerWaalsContact O-N 3.11Å
227L91.9Very high89.6Confident154 Ų15465 Ų6581%0.80634%0.342SS*.Hα-helixtrans-66.2-27.3175-73.1171.7000112.5L223 V224 L225 D229L223-L227 VanDerWaalsContact O-CG 3.28Å; L223-L227 WeakPolarHBondContact O-CG 3.5Å; L223-L227 PolarHBondContact O-N 2.93Å; V224-L227 WeakPolarHBondContact O-CB 3.4Å; V224-L227 PolarHBondContact O-N 3.48Å; L225-L227 VanDerWaalsContact C-N 3.35Å; L225-L227 PolarHBondContact O-N 3.45Å; L227-D229 PolarHBondContact O-N 2.81Å
228L91.3Very high89.4Confident116 Ų11663.1 Ų63.161%0.60733%0.333SS*.THydrogen-bonded Turntrans-83.710.7173.3-63.1174.2000113.2V224 L225 K226 I230V224-L228 HydrophobicContact CG1-CD1 4.37Å; V224-L228 WeakPolarHBondContact O-CG 3.23Å; V224-L228 PolarHBondContact O-N 2.84Å; V224-L228 VanDerWaalsContact O-N 3.12Å; L225-L228 CarbonylContact O-C 3.59Å; L225-L228 PolarHBondContact O-N 2.79Å; L225-L228 VanDerWaalsContact O-N 3.16Å; K226-L228 PolarHBondContact O-N 3.47Å; L228-I230 HydrophobicContact CB-CD1 4.12Å; L228-I230 HydrophobicContact CB-CG1 4.21Å; L228-I230 PolarHBondContact O-N 2.84Å
229D87.6Confident89.1Confident155 Ų15563.1 Ų63.183%0.82933%0.333SS*.THydrogen-bonded Turntrans59.727.3-177-15636.1000114L225 K226 L227L225-D229 PolarHBondContact O-N 3.48Å; K226-D229 PolarHBondContact O-N 2.91Å; K226-D229 VanDerWaalsContact O-N 3.11Å; L227-D229 PolarHBondContact O-N 2.81Å
230I87.1Confident89Confident60 Ų6066.3 Ų66.331%0.30834%0.344SS..  trans-96.5103.8176-58.5173.1000108.6F76 L225 L228 L232F76-I230 HydrophobicContact CE1-CG2 3.54Å; F76-I230 HydrophobicContact CE2-CG2 4.12Å; F76-I230 HydrophobicContact CZ-CG2 3.17Å; L225-I230 HydrophobicContact CB-CB 4.41Å; L225-I230 HydrophobicContact CD2-CD1 3.9Å; L225-I230 WeakPolarHBondContact O-CB 3.31Å; L225-I230 PolarHBondContact O-N 2.96Å; L228-I230 HydrophobicContact CB-CD1 4.12Å; L228-I230 HydrophobicContact CB-CG1 4.21Å; L228-I230 PolarHBondContact O-N 2.84Å; I230-L232 PolarHBondContact O-N 3.02Å
231D84.1Confident88.9Confident91 Ų9171.6 Ų71.649%0.48736%0.359SS..  trans-70115.3176.6179.919.7000111.1L233 W234D231-L233 VanDerWaalsContact C-N 3.34Å; D231-L233 WeakPolarHBondContact OD1-CB 3.49Å; D231-L233 PolarHBondContact OD1-N 3.37Å; D231-W234 WeakPolarHBondContact O-CB 3.36Å; D231-W234 PolarHBondContact OD2-N 3.18Å
232L81.4Confident88.8Confident2 Ų272.2 Ų72.21%0.0136%0.36CS..THydrogen-bonded Turntrans-82.3-11.1176.8-71171.3000114.3W73 F76 Y222 L225 I230W73-L232 HydrophobicContact CB-CD2 3.73Å; W73-L232 HydrophobicContact CD2-CD1 4.24Å; W73-L232 HydrophobicContact CD2-CD2 4.47Å; W73-L232 HydrophobicContact CG-CD1 4.31Å; W73-L232 HydrophobicContact CG-CD2 3.71Å; F76-L232 HydrophobicContact CE1-CD2 4.24Å; F76-L232 HydrophobicContact CZ-CD2 3.94Å; Y222-L232 HydrophobicContact CD2-CB 4.18Å; Y222-L232 HydrophobicContact CD2-CD1 3.48Å; Y222-L232 VanDerWaalsContact CD2-CD1 3.48Å; Y222-L232 HydrophobicContact CD2-CG 4.39Å; Y222-L232 HydrophobicContact CE2-CB 4.36Å; Y222-L232 HydrophobicContact CE2-CD1 4.34Å; Y222-L232 HydrophobicContact CG-CD1 4.19Å; L225-L232 HydrophobicContact CB-CD1 3.93Å; L225-L232 HydrophobicContact CB-CG 4.29Å; L225-L232 HydrophobicContact CD1-CD1 3.85Å; L225-L232 HydrophobicContact CD1-CD2 3.86Å; L225-L232 HydrophobicContact CD1-CG 4.28Å; I230-L232 PolarHBondContact O-N 3.02Å
233L83.7Confident88.9Confident67 Ų6771.1 Ų71.135%0.35136%0.358SS..THydrogen-bonded Turntrans-96.17175-63.3174.3000112.3D231 S235 V236 P237D231-L233 VanDerWaalsContact C-N 3.34Å; D231-L233 WeakPolarHBondContact OD1-CB 3.49Å; D231-L233 PolarHBondContact OD1-N 3.37Å; L233-S235 PolarHBondContact O-N 3.18Å; L233-V236 HydrophobicContact CB-CG2 4.45Å; L233-V236 HydrophobicContact CD2-CG2 4.21Å; L233-V236 WeakPolarHBondContact O-CB 3.39Å; L233-V236 PolarHBondContact O-N 2.95Å; L233-P237 WeakPolarHBondContact O-CD 3.38Å
234W88.5Confident88.8Confident37 Ų3770.6 Ų70.614%0.1437%0.365CS..THydrogen-bonded Turntrans-50-29.7-179.173.2-86.7000114.4F76 H78 P109 D231 K238F76-W234 HydrophobicContact CB-CZ2 4.27Å; F76-W234 AromaticContact CD1-CD1 3.76Å; F76-W234 AromaticContact CD1-CE2 3.92Å; F76-W234 HydrophobicContact CD1-CZ2 4.47Å; F76-W234 AromaticContact CD1-NE1 3.29Å; F76-W234 VanDerWaalsContact CD1-NE1 3.29Å; F76-W234 AromaticContact CE1-CD1 3.86Å; F76-W234 AromaticContact CE1-NE1 3.77Å; F76-W234 WeakPolarHBondContact O-CZ2 3.27Å; H78-W234 AromaticContact CD2-CH2 3.97Å; H78-W234 AromaticContact CE1-CZ3 3.76Å; H78-W234 AromaticContact ND1-CZ3 3.94Å; P109-W234 HydrophobicContact CB-CZ2 4.33Å; D231-W234 WeakPolarHBondContact O-CB 3.36Å; D231-W234 PolarHBondContact OD2-N 3.18Å; W234-K238 HydrophobicContact CE3-CD 3.61Å; W234-K238 VanDerWaalsContact CE3-CE 3.43Å; W234-K238 HydrophobicContact CZ3-CD 3.51Å
235S89.8Confident88.5Confident0 Ų069 Ų690%035%0.354CS..Hα-helixtrans-76.8-24.1179.462.40000113.1T107 L233 K238 A239T107-S235 CarbonylContact O-C 3.29Å; T107-S235 WeakPolarHBondContact O-CB 3.39Å; T107-S235 PolarHBondContact O-OG 3.27Å; L233-S235 PolarHBondContact O-N 3.18Å; S235-K238 PolarHBondContact O-N 2.79Å; S235-A239 WeakPolarHBondContact O-CB 3.41Å; S235-A239 PolarHBondContact O-N 3.08Å
236V88.3Confident88.3Confident25 Ų2572.7 Ų72.715%0.15238%0.379CS..Hα-helixtrans-67.9-49-178.1179.80000111.5L233 K238 A239 K240 T254L233-V236 HydrophobicContact CB-CG2 4.45Å; L233-V236 HydrophobicContact CD2-CG2 4.21Å; L233-V236 WeakPolarHBondContact O-CB 3.39Å; L233-V236 PolarHBondContact O-N 2.95Å; V236-K238 VanDerWaalsContact C-N 3.28Å; V236-K238 PolarHBondContact O-N 3.33Å; V236-A239 PolarHBondContact O-N 2.82Å; V236-K240 HydrophobicContact CG1-CD 4.42Å; V236-K240 WeakPolarHBondContact O-CG 3.28Å; V236-K240 PolarHBondContact O-N 3.21Å; V236-T254 HydrophobicContact CG2-CG2 4.4Å
237P89.3Confident88Confident77 Ų7773.5 Ų73.550%0.539%0.39SS..Hα-helixtrans-58.2-38.7172.8-25.334.3000113L233 K240 K241L233-P237 WeakPolarHBondContact O-CD 3.38Å; P237-K240 PolarHBondContact O-N 3.12Å; P237-K241 VanDerWaalsContact O-CB 3.27Å; P237-K241 WeakPolarHBondContact O-CB 3.44Å; P237-K241 PolarHBondContact O-N 3.12Å
238K90.1Very high87.7Confident47 Ų4769.5 Ų69.520%0.20436%0.364CS..Hα-helixtrans-65.6-44178.1-67.2-178.5-176.1-740111.9W82 E86 W234 S235 V236 K241 W242W82-K238 HydrophobicContact CD2-CB 4.12Å; W82-K238 HydrophobicContact CE3-CB 4.26Å; W82-K238 HydrophobicContact CG-CB 4.23Å; E86-K238 IonicContact OE1-NZ 2.79Å; E86-K238 PolarHBondContact OE1-NZ 3.04Å; E86-K238 WeakPolarHBondContact OE2-CD 3.3Å; E86-K238 WeakPolarHBondContact OE2-CE 3.26Å; E86-K238 IonicContact OE2-NZ 3.94Å; E86-K238 PolarHBondContact OE2-NZ 3.46Å; W234-K238 HydrophobicContact CE3-CD 3.61Å; W234-K238 VanDerWaalsContact CE3-CE 3.43Å; W234-K238 HydrophobicContact CZ3-CD 3.51Å; S235-K238 PolarHBondContact O-N 2.79Å; V236-K238 VanDerWaalsContact C-N 3.28Å; V236-K238 PolarHBondContact O-N 3.33Å; K238-K241 PolarHBondContact O-N 3.07Å; K238-W242 VanDerWaalsContact O-CD1 3.31Å; K238-W242 PolarHBondContact O-N 3.34Å
239A88.6Confident87.2Confident0 Ų065.6 Ų65.60%034%0.343CS..Hα-helixtrans-59.8-46.2174.500000111.4Y81 W82 T107 S235 V236 K241 C243Y81-A239 WeakPolarHBondContact OH-CA 3.27Å; Y81-A239 WeakPolarHBondContact OH-CB 3.29Å; W82-A239 HydrophobicContact CE3-CB 4.41Å; W82-A239 HydrophobicContact CZ3-CB 3.98Å; T107-A239 HydrophobicContact CG2-CB 4.21Å; S235-A239 WeakPolarHBondContact O-CB 3.41Å; S235-A239 PolarHBondContact O-N 3.08Å; V236-A239 PolarHBondContact O-N 2.82Å; A239-K241 VanDerWaalsContact C-N 3.34Å; A239-K241 PolarHBondContact O-N 3Å; A239-C243 WeakPolarHBondContact O-CB 3.5Å; A239-C243 PolarHBondContact O-N 3.2Å; A239-C243 VanDerWaalsContact O-N 3.1Å
240K89.1Confident86.7Confident131 Ų13160.6 Ų60.657%0.5732%0.316SS*.Hα-helixtrans-63.7-37.4177.6-71.4-176.9175.5-1760112.9V236 P237 I249V236-K240 HydrophobicContact CG1-CD 4.42Å; V236-K240 WeakPolarHBondContact O-CG 3.28Å; V236-K240 PolarHBondContact O-N 3.21Å; P237-K240 PolarHBondContact O-N 3.12Å; K240-I249 HydrophobicContact CB-CD1 4.48Å; K240-I249 HydrophobicContact CG-CD1 4.15Å
241K91.5Very high86Confident143 Ų14361.7 Ų61.762%0.62232%0.322SS*.Hα-helixtrans-73.3-40.6-177.4-178177.9176-175.70113P237 K238 A239P237-K241 VanDerWaalsContact O-CB 3.27Å; P237-K241 WeakPolarHBondContact O-CB 3.44Å; P237-K241 PolarHBondContact O-N 3.12Å; K238-K241 PolarHBondContact O-N 3.07Å; A239-K241 VanDerWaalsContact C-N 3.34Å; A239-K241 PolarHBondContact O-N 3Å
242W91.4Very high85.2Confident64 Ų6460.8 Ų60.824%0.24232%0.317CS..Hα-helixtrans-108.61.4-168.2-61.3114.7000114.3Y81 W82 Q85 E86 Q100 K238Y81-W242 HydrophobicContact CD2-CB 4.33Å; Y81-W242 HydrophobicContact CE2-CB 4.33Å; W82-W242 HydrophobicContact CB-CB 3.85Å; W82-W242 HydrophobicContact CB-CG 3.91Å; Q85-W242 HydrophobicContact CB-CD2 3.72Å; Q85-W242 HydrophobicContact CB-CE3 3.6Å; Q85-W242 HydrophobicContact CB-CG 4.49Å; Q85-W242 HydrophobicContact CB-CH2 3.65Å; Q85-W242 HydrophobicContact CB-CZ2 3.78Å; Q85-W242 HydrophobicContact CB-CZ3 3.57Å; Q85-W242 HydrophobicContact CG-CD2 4.04Å; Q85-W242 HydrophobicContact CG-CE3 3.64Å; Q85-W242 HydrophobicContact CG-CH2 4.46Å; Q85-W242 HydrophobicContact CG-CZ3 3.88Å; E86-W242 HydrophobicContact CG-CZ2 4.02Å; E86-W242 PolarHBondContact OE1-NE1 2.96Å; E86-W242 VanDerWaalsContact OE1-NE1 3.15Å; Q100-W242 PolarHBondContact NE2-O 3.18Å; K238-W242 VanDerWaalsContact O-CD1 3.31Å; K238-W242 PolarHBondContact O-N 3.34Å
243C91.2Very high84.8Confident17 Ų1762.4 Ų62.412%0.11533%0.327CS..  trans-72.3133.1172.2-1710000111C105 A239 N245 I249C105-C243 HydrophobicContact CB-CB 3.75Å; C105-C243 WeakPolarHBondContact CB-SG 3.35Å; C105-C243 WeakPolarHBondContact SG-CA 3.44Å; C105-C243 WeakPolarHBondContact SG-CB 3.26Å; C105-C243 CovalentContact SG-SG 2.02Å; C105-C243 PolarHBondContact SG-SG 2.96Å; A239-C243 WeakPolarHBondContact O-CB 3.5Å; A239-C243 PolarHBondContact O-N 3.2Å; A239-C243 VanDerWaalsContact O-N 3.1Å; C243-N245 VanDerWaalsContact C-N 3.3Å; C243-N245 PolarHBondContact O-N 2.72Å; C243-N245 PolarHBondContact SG-O 2.89Å; C243-I249 HydrophobicContact CB-CG1 4.09Å
244A89Confident84.7Confident73 Ų7360 Ų6060%0.60332%0.315SS*.SBendtrans-67.3-28.8-178.500000113.5Q100 W248Q100-A244 HydrophobicContact CB-CB 4.2Å; Q100-A244 HydrophobicContact CG-CB 4.46Å; A244-W248 HydrophobicContact CB-CZ3 4.13Å
245N87.8Confident84.3Confident47 Ų4758.6 Ų58.625%0.25131%0.311SS..  trans-136.5123.5177.8-177.7-17.6000110C243 D247 W248C243-N245 VanDerWaalsContact C-N 3.3Å; C243-N245 PolarHBondContact O-N 2.72Å; C243-N245 PolarHBondContact SG-O 2.89Å; N245-D247 PolarHBondContact O-N 3.09Å; N245-D247 VanDerWaalsContact O-N 3.16Å; N245-D247 WeakPolarHBondContact OD1-CB 3.5Å; N245-D247 PolarHBondContact OD1-N 2.97Å; N245-W248 HydrophobicContact CB-CD2 3.52Å; N245-W248 HydrophobicContact CB-CE3 3.81Å; N245-W248 HydrophobicContact CB-CG 3.86Å; N245-W248 HydrophobicContact CB-CH2 4.36Å; N245-W248 HydrophobicContact CB-CZ2 4.1Å; N245-W248 HydrophobicContact CB-CZ3 4.22Å; N245-W248 PolarHBondContact ND2-NE1 3.44Å; N245-W248 WeakPolarHBondContact O-CB 3.43Å; N245-W248 PolarHBondContact O-N 3.22Å
246P83.9Confident84.1Confident96 Ų9660.6 Ų60.662%0.62332%0.32SS*.G310 helixtrans-58.7-27.7179.625-35.3000113.8W248 I249P246-W248 PolarHBondContact O-N 2.97Å; P246-I249 HydrophobicContact CB-CD1 4.34Å; P246-I249 WeakPolarHBondContact O-CB 3.4Å; P246-I249 WeakPolarHBondContact O-CD1 3.31Å; P246-I249 VanDerWaalsContact O-CG1 3.31Å; P246-I249 WeakPolarHBondContact O-CG1 3.47Å; P246-I249 PolarHBondContact O-N 3.1Å
247D82.8Confident84Confident142 Ų14259.7 Ų59.776%0.75932%0.315SS*.G310 helixtrans-69.8-16.2177.9-64.8-29.6000113N245 I249N245-D247 PolarHBondContact O-N 3.09Å; N245-D247 VanDerWaalsContact O-N 3.16Å; N245-D247 WeakPolarHBondContact OD1-CB 3.5Å; N245-D247 PolarHBondContact OD1-N 2.97Å; D247-I249 VanDerWaalsContact C-N 3.31Å
248W84.9Confident83.9Confident69 Ų6956.6 Ų56.626%0.26130%0.297SS..G310 helixtrans-87.4-1.6178.1-58.7-11.9000112.9Q100 P102 C105 A244 N245 P246 N250Q100-W248 HydrophobicContact CB-CZ3 4.25Å; P102-W248 HydrophobicContact CB-CD2 4.4Å; P102-W248 HydrophobicContact CB-CG 4.29Å; P102-W248 HydrophobicContact CG-CD2 4.47Å; P102-W248 HydrophobicContact CG-CZ2 4.18Å; C105-W248 HydrophobicContact CB-CB 4.4Å; C105-W248 WeakPolarHBondContact CB-O 3.4Å; A244-W248 HydrophobicContact CB-CZ3 4.13Å; N245-W248 HydrophobicContact CB-CD2 3.52Å; N245-W248 HydrophobicContact CB-CE3 3.81Å; N245-W248 HydrophobicContact CB-CG 3.86Å; N245-W248 HydrophobicContact CB-CH2 4.36Å; N245-W248 HydrophobicContact CB-CZ2 4.1Å; N245-W248 HydrophobicContact CB-CZ3 4.22Å; N245-W248 PolarHBondContact ND2-NE1 3.44Å; N245-W248 WeakPolarHBondContact O-CB 3.43Å; N245-W248 PolarHBondContact O-N 3.22Å; P246-W248 PolarHBondContact O-N 2.97Å; W248-N250 PolarHBondContact O-N 3.39Å; W248-N250 VanDerWaalsContact O-N 3.14Å; W248-N250 PolarHBondContact O-ND2 2.93Å
249I81.8Confident83.9Confident34 Ų3454.4 Ų54.417%0.17429%0.288CS..  trans-73.6107.3-178.7-61.4170.6000109.6T107 K240 C243 P246 D247 I251T107-I249 HydrophobicContact CG2-CG2 3.68Å; K240-I249 HydrophobicContact CB-CD1 4.48Å; K240-I249 HydrophobicContact CG-CD1 4.15Å; C243-I249 HydrophobicContact CB-CG1 4.09Å; P246-I249 HydrophobicContact CB-CD1 4.34Å; P246-I249 WeakPolarHBondContact O-CB 3.4Å; P246-I249 WeakPolarHBondContact O-CD1 3.31Å; P246-I249 VanDerWaalsContact O-CG1 3.31Å; P246-I249 WeakPolarHBondContact O-CG1 3.47Å; P246-I249 PolarHBondContact O-N 3.1Å; D247-I249 VanDerWaalsContact C-N 3.31Å; I249-I251 HydrophobicContact CG2-CG1 4.34Å; I249-I251 PolarHBondContact O-N 3.45Å; I249-I251 VanDerWaalsContact O-N 3.12Å
250N76.5Confident84.1Confident50 Ų5055.5 Ų55.527%0.26729%0.294SS..BIsolated β-bridgetrans-85.187.8-178.1-71.1-71000111.3C105 T107 W248 D252 T253C105-N250 PolarHBondContact O-N 3.03Å; C105-N250 VanDerWaalsContact O-N 3.12Å; T107-N250 WeakPolarHBondContact CG2-O 3.41Å; T107-N250 PolarHBondContact OG1-O 2.97Å; W248-N250 PolarHBondContact O-N 3.39Å; W248-N250 VanDerWaalsContact O-N 3.14Å; W248-N250 PolarHBondContact O-ND2 2.93Å; N250-D252 PolarHBondContact O-N 3.43Å; N250-T253 HydrophobicContact CB-CG2 3.77Å; N250-T253 PolarHBondContact O-N 3.08Å; N250-T253 VanDerWaalsContact O-N 3.09Å; N250-T253 PolarHBondContact O-OG1 3.41Å
251I72.8Confident84.3Confident84 Ų8452 Ų5243%0.43128%0.277SS..G310 helixtrans-62.4-30.8177.8-62.2171.1000111.8I249 T253 T254I249-I251 HydrophobicContact CG2-CG1 4.34Å; I249-I251 PolarHBondContact O-N 3.45Å; I249-I251 VanDerWaalsContact O-N 3.12Å; I251-T253 PolarHBondContact O-N 3.17Å; I251-T253 VanDerWaalsContact O-N 3.07Å; I251-T254 WeakPolarHBondContact O-CB 3.39Å; I251-T254 VanDerWaalsContact O-CG2 3.27Å; I251-T254 WeakPolarHBondContact O-CG2 3.3Å; I251-T254 PolarHBondContact O-N 3.03Å; I251-T254 PolarHBondContact O-OG1 2.94Å
252D67.1Low84.3Confident71 Ų7145.3 Ų45.338%0.3825%0.249SC..G310 helixtrans-62.6-15.8175.8-60.9-18.7000113.5R36 N250 T254 F320R36-D252 IonicContact NH1-OD2 2.76Å; R36-D252 IonicContact NH2-OD2 2.72Å; N250-D252 PolarHBondContact O-N 3.43Å; D252-T254 VanDerWaalsContact C-N 3.27Å; D252-F320 WeakPolarHBondContact OD1-CE2 3.5Å; D252-F320 WeakPolarHBondContact OD1-CZ 3.4Å
253T73.1Confident84.5Confident37 Ų3742.9 Ų42.923%0.22724%0.24CC..G310 helixtrans-88.97.3177.965.80000113E106 T107 N250 I251E106-T253 HydrophobicContact CG-CG2 4.24Å; T107-T253 PolarHBondContact N-OG1 3.43Å; T107-T253 PolarHBondContact OG1-OG1 3.37Å; T107-T253 VanDerWaalsContact OG1-OG1 3.08Å; N250-T253 HydrophobicContact CB-CG2 3.77Å; N250-T253 PolarHBondContact O-N 3.08Å; N250-T253 VanDerWaalsContact O-N 3.09Å; N250-T253 PolarHBondContact O-OG1 3.41Å; I251-T253 PolarHBondContact O-N 3.17Å; I251-T253 VanDerWaalsContact O-N 3.07Å
254T80.9Confident84.7Confident15 Ų1542 Ų429%0.09224%0.235CC..SBendtrans-64.3143.8173.352.30000111T107 V236 I251 D252 F256 A257 G258T107-T254 WeakPolarHBondContact OG1-CG2 3.46Å; T107-T254 PolarHBondContact OG1-N 2.91Å; V236-T254 HydrophobicContact CG2-CG2 4.4Å; I251-T254 WeakPolarHBondContact O-CB 3.39Å; I251-T254 VanDerWaalsContact O-CG2 3.27Å; I251-T254 WeakPolarHBondContact O-CG2 3.3Å; I251-T254 PolarHBondContact O-N 3.03Å; I251-T254 PolarHBondContact O-OG1 2.94Å; D252-T254 VanDerWaalsContact C-N 3.27Å; T254-F256 VanDerWaalsContact C-N 3.28Å; T254-F256 PolarHBondContact O-N 2.89Å; T254-A257 PolarHBondContact O-N 3.47Å; T254-A257 VanDerWaalsContact O-N 3.1Å; T254-A257 VanDerWaalsContact OG1-CB 3.24Å; T254-A257 WeakPolarHBondContact OG1-CB 3.49Å; T254-G258 PolarHBondContact O-N 2.67Å; T254-G258 VanDerWaalsContact O-N 3.08Å
255P81.3Confident84.9Confident9 Ų938.6 Ų38.66%0.05821%0.206CC..Hα-helixtrans-44.4-47.7176-36.240.3000114.5L69 W73 G258 L259L69-P255 VanDerWaalsContact CD1-CA 3.47Å; L69-P255 HydrophobicContact CD1-CB 3.32Å; L69-P255 HydrophobicContact CD1-CG 4.37Å; L69-P255 WeakPolarHBondContact CD1-O 3.34Å; W73-P255 HydrophobicContact CZ2-CB 3.88Å; P255-G258 PolarHBondContact O-N 2.96Å; P255-L259 PolarHBondContact O-N 3.38Å
256F84.6Confident85.3Confident41 Ų4136.4 Ų36.418%0.1819%0.194CC..Hα-helixtrans-71.4-37.5-179.4-74-75.7000113.7W73 Y222 T254 G258 L259 V260 Y321W73-F256 HydrophobicContact CH2-CE1 4.42Å; W73-F256 HydrophobicContact CH2-CZ 4.39Å; W73-F256 HydrophobicContact CZ2-CE2 4.33Å; W73-F256 HydrophobicContact CZ2-CZ 4.21Å; Y222-F256 HydrophobicContact CD1-CZ 4.07Å; Y222-F256 AromaticContact CD2-CE2 3.86Å; Y222-F256 HydrophobicContact CD2-CE2 3.86Å; Y222-F256 AromaticContact CD2-CZ 3.5Å; Y222-F256 HydrophobicContact CD2-CZ 3.5Å; Y222-F256 VanDerWaalsContact CD2-CZ 3.5Å; Y222-F256 HydrophobicContact CE1-CZ 4.42Å; Y222-F256 AromaticContact CE2-CE2 3.97Å; Y222-F256 HydrophobicContact CE2-CE2 3.97Å; Y222-F256 AromaticContact CE2-CZ 3.92Å; Y222-F256 HydrophobicContact CE2-CZ 3.92Å; Y222-F256 HydrophobicContact CG-CE2 4.43Å; Y222-F256 AromaticContact CG-CZ 3.61Å; Y222-F256 HydrophobicContact CG-CZ 3.61Å; T254-F256 VanDerWaalsContact C-N 3.28Å; T254-F256 PolarHBondContact O-N 2.89Å; F256-G258 VanDerWaalsContact C-N 3.29Å; F256-G258 PolarHBondContact O-N 3.3Å; F256-L259 PolarHBondContact O-N 2.89Å; F256-V260 WeakPolarHBondContact O-CG2 3.44Å; F256-V260 PolarHBondContact O-N 2.84Å; F256-Y321 HydrophobicContact CB-CE1 3.99Å
257A85.8Confident85.8Confident7 Ų734.8 Ų34.86%0.05818%0.177CC..Hα-helixtrans-62.3-41175.400000110.9T254 R261 F320 Y321T254-A257 PolarHBondContact O-N 3.47Å; T254-A257 VanDerWaalsContact O-N 3.1Å; T254-A257 VanDerWaalsContact OG1-CB 3.24Å; T254-A257 WeakPolarHBondContact OG1-CB 3.49Å; A257-R261 WeakPolarHBondContact O-CB 3.22Å; A257-R261 PolarHBondContact O-N 3.35Å; A257-F320 HydrophobicContact CB-CE1 4.01Å; A257-F320 HydrophobicContact CB-CZ 4.36Å; A257-Y321 HydrophobicContact CB-CE1 4.37Å
258G87.4Confident86.3Confident11 Ų1128 Ų2811%0.11314%0.141CC..Hα-helixtrans-58.7-50.217200000112.6T254 P255 F256 V260 R261 N262T254-G258 PolarHBondContact O-N 2.67Å; T254-G258 VanDerWaalsContact O-N 3.08Å; P255-G258 PolarHBondContact O-N 2.96Å; F256-G258 VanDerWaalsContact C-N 3.29Å; F256-G258 PolarHBondContact O-N 3.3Å; G258-V260 PolarHBondContact O-N 3.05Å; G258-R261 PolarHBondContact O-N 2.9Å; G258-N262 VanDerWaalsContact O-CG 3.23Å; G258-N262 PolarHBondContact O-N 3.31Å; G258-N262 PolarHBondContact O-ND2 3.37Å
259L91.3Very high86.8Confident2 Ų224.7 Ų24.71%0.0113%0.129CC..Hα-helixtrans-55-51.5177.4179.863.7000112L69 F215 A218 P255 F256 R261 N262 L263L69-L259 HydrophobicContact CD2-CB 3.91Å; L69-L259 HydrophobicContact CD2-CD1 4.07Å; L69-L259 HydrophobicContact CD2-CG 4.39Å; F215-L259 HydrophobicContact CD2-CD2 4.27Å; A218-L259 HydrophobicContact CB-CD1 4.08Å; A218-L259 HydrophobicContact CB-CD2 3.65Å; P255-L259 PolarHBondContact O-N 3.38Å; F256-L259 PolarHBondContact O-N 2.89Å; L259-R261 VanDerWaalsContact C-N 3.34Å; L259-R261 PolarHBondContact O-N 3.38Å; L259-N262 PolarHBondContact O-N 3.37Å; L259-L263 HydrophobicContact CD1-CD1 4.1Å; L259-L263 HydrophobicContact CD1-CG 4.25Å; L259-L263 HydrophobicContact CG-CD1 3.93Å; L259-L263 HydrophobicContact CG-CG 4.46Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.36Å; L259-L263 PolarHBondContact O-N 3.38Å
260V92.6Very high87.3Confident23 Ų2323.1 Ų23.114%0.13912%0.121CC..Hα-helixtrans-63.6-40-177.1173.80000111.6F256 G258 G264 Y321 F325F256-V260 WeakPolarHBondContact O-CG2 3.44Å; F256-V260 PolarHBondContact O-N 2.84Å; G258-V260 PolarHBondContact O-N 3.05Å; V260-G264 PolarHBondContact O-N 3.36Å; V260-Y321 VanDerWaalsContact CG1-O 3.25Å; V260-Y321 WeakPolarHBondContact CG1-O 3.24Å; V260-Y321 HydrophobicContact CG2-CD1 4.06Å; V260-F325 HydrophobicContact CG1-CB 3.59Å; V260-F325 HydrophobicContact CG1-CD2 4.26Å; V260-F325 HydrophobicContact CG1-CG 4.44Å
261R91.8Very high88.1Confident56 Ų5623.7 Ų23.721%0.21112%0.124CC..Hα-helixtrans-61.5-44.2174171168.270.483.714112D65 A257 G258 L259 G264 A265 S328D65-R261 IonicContact OD2-NH2 3.55Å; D65-R261 PolarHBondContact OD2-NH2 2.99Å; A257-R261 WeakPolarHBondContact O-CB 3.22Å; A257-R261 PolarHBondContact O-N 3.35Å; G258-R261 PolarHBondContact O-N 2.9Å; L259-R261 VanDerWaalsContact C-N 3.34Å; L259-R261 PolarHBondContact O-N 3.38Å; R261-G264 PolarHBondContact O-N 3.22Å; R261-A265 WeakPolarHBondContact O-CB 3.5Å; R261-A265 PolarHBondContact O-N 2.63Å; R261-S328 WeakPolarHBondContact CA-OG 3.27Å; R261-S328 VanDerWaalsContact CG-OG 3.29Å; R261-S328 WeakPolarHBondContact CG-OG 3.32Å; R261-S328 VanDerWaalsContact O-CB 3.23Å; R261-S328 WeakPolarHBondContact O-CB 3.41Å
262N93Very high89Confident4 Ų419.7 Ų19.72%0.02110%0.103CC..Hα-helixtrans-65.3-43.5179.6-70.7-24.2000112.5V62 D65 G258 L259 G264 A265 L266V62-N262 HydrophobicContact CB-CB 4.47Å; V62-N262 HydrophobicContact CG1-CB 4.05Å; V62-N262 HydrophobicContact CG2-CB 4.24Å; V62-N262 WeakPolarHBondContact CG2-O 3.4Å; D65-N262 WeakPolarHBondContact CB-ND2 3.38Å; D65-N262 PolarHBondContact OD2-ND2 3.12Å; D65-N262 PolarHBondContact OD2-OD1 2.91Å; G258-N262 VanDerWaalsContact O-CG 3.23Å; G258-N262 PolarHBondContact O-N 3.31Å; G258-N262 PolarHBondContact O-ND2 3.37Å; L259-N262 PolarHBondContact O-N 3.37Å; N262-G264 VanDerWaalsContact C-N 3.35Å; N262-A265 PolarHBondContact O-N 3.12Å; N262-L266 WeakPolarHBondContact O-CB 3.33Å; N262-L266 PolarHBondContact O-N 3.14Å
263L94.6Very high90.1Very high12 Ų1217.9 Ų17.96%0.0639%0.093CC..Hα-helixtrans-62.1-44.8174.9-65.8171.2000111N211 L214 F215 L259 A265 L266 F267 F325N211-L263 HydrophobicContact CB-CD2 4.25Å; N211-L263 VanDerWaalsContact O-CD2 3.3Å; N211-L263 WeakPolarHBondContact O-CD2 3Å; N211-L263 WeakPolarHBondContact OD1-CA 3.43Å; N211-L263 WeakPolarHBondContact OD1-CD2 3.47Å; N211-L263 PolarHBondContact OD1-O 3.31Å; L214-L263 HydrophobicContact CB-CD2 3.89Å; L214-L263 HydrophobicContact CD1-CD2 4.46Å; F215-L263 HydrophobicContact CB-CD1 3.73Å; F215-L263 HydrophobicContact CB-CD2 4.36Å; F215-L263 HydrophobicContact CD2-CD1 3.61Å; F215-L263 HydrophobicContact CG-CD1 4.07Å; L259-L263 HydrophobicContact CD1-CD1 4.1Å; L259-L263 HydrophobicContact CD1-CG 4.25Å; L259-L263 HydrophobicContact CG-CD1 3.93Å; L259-L263 HydrophobicContact CG-CG 4.46Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.36Å; L259-L263 PolarHBondContact O-N 3.38Å; L263-A265 PolarHBondContact O-N 3.01Å; L263-L266 PolarHBondContact O-N 2.62Å; L263-F267 WeakPolarHBondContact O-CB 3.35Å; L263-F267 PolarHBondContact O-N 3.17Å; L263-F325 HydrophobicContact CB-CD2 4.4Å; L263-F325 HydrophobicContact CB-CE2 4.05Å
264G94.9Very high90.9Very high0 Ų019.3 Ų19.30%010%0.099CC..Hα-helixtrans-55.7-52.5174.600000111.4V260 R261 N262 L266 F267 G268 F325 A329V260-G264 PolarHBondContact O-N 3.36Å; R261-G264 PolarHBondContact O-N 3.22Å; N262-G264 VanDerWaalsContact C-N 3.35Å; G264-L266 PolarHBondContact O-N 3.36Å; G264-F267 PolarHBondContact O-N 3.43Å; G264-G268 PolarHBondContact O-N 2.76Å; G264-F325 VanDerWaalsContact CA-CE2 3.41Å; G264-F325 VanDerWaalsContact N-CE2 3.35Å; G264-A329 WeakPolarHBondContact O-CA 3.28Å; G264-A329 VanDerWaalsContact O-CB 3.25Å; G264-A329 WeakPolarHBondContact O-CB 3.4Å
265A94.8Very high91.3Very high1 Ų119.8 Ų19.81%0.00810%0.103CC..Hα-helixtrans-59.7-45.8-179.500000112.8F39 V62 R261 N262 L263 G268 L269 S328 P332F39-A265 HydrophobicContact CD1-CB 3.97Å; F39-A265 HydrophobicContact CE1-CB 3.52Å; F39-A265 HydrophobicContact CZ-CB 4.28Å; V62-A265 HydrophobicContact CG2-CB 4.33Å; R261-A265 WeakPolarHBondContact O-CB 3.5Å; R261-A265 PolarHBondContact O-N 2.63Å; N262-A265 PolarHBondContact O-N 3.12Å; L263-A265 PolarHBondContact O-N 3.01Å; A265-G268 PolarHBondContact O-N 2.61Å; A265-L269 WeakPolarHBondContact O-CB 3.42Å; A265-L269 PolarHBondContact O-N 3.27Å; A265-S328 WeakPolarHBondContact CA-O 3.49Å; A265-P332 HydrophobicContact CB-CG 4.16Å; A265-P332 WeakPolarHBondContact O-CG 3.35Å
266L94.5Very high91.6Very high0 Ų027.1 Ų27.10%014%0.137CC..Hα-helixtrans-66.3-40.5179.3-171.962.8000111.9W59 V62 Y207 I210 N211 L214 N262 L263 G264 G270W59-L266 HydrophobicContact CD2-CD1 3.77Å; W59-L266 HydrophobicContact CE3-CD1 4.04Å; W59-L266 HydrophobicContact CG-CD1 4.29Å; W59-L266 HydrophobicContact CH2-CD1 4.23Å; W59-L266 HydrophobicContact CH2-CD2 4.44Å; W59-L266 HydrophobicContact CZ2-CD1 3.97Å; W59-L266 HydrophobicContact CZ3-CD1 4.28Å; W59-L266 HydrophobicContact CZ3-CD2 4.31Å; V62-L266 HydrophobicContact CG1-CB 4.11Å; V62-L266 HydrophobicContact CG1-CD2 4.07Å; V62-L266 HydrophobicContact CG2-CB 4.24Å; Y207-L266 HydrophobicContact CD1-CD1 3.83Å; Y207-L266 HydrophobicContact CD1-CG 4.06Å; Y207-L266 WeakPolarHBondContact CD1-O 3.21Å; Y207-L266 HydrophobicContact CE1-CD1 3.83Å; I210-L266 HydrophobicContact CG2-CD2 3.87Å; N211-L266 WeakPolarHBondContact ND2-CG 3.4Å; L214-L266 HydrophobicContact CD1-CD2 4.13Å; N262-L266 WeakPolarHBondContact O-CB 3.33Å; N262-L266 PolarHBondContact O-N 3.14Å; L263-L266 PolarHBondContact O-N 2.62Å; G264-L266 PolarHBondContact O-N 3.36Å; L266-G270 PolarHBondContact O-N 2.72Å
267F94.8Very high91.7Very high62 Ų6228.9 Ų28.927%0.27215%0.147SC..Hα-helixtrans-63.6-46.5175.3-179.3-106.3000112I208 N211 L263 G264 L269 G270 L271 F325 A329I208-F267 HydrophobicContact CG1-CE2 4.35Å; N211-F267 PolarHBondContact ND2-N 3.36Å; L263-F267 WeakPolarHBondContact O-CB 3.35Å; L263-F267 PolarHBondContact O-N 3.17Å; G264-F267 PolarHBondContact O-N 3.43Å; F267-L269 VanDerWaalsContact C-N 3.33Å; F267-L269 PolarHBondContact O-N 2.88Å; F267-G270 PolarHBondContact O-N 3.5Å; F267-L271 HydrophobicContact CD1-CD1 3.93Å; F267-L271 HydrophobicContact CD1-CG 4.48Å; F267-L271 HydrophobicContact CE1-CD1 3.33Å; F267-L271 HydrophobicContact CE1-CG 4.09Å; F267-L271 HydrophobicContact CE2-CD1 4.47Å; F267-L271 HydrophobicContact CE2-CG 4.42Å; F267-L271 HydrophobicContact CZ-CD1 3.65Å; F267-L271 HydrophobicContact CZ-CD2 4.33Å; F267-L271 HydrophobicContact CZ-CG 4.05Å; F267-L271 PolarHBondContact O-N 2.81Å; F267-F325 HydrophobicContact CB-CZ 4.07Å; F267-F325 HydrophobicContact CD1-CE1 4.07Å; F267-F325 AromaticContact CD1-CZ 3.81Å; F267-F325 HydrophobicContact CD1-CZ 3.81Å; F267-F325 HydrophobicContact CG-CZ 4.06Å; F267-A329 HydrophobicContact CD1-CB 4.49Å
268G94.8Very high91.7Very high0 Ų029 Ų290%015%0.146CC..Hα-helixtrans-60.4-39.8177.100000113G264 A265 G272 A329G264-G268 PolarHBondContact O-N 2.76Å; A265-G268 PolarHBondContact O-N 2.61Å; G268-G272 PolarHBondContact O-N 3.49Å; G268-A329 WeakPolarHBondContact CA-O 3.31Å
269L94.4Very high91.5Very high0 Ų032.5 Ų32.50%016%0.161CC..Hα-helixtrans-64.1-46173.8-178.567.1000111.5F43 T55 I58 Y207 A265 F267 L271 G272 I273 P332 V336F43-L269 HydrophobicContact CE2-CD1 4.27Å; F43-L269 HydrophobicContact CZ-CD1 4.05Å; T55-L269 HydrophobicContact CG2-CD2 4.15Å; I58-L269 HydrophobicContact CB-CD2 3.6Å; I58-L269 HydrophobicContact CG1-CD2 4.12Å; I58-L269 HydrophobicContact CG2-CB 4.34Å; I58-L269 HydrophobicContact CG2-CD2 3.61Å; Y207-L269 HydrophobicContact CE1-CD2 4.13Å; Y207-L269 HydrophobicContact CE1-CG 4.27Å; A265-L269 WeakPolarHBondContact O-CB 3.42Å; A265-L269 PolarHBondContact O-N 3.27Å; F267-L269 VanDerWaalsContact C-N 3.33Å; F267-L269 PolarHBondContact O-N 2.88Å; L269-L271 VanDerWaalsContact C-N 3.35Å; L269-L271 PolarHBondContact O-N 3.38Å; L269-G272 PolarHBondContact O-N 3.46Å; L269-I273 HydrophobicContact CD1-CD1 3.64Å; L269-I273 HydrophobicContact CD1-CG1 4.02Å; L269-I273 HydrophobicContact CD2-CD1 4.43Å; L269-I273 HydrophobicContact CG-CD1 3.79Å; L269-I273 HydrophobicContact CG-CG1 4.4Å; L269-I273 WeakPolarHBondContact O-CG1 3.36Å; L269-I273 PolarHBondContact O-N 3.33Å; L269-P332 HydrophobicContact CB-CB 3.98Å; L269-P332 HydrophobicContact CD1-CB 4.43Å; L269-V336 HydrophobicContact CD1-CG2 3.8Å
270G93Very high91.1Very high0 Ų035.9 Ų35.90%018%0.181CC..Hα-helixtrans-57.5-46.5177.600000112.2L266 F267 N274L266-G270 PolarHBondContact O-N 2.72Å; F267-G270 PolarHBondContact O-N 3.5Å; G270-N274 WeakPolarHBondContact O-CB 3.37Å; G270-N274 PolarHBondContact O-N 3.4Å; G270-N274 PolarHBondContact O-ND2 2.72Å
271L93.6Very high90.5Very high63 Ų6334.8 Ų34.833%0.3318%0.175SC..Hα-helixtrans-62.9-44.9173.9-72.5179.8000112L204 F267 L269 N274 S275 L333L204-L271 HydrophobicContact CD1-CD2 3.98Å; L204-L271 HydrophobicContact CD2-CD2 4.33Å; F267-L271 HydrophobicContact CD1-CD1 3.93Å; F267-L271 HydrophobicContact CD1-CG 4.48Å; F267-L271 HydrophobicContact CE1-CD1 3.33Å; F267-L271 HydrophobicContact CE1-CG 4.09Å; F267-L271 HydrophobicContact CE2-CD1 4.47Å; F267-L271 HydrophobicContact CE2-CG 4.42Å; F267-L271 HydrophobicContact CZ-CD1 3.65Å; F267-L271 HydrophobicContact CZ-CD2 4.33Å; F267-L271 HydrophobicContact CZ-CG 4.05Å; F267-L271 PolarHBondContact O-N 2.81Å; L269-L271 VanDerWaalsContact C-N 3.35Å; L269-L271 PolarHBondContact O-N 3.38Å; L271-N274 PolarHBondContact O-N 3.47Å; L271-S275 WeakPolarHBondContact O-CB 3.44Å; L271-S275 PolarHBondContact O-N 3.22Å; L271-S275 VanDerWaalsContact O-N 3.08Å; L271-L333 HydrophobicContact CB-CD1 4.19Å
272G91.4Very high89.9Confident0 Ų032.4 Ų32.40%017%0.167CC..Hα-helixtrans-58.4-55.2-179.100000112.6G268 L269 N274 S275 F278G268-G272 PolarHBondContact O-N 3.49Å; L269-G272 PolarHBondContact O-N 3.46Å; G272-N274 VanDerWaalsContact C-N 3.29Å; G272-N274 PolarHBondContact O-N 2.99Å; G272-S275 WeakPolarHBondContact O-CB 3.4Å; G272-S275 PolarHBondContact O-N 3.27Å; G272-S275 PolarHBondContact O-OG 3.45Å; G272-F278 WeakPolarHBondContact O-CB 3.3Å
273I90.5Very high89Confident33 Ų3339.4 Ų39.417%0.16920%0.197CC..Hα-helixtrans-66.5-32-175.8-65175.4000111.9T55 L269 F278 V336T55-I273 HydrophobicContact CG2-CD1 3.54Å; T55-I273 VanDerWaalsContact OG1-CD1 3.28Å; T55-I273 WeakPolarHBondContact OG1-CD1 3.24Å; L269-I273 HydrophobicContact CD1-CD1 3.64Å; L269-I273 HydrophobicContact CD1-CG1 4.02Å; L269-I273 HydrophobicContact CD2-CD1 4.43Å; L269-I273 HydrophobicContact CG-CD1 3.79Å; L269-I273 HydrophobicContact CG-CG1 4.4Å; L269-I273 WeakPolarHBondContact O-CG1 3.36Å; L269-I273 PolarHBondContact O-N 3.33Å; I273-F278 HydrophobicContact CG2-CE1 4.24Å; I273-F278 WeakPolarHBondContact O-CD1 3.47Å; I273-V336 HydrophobicContact CG1-CG1 3.84Å
274N89.3Confident87.8Confident66 Ų6640 Ų4035%0.35321%0.206SC..THydrogen-bonded Turntrans-91.94.3-179.3-67.7-92.8000113.2L204 G270 L271 G272L204-N274 HydrophobicContact CB-CB 4.06Å; L204-N274 PolarHBondContact N-OD1 3.38Å; G270-N274 WeakPolarHBondContact O-CB 3.37Å; G270-N274 PolarHBondContact O-N 3.4Å; G270-N274 PolarHBondContact O-ND2 2.72Å; L271-N274 PolarHBondContact O-N 3.47Å; G272-N274 VanDerWaalsContact C-N 3.29Å; G272-N274 PolarHBondContact O-N 2.99Å
275S89.6Confident86.2Confident26 Ų2649.7 Ų49.718%0.18225%0.249CC..SBendtrans-80.8150.7179.670.30000113L271 G272 M277 F278 I279 A337L271-S275 WeakPolarHBondContact O-CB 3.44Å; L271-S275 PolarHBondContact O-N 3.22Å; L271-S275 VanDerWaalsContact O-N 3.08Å; G272-S275 WeakPolarHBondContact O-CB 3.4Å; G272-S275 PolarHBondContact O-N 3.27Å; G272-S275 PolarHBondContact O-OG 3.45Å; S275-M277 PolarHBondContact O-N 3.35Å; S275-F278 PolarHBondContact O-N 3.03Å; S275-F278 PolarHBondContact OG-N 2.86Å; S275-I279 PolarHBondContact O-N 3.02Å; S275-A337 WeakPolarHBondContact OG-CB 3.08Å
276E86.3Confident84.8Confident163 Ų16350.8 Ų50.876%0.76225%0.254SS*.Hα-helixtrans-62.3-30.4171.2-66.5-173.3170.900112.4I279 T280E276-I279 PolarHBondContact O-N 3.1Å; E276-T280 WeakPolarHBondContact O-CB 3.38Å; E276-T280 PolarHBondContact O-N 3.42Å; E276-T280 PolarHBondContact O-OG1 3.35Å
277M86.5Confident83.4Confident78 Ų7851.3 Ų51.338%0.38426%0.258SS..Hα-helixtrans-60.5-45175.9-68.9177.3-175.400111.6S275 S281 A337 L338 Y341S275-M277 PolarHBondContact O-N 3.35Å; M277-S281 WeakPolarHBondContact O-CB 3.34Å; M277-S281 PolarHBondContact O-N 3Å; M277-S281 VanDerWaalsContact O-N 3.15Å; M277-S281 PolarHBondContact O-OG 3.21Å; M277-A337 HydrophobicContact CB-CB 4.15Å; M277-L338 HydrophobicContact SD-CD2 3.92Å; M277-Y341 HydrophobicContact CB-CD2 4.16Å; M277-Y341 HydrophobicContact CB-CG 4.16Å; M277-Y341 HydrophobicContact CG-CD1 4.38Å; M277-Y341 HydrophobicContact CG-CD2 4.17Å; M277-Y341 HydrophobicContact CG-CG 4.09Å
278F85.9Confident82.1Confident10 Ų1053.2 Ų53.24%0.04428%0.278CS..Hα-helixtrans-64.7-46.6175.7172.2-104.3000111.5F47 G272 I273 S275 T280 S281 C282 V336F47-F278 HydrophobicContact CE1-CE2 4.3Å; F47-F278 HydrophobicContact CZ-CD2 4.45Å; F47-F278 AromaticContact CZ-CE2 3.8Å; F47-F278 HydrophobicContact CZ-CE2 3.8Å; G272-F278 WeakPolarHBondContact O-CB 3.3Å; I273-F278 HydrophobicContact CG2-CE1 4.24Å; I273-F278 WeakPolarHBondContact O-CD1 3.47Å; S275-F278 PolarHBondContact O-N 3.03Å; S275-F278 PolarHBondContact OG-N 2.86Å; F278-T280 VanDerWaalsContact C-N 3.34Å; F278-T280 PolarHBondContact O-N 3.33Å; F278-S281 PolarHBondContact O-N 3.29Å; F278-C282 HydrophobicContact CD2-CB 3.57Å; F278-C282 HydrophobicContact CE2-CB 3.41Å; F278-C282 VanDerWaalsContact CE2-CB 3.41Å; F278-C282 HydrophobicContact CG-CB 4.36Å; F278-C282 HydrophobicContact CZ-CB 4.1Å; F278-C282 VanDerWaalsContact O-CB 3.3Å; F278-C282 WeakPolarHBondContact O-CB 3.5Å; F278-C282 PolarHBondContact O-N 3.36Å; F278-V336 HydrophobicContact CD2-CG1 3.76Å; F278-V336 WeakPolarHBondContact CD2-O 3.38Å; F278-V336 HydrophobicContact CE2-CG1 4.27Å; F278-V336 HydrophobicContact CG-CG1 4.27Å
279I84.3Confident81.5Confident84 Ų8457.1 Ų57.143%0.43130%0.295SS..Hα-helixtrans-59.1-46.9179.8-64.7171.7000110.6S275 E276 S281 K283S275-I279 PolarHBondContact O-N 3.02Å; E276-I279 PolarHBondContact O-N 3.1Å; I279-S281 PolarHBondContact O-N 3.26Å; I279-K283 HydrophobicContact CG2-CD 4.39Å; I279-K283 WeakPolarHBondContact O-CB 3.48Å; I279-K283 PolarHBondContact O-N 3.11Å
280T81.8Confident81Confident72 Ų7263.2 Ų63.244%0.44233%0.326SS..Hα-helixtrans-64.6-39.4-177.6-55.60000112.4E276 F278E276-T280 WeakPolarHBondContact O-CB 3.38Å; E276-T280 PolarHBondContact O-N 3.42Å; E276-T280 PolarHBondContact O-OG1 3.35Å; F278-T280 VanDerWaalsContact C-N 3.34Å; F278-T280 PolarHBondContact O-N 3.33Å
281S81.1Confident80.6Confident0 Ų066.5 Ų66.50%035%0.349CS..Hα-helixtrans-90.5-51.1-170.6-44.20000112.1M277 F278 I279 Y341M277-S281 WeakPolarHBondContact O-CB 3.34Å; M277-S281 PolarHBondContact O-N 3Å; M277-S281 VanDerWaalsContact O-N 3.15Å; M277-S281 PolarHBondContact O-OG 3.21Å; F278-S281 PolarHBondContact O-N 3.29Å; I279-S281 PolarHBondContact O-N 3.26Å; S281-Y341 WeakPolarHBondContact OG-CA 3.33Å; S281-Y341 WeakPolarHBondContact OG-CB 3.25Å; S281-Y341 PolarHBondContact OG-N 2.89Å
282C77.9Confident80.3Confident7 Ų763.5 Ų63.55%0.04733%0.333CS..Hα-helixtrans-90.7-19.9-168.9-72.70000113.9F278 S287 P340F278-C282 HydrophobicContact CD2-CB 3.57Å; F278-C282 HydrophobicContact CE2-CB 3.41Å; F278-C282 VanDerWaalsContact CE2-CB 3.41Å; F278-C282 HydrophobicContact CG-CB 4.36Å; F278-C282 HydrophobicContact CZ-CB 4.1Å; F278-C282 VanDerWaalsContact O-CB 3.3Å; F278-C282 WeakPolarHBondContact O-CB 3.5Å; F278-C282 PolarHBondContact O-N 3.36Å; C282-S287 WeakPolarHBondContact O-CB 3.27Å; C282-S287 PolarHBondContact O-OG 2.9Å; C282-P340 VanDerWaalsContact SG-CB 3.57Å
283K75.5Confident80.2Confident150 Ų15067.8 Ų67.865%0.65235%0.349SS*.SBendtrans-97.7-1.5171.3-60.8-175.9169.7177.50113.6I279I279-K283 HydrophobicContact CG2-CD 4.39Å; I279-K283 WeakPolarHBondContact O-CB 3.48Å; I279-K283 PolarHBondContact O-N 3.11Å
284G68.4Low80.1Confident25 Ų2571.6 Ų71.626%0.25837%0.369SS..SBendtrans-79.3165.2176.100000113.8N286 S287G284-N286 PolarHBondContact O-N 2.85Å; G284-N286 VanDerWaalsContact O-N 3.12Å; G284-S287 WeakPolarHBondContact O-CB 3.49Å; G284-S287 PolarHBondContact O-N 3.49Å; G284-S287 VanDerWaalsContact O-N 3.13Å
285K62.8Low80.2Confident204 Ų20471.9 Ų71.989%0.88737%0.37SS*.G310 helixtrans-56.2-28.3180-70.5-178.2177.4179.30114.2
286N63.8Low80.3Confident24 Ų2470.6 Ų70.613%0.12836%0.361CS..G310 helixtrans-77.6-16.5-178.5-76.7-10000114.2G284 C288 K289 F292G284-N286 PolarHBondContact O-N 2.85Å; G284-N286 VanDerWaalsContact O-N 3.12Å; N286-C288 PolarHBondContact O-N 3.34Å; N286-K289 WeakPolarHBondContact O-CB 3.2Å; N286-K289 PolarHBondContact O-N 3.24Å; N286-K289 VanDerWaalsContact O-N 3.09Å; N286-K289 VanDerWaalsContact OD1-CE 3.29Å; N286-K289 WeakPolarHBondContact OD1-CE 3.28Å; N286-K289 PolarHBondContact OD1-NZ 3.47Å; N286-F292 WeakPolarHBondContact O-CB 3.31Å
287S65.9Low80.5Confident11 Ų1164 Ų648%0.07733%0.332CS..G310 helixtrans-64.2-24.8-180-176.30000113.6C282 G284 K289 R293C282-S287 WeakPolarHBondContact O-CB 3.27Å; C282-S287 PolarHBondContact O-OG 2.9Å; G284-S287 WeakPolarHBondContact O-CB 3.49Å; G284-S287 PolarHBondContact O-N 3.49Å; G284-S287 VanDerWaalsContact O-N 3.13Å; S287-K289 VanDerWaalsContact C-N 3.34Å; S287-R293 PolarHBondContact O-NE 3.44Å
288C66.9Low80.7Confident102 Ų10262.9 Ų62.969%0.68934%0.335SS*.G310 helixtrans-79.9-12.6176.6-680000113.6N286 I290N286-C288 PolarHBondContact O-N 3.34Å; C288-I290 PolarHBondContact O-N 3.39Å
289K82.2Confident81Confident81 Ų8163.9 Ų63.935%0.35235%0.345SS..  trans-71.4130.2179.8-65.3-176.1-178.8-178.20109.8N286 S287 S291 F292 R293 M347 E351N286-K289 WeakPolarHBondContact O-CB 3.2Å; N286-K289 PolarHBondContact O-N 3.24Å; N286-K289 VanDerWaalsContact O-N 3.09Å; N286-K289 VanDerWaalsContact OD1-CE 3.29Å; N286-K289 WeakPolarHBondContact OD1-CE 3.28Å; N286-K289 PolarHBondContact OD1-NZ 3.47Å; S287-K289 VanDerWaalsContact C-N 3.34Å; K289-S291 PolarHBondContact O-N 3.25Å; K289-F292 HydrophobicContact CB-CB 4.19Å; K289-F292 WeakPolarHBondContact O-CB 3.4Å; K289-F292 PolarHBondContact O-N 3.05Å; K289-F292 VanDerWaalsContact O-N 3.14Å; K289-R293 PolarHBondContact O-N 3.46Å; K289-M347 HydrophobicContact CD-CE 4.27Å; K289-E351 IonicContact NZ-OE1 3.13Å; K289-E351 PolarHBondContact NZ-OE1 3.08Å
290I84.1Confident81.4Confident128 Ų12859.9 Ų59.966%0.65633%0.325SS*.Hα-helixtrans-59.1-38.9176.6-66.9169.4000110.8C288 F292 R293 I294C288-I290 PolarHBondContact O-N 3.39Å; I290-F292 VanDerWaalsContact C-N 3.33Å; I290-F292 PolarHBondContact O-N 3.48Å; I290-R293 PolarHBondContact O-N 2.96Å; I290-I294 HydrophobicContact CG2-CD1 3.62Å; I290-I294 HydrophobicContact CG2-CG1 4.15Å; I290-I294 WeakPolarHBondContact O-CG1 3Å; I290-I294 PolarHBondContact O-N 3.25Å
291S85.4Confident81.9Confident69 Ų6958.7 Ų58.748%0.48332%0.315SS..Hα-helixtrans-60.1-40176.854.60000112.9K289 L295K289-S291 PolarHBondContact O-N 3.25Å; S291-L295 VanDerWaalsContact O-CB 3.27Å; S291-L295 WeakPolarHBondContact O-CB 3.49Å; S291-L295 PolarHBondContact O-N 3Å
292F87.3Confident82.4Confident1 Ų161.2 Ų61.20%0.00434%0.336CS..Hα-helixtrans-62-47.2174.9176.1-95.4000111N286 K289 I290 L295 C296 P340 V343 H344 M347N286-F292 WeakPolarHBondContact O-CB 3.31Å; K289-F292 HydrophobicContact CB-CB 4.19Å; K289-F292 WeakPolarHBondContact O-CB 3.4Å; K289-F292 PolarHBondContact O-N 3.05Å; K289-F292 VanDerWaalsContact O-N 3.14Å; I290-F292 VanDerWaalsContact C-N 3.33Å; I290-F292 PolarHBondContact O-N 3.48Å; F292-L295 PolarHBondContact O-N 3.4Å; F292-C296 VanDerWaalsContact CZ-SG 3.52Å; F292-C296 WeakPolarHBondContact O-CB 3.46Å; F292-C296 PolarHBondContact O-N 2.79Å; F292-C296 PolarHBondContact O-SG 3.03Å; F292-P340 HydrophobicContact CZ-CB 3.98Å; F292-V343 HydrophobicContact CD2-CB 4.48Å; F292-V343 HydrophobicContact CD2-CG1 3.65Å; F292-V343 HydrophobicContact CE2-CB 4.14Å; F292-V343 HydrophobicContact CE2-CG1 3.8Å; F292-H344 HydrophobicContact CE2-CB 4.06Å; F292-M347 HydrophobicContact CB-CE 4.43Å; F292-M347 HydrophobicContact CB-SD 3.85Å; F292-M347 HydrophobicContact CD2-SD 3.76Å; F292-M347 HydrophobicContact CG-SD 4.32Å
293R87.9Confident82.9Confident89 Ų8963.3 Ų63.334%0.33635%0.349SS..Hα-helixtrans-63.8-46.2-180-65.7-179.7179.8-152.81.3112.2Q48 L49 S287 K289 I290 L295 C296 T297Q48-R293 WeakPolarHBondContact O-CD 2.93Å; L49-R293 PolarHBondContact O-NH1 3.42Å; S287-R293 PolarHBondContact O-NE 3.44Å; K289-R293 PolarHBondContact O-N 3.46Å; I290-R293 PolarHBondContact O-N 2.96Å; R293-L295 VanDerWaalsContact C-N 3.34Å; R293-L295 PolarHBondContact O-N 3.28Å; R293-C296 PolarHBondContact O-N 3.1Å; R293-T297 WeakPolarHBondContact O-CB 3.19Å; R293-T297 PolarHBondContact O-N 2.02Å; R293-T297 PolarHBondContact O-OG1 3.31Å
294I89.5Confident83.5Confident113 Ų11356.1 Ų56.158%0.57932%0.318SS*.Hα-helixtrans-60.4-46.4177.8-68.5173.3000110.3I290 T297 A298I290-I294 HydrophobicContact CG2-CD1 3.62Å; I290-I294 HydrophobicContact CG2-CG1 4.15Å; I290-I294 WeakPolarHBondContact O-CG1 3Å; I290-I294 PolarHBondContact O-N 3.25Å; I294-T297 PolarHBondContact O-N 3.44Å; I294-A298 WeakPolarHBondContact O-CB 3.15Å; I294-A298 PolarHBondContact O-N 3.28Å
295L91.4Very high84.3Confident72 Ų7259 Ų5938%0.37733%0.325SS..Hα-helixtrans-65.4-40.8180-174.355.7000111.8S291 F292 R293 A298 A299 V343S291-L295 VanDerWaalsContact O-CB 3.27Å; S291-L295 WeakPolarHBondContact O-CB 3.49Å; S291-L295 PolarHBondContact O-N 3Å; F292-L295 PolarHBondContact O-N 3.4Å; R293-L295 VanDerWaalsContact C-N 3.34Å; R293-L295 PolarHBondContact O-N 3.28Å; L295-A298 PolarHBondContact O-N 3.15Å; L295-A299 WeakPolarHBondContact O-CB 3.26Å; L295-A299 PolarHBondContact O-N 3.07Å; L295-V343 HydrophobicContact CB-CG1 4.16Å; L295-V343 HydrophobicContact CD2-CG1 3.66Å; L295-V343 HydrophobicContact CD2-CG2 4.38Å; L295-V343 HydrophobicContact CG-CG1 3.88Å; L295-V343 HydrophobicContact CG-CG2 4.01Å
296C90.6Very high85.4Confident0 Ų055 Ų550%031%0.312CS..Hα-helixtrans-63.7-42.3174.4-69.30000112.2Q48 F292 R293 S300 V339Q48-C296 HydrophobicContact CG-CB 4.18Å; F292-C296 VanDerWaalsContact CZ-SG 3.52Å; F292-C296 WeakPolarHBondContact O-CB 3.46Å; F292-C296 PolarHBondContact O-N 2.79Å; F292-C296 PolarHBondContact O-SG 3.03Å; R293-C296 PolarHBondContact O-N 3.1Å; C296-S300 WeakPolarHBondContact O-CB 3.46Å; C296-S300 PolarHBondContact O-N 3.2Å; C296-S300 PolarHBondContact O-OG 3.24Å; C296-V339 HydrophobicContact CB-CG1 4.36Å; C296-V339 WeakPolarHBondContact O-CG1 3.46Å
297T90.9Very high86.2Confident25 Ų2555.9 Ų55.915%0.15332%0.319CS..Hα-helixtrans-62.3-50.9176.3-62.30000110.9L45 Q48 R293 I294 A299 S300 L301L45-T297 HydrophobicContact CD2-CG2 3.56Å; Q48-T297 VanDerWaalsContact CB-OG1 3.31Å; Q48-T297 WeakPolarHBondContact CB-OG1 3.37Å; Q48-T297 WeakPolarHBondContact CG-OG1 3.46Å; R293-T297 WeakPolarHBondContact O-CB 3.19Å; R293-T297 PolarHBondContact O-N 2.02Å; R293-T297 PolarHBondContact O-OG1 3.31Å; I294-T297 PolarHBondContact O-N 3.44Å; T297-A299 PolarHBondContact O-N 3.25Å; T297-S300 PolarHBondContact O-N 3.16Å; T297-L301 HydrophobicContact CG2-CD1 3.99Å; T297-L301 HydrophobicContact CG2-CG 4.43Å; T297-L301 WeakPolarHBondContact O-CB 3.36Å; T297-L301 WeakPolarHBondContact O-CG 3.45Å; T297-L301 PolarHBondContact O-N 2.96Å
298A92Very high86.8Confident53 Ų5358.8 Ų58.844%0.43833%0.334SS..Hα-helixtrans-60.9-47-179.500000111.6I294 L295 S300 L301 A302I294-A298 WeakPolarHBondContact O-CB 3.15Å; I294-A298 PolarHBondContact O-N 3.28Å; L295-A298 PolarHBondContact O-N 3.15Å; A298-S300 PolarHBondContact O-N 3.37Å; A298-L301 PolarHBondContact O-N 3.28Å; A298-A302 VanDerWaalsContact O-CB 3.31Å; A298-A302 WeakPolarHBondContact O-CB 3.14Å; A298-A302 PolarHBondContact O-N 3.49Å
299A92.2Very high87.3Confident31 Ų3161.6 Ų61.626%0.25634%0.335SS..Hα-helixtrans-64.7-39.4177.700000112.3L295 T297 T303 V339L295-A299 WeakPolarHBondContact O-CB 3.26Å; L295-A299 PolarHBondContact O-N 3.07Å; T297-A299 PolarHBondContact O-N 3.25Å; A299-T303 VanDerWaalsContact O-CB 3.31Å; A299-T303 WeakPolarHBondContact O-CB 3.34Å; A299-T303 PolarHBondContact O-N 2.88Å; A299-T303 PolarHBondContact O-OG1 3.03Å; A299-V339 HydrophobicContact CB-CG1 3.65Å
300S92.1Very high87.2Confident0 Ų062.1 Ų62.10%035%0.345CS..Hα-helixtrans-64.3-49.7176.4-63.30000111.4C296 T297 A298 A302 T303 L304C296-S300 WeakPolarHBondContact O-CB 3.46Å; C296-S300 PolarHBondContact O-N 3.2Å; C296-S300 PolarHBondContact O-OG 3.24Å; T297-S300 PolarHBondContact O-N 3.16Å; A298-S300 PolarHBondContact O-N 3.37Å; S300-A302 PolarHBondContact O-N 3.43Å; S300-T303 PolarHBondContact O-N 2.96Å; S300-L304 WeakPolarHBondContact O-CB 3.48Å; S300-L304 WeakPolarHBondContact O-CG 3.49Å; S300-L304 PolarHBondContact O-N 3.14Å
301L91.9Very high86.8Confident47 Ų4765.3 Ų65.325%0.24635%0.354CS..Hα-helixtrans-60.4-47.1178.2-70.6175.5000111.1S40 P44 L45 T297 A298 T303 L304 Q305S40-L301 WeakPolarHBondContact O-CD2 3.39Å; P44-L301 HydrophobicContact CB-CD2 4.08Å; P44-L301 HydrophobicContact CB-CG 4.49Å; P44-L301 HydrophobicContact CG-CD2 4.27Å; L45-L301 HydrophobicContact CD2-CD1 4.28Å; T297-L301 HydrophobicContact CG2-CD1 3.99Å; T297-L301 HydrophobicContact CG2-CG 4.43Å; T297-L301 WeakPolarHBondContact O-CB 3.36Å; T297-L301 WeakPolarHBondContact O-CG 3.45Å; T297-L301 PolarHBondContact O-N 2.96Å; A298-L301 PolarHBondContact O-N 3.28Å; L301-T303 PolarHBondContact O-N 3.45Å; L301-L304 PolarHBondContact O-N 3.15Å; L301-Q305 WeakPolarHBondContact O-CB 3.14Å; L301-Q305 WeakPolarHBondContact O-CG 3.21Å; L301-Q305 PolarHBondContact O-N 3.28Å
302A90.8Very high86.4Confident53 Ų5363.9 Ų63.944%0.43834%0.34SS..Hα-helixtrans-59.6-46.817800000111.9A298 S300 L304 Q305 L306A298-A302 VanDerWaalsContact O-CB 3.31Å; A298-A302 WeakPolarHBondContact O-CB 3.14Å; A298-A302 PolarHBondContact O-N 3.49Å; S300-A302 PolarHBondContact O-N 3.43Å; A302-L304 PolarHBondContact O-N 3.35Å; A302-Q305 PolarHBondContact O-N 3.15Å; A302-L306 WeakPolarHBondContact O-CG 3.38Å; A302-L306 PolarHBondContact O-N 3.3Å
303T88.4Confident85.9Confident51 Ų5166.9 Ų66.931%0.31336%0.36SS..Hα-helixtrans-63.7-43.4-179.9-53.80000111.5A299 S300 L301 L306 C307 T334A299-T303 VanDerWaalsContact O-CB 3.31Å; A299-T303 WeakPolarHBondContact O-CB 3.34Å; A299-T303 PolarHBondContact O-N 2.88Å; A299-T303 PolarHBondContact O-OG1 3.03Å; S300-T303 PolarHBondContact O-N 2.96Å; L301-T303 PolarHBondContact O-N 3.45Å; T303-L306 WeakPolarHBondContact O-CB 3.26Å; T303-L306 PolarHBondContact O-N 3.5Å; T303-C307 PolarHBondContact O-N 2.63Å; T303-C307 PolarHBondContact O-SG 2.92Å; T303-T334 HydrophobicContact CG2-CG2 3.88Å
304L88.4Confident85.2Confident0 Ų066.2 Ų66.20%037%0.366CS..Hα-helixtrans-68.5-36.4179.9-67.1172.2000112.5P44 S300 L301 A302 L306 C307 N308 M331 V335P44-L304 HydrophobicContact CB-CD1 4.45Å; P44-L304 HydrophobicContact CG-CD1 3.37Å; S300-L304 WeakPolarHBondContact O-CB 3.48Å; S300-L304 WeakPolarHBondContact O-CG 3.49Å; S300-L304 PolarHBondContact O-N 3.14Å; L301-L304 PolarHBondContact O-N 3.15Å; A302-L304 PolarHBondContact O-N 3.35Å; L304-L306 VanDerWaalsContact C-N 3.34Å; L304-C307 WeakPolarHBondContact O-CB 3.18Å; L304-C307 PolarHBondContact O-N 2.53Å; L304-N308 PolarHBondContact O-N 3.17Å; L304-N308 VanDerWaalsContact O-N 3.12Å; L304-M331 HydrophobicContact CD2-CB 3.84Å; L304-M331 HydrophobicContact CD2-CG 3.67Å; L304-V335 HydrophobicContact CD1-CG2 3.68Å; L304-V335 HydrophobicContact CG-CG2 4.48Å
305Q86Confident84.3Confident86 Ų8669.4 Ų69.440%0.40238%0.378SS..Hα-helixtrans-63.5-40.8172.1-69.2-65.3-18.900111.1L301 A302 C307 N308 F309L301-Q305 WeakPolarHBondContact O-CB 3.14Å; L301-Q305 WeakPolarHBondContact O-CG 3.21Å; L301-Q305 PolarHBondContact O-N 3.28Å; A302-Q305 PolarHBondContact O-N 3.15Å; Q305-C307 PolarHBondContact O-N 3.25Å; Q305-N308 WeakPolarHBondContact O-CB 3.15Å; Q305-N308 PolarHBondContact O-N 3.01Å; Q305-N308 VanDerWaalsContact O-N 3.15Å; Q305-F309 WeakPolarHBondContact O-CD2 3.36Å
306L85.2Confident83.7Confident120 Ų12069.7 Ų69.763%0.62838%0.383SS*.Hα-helixtrans-62.3-41.4173.2-69.5171.2000112A302 T303 L304 N308 F309A302-L306 WeakPolarHBondContact O-CG 3.38Å; A302-L306 PolarHBondContact O-N 3.3Å; T303-L306 WeakPolarHBondContact O-CB 3.26Å; T303-L306 PolarHBondContact O-N 3.5Å; L304-L306 VanDerWaalsContact C-N 3.34Å; L306-N308 PolarHBondContact O-N 3.05Å; L306-F309 PolarHBondContact O-N 2.93Å; L306-F309 VanDerWaalsContact O-N 3.16Å
307C81.6Confident83.2Confident41 Ų4176.4 Ų76.428%0.27741%0.414SS..Hα-helixtrans-62.6-24.8175.1-68.70000113.4T303 L304 Q305 F309 V310 K327T303-C307 PolarHBondContact O-N 2.63Å; T303-C307 PolarHBondContact O-SG 2.92Å; L304-C307 WeakPolarHBondContact O-CB 3.18Å; L304-C307 PolarHBondContact O-N 2.53Å; Q305-C307 PolarHBondContact O-N 3.25Å; C307-F309 VanDerWaalsContact C-N 3.31Å; C307-F309 PolarHBondContact O-N 3.44Å; C307-V310 PolarHBondContact O-N 3.5Å; C307-K327 WeakPolarHBondContact O-CE 3.35Å; C307-K327 PolarHBondContact O-NZ 3.03Å; C307-K327 VanDerWaalsContact O-NZ 3.08Å
308N77.8Confident82.8Confident72 Ų7284.3 Ų84.339%0.38544%0.442SS..Hα-helixtrans-69.3-28.6176.4-72.1-24.5000112.7L304 Q305 L306 V310L304-N308 PolarHBondContact O-N 3.17Å; L304-N308 VanDerWaalsContact O-N 3.12Å; Q305-N308 WeakPolarHBondContact O-CB 3.15Å; Q305-N308 PolarHBondContact O-N 3.01Å; Q305-N308 VanDerWaalsContact O-N 3.15Å; L306-N308 PolarHBondContact O-N 3.05Å; N308-V310 PolarHBondContact O-N 3.38Å
309F77.7Confident82.5Confident161 Ų16185.4 Ų85.471%0.70644%0.44SS*.THydrogen-bonded Turntrans-71.2-18176.2-67.3-77000113.7Q305 L306 C307 K311Q305-F309 WeakPolarHBondContact O-CD2 3.36Å; L306-F309 PolarHBondContact O-N 2.93Å; L306-F309 VanDerWaalsContact O-N 3.16Å; C307-F309 VanDerWaalsContact C-N 3.31Å; C307-F309 PolarHBondContact O-N 3.44Å; F309-K311 PolarHBondContact O-N 3.46Å
310V79.3Confident82.2Confident92 Ų9284.4 Ų84.456%0.55843%0.431SS*.  trans-73.1101.2175.9-174.50000109.2C307 N308 K327C307-V310 PolarHBondContact O-N 3.5Å; N308-V310 PolarHBondContact O-N 3.38Å; V310-K327 PolarHBondContact O-NZ 3.2Å
311K76Confident82Confident195 Ų19587.7 Ų87.785%0.84844%0.443SS*.PPolyproline II helixtrans-72.9130.8173-66.9-173.9179.4-177.50109.8F309F309-K311 PolarHBondContact O-N 3.46Å
312I78.1Confident81.9Confident40 Ų4090.4 Ų90.421%0.20546%0.457CS..PPolyproline II helixtrans-85.2131.4175.8-62.1174.1000108.1T314 F320 L323 K327I312-T314 PolarHBondContact O-N 2.88Å; I312-F320 HydrophobicContact CB-CD2 4.44Å; I312-F320 HydrophobicContact CG2-CD2 3.74Å; I312-F320 HydrophobicContact CG2-CE2 4.36Å; I312-L323 HydrophobicContact CG2-CB 3.77Å; I312-L323 HydrophobicContact CG2-CD1 4.13Å; I312-K327 HydrophobicContact CD1-CB 4.41Å; I312-K327 HydrophobicContact CD1-CD 3.82Å; I312-K327 HydrophobicContact CG1-CD 4.27Å
313P76.9Confident81.8Confident63 Ų6390.8 Ų90.841%0.40945%0.451SS..PPolyproline II helixtrans-57.8125.5172.2-22.332.2000111.3L319 L323P313-L319 HydrophobicContact CB-CD2 4.44Å; P313-L323 HydrophobicContact CG-CD1 4.26Å
314T71.7Confident81.9Confident75 Ų7589 Ų8946%0.4644%0.441SS..  trans-98.6-7.3-178.450.70000113.6I312 T316 F320I312-T314 PolarHBondContact O-N 2.88Å; T314-T316 VanDerWaalsContact C-N 3.33Å; T314-T316 PolarHBondContact O-N 3.1Å; T314-F320 HydrophobicContact CG2-CD2 4.08Å; T314-F320 HydrophobicContact CG2-CE2 4.19Å
315H71Confident82.1Confident180 Ų18092 Ų9283%0.83345%0.454SS*.SBendtrans-72.1-21.8-174.1-61.8-69.7000114.5
316T79.3Confident82.4Confident78 Ų7891.1 Ų91.148%0.47946%0.457SS..SBendtrans-125.5110.2-179.3-51.60000109.1T314 Y318 L319 F320T314-T316 VanDerWaalsContact C-N 3.33Å; T314-T316 PolarHBondContact O-N 3.1Å; T316-Y318 PolarHBondContact O-N 3.21Å; T316-L319 HydrophobicContact CG2-CB 4.07Å; T316-L319 PolarHBondContact O-N 2.82Å; T316-L319 VanDerWaalsContact O-N 3.14Å; T316-F320 PolarHBondContact O-N 3.16Å
317E79.5Confident82.7Confident141 Ų14188 Ų8866%0.65944%0.438SS*.Hα-helixtrans-56.5-47.2-171.9-63.5-176169.900112.9L319 F320 Y321E317-L319 PolarHBondContact O-N 2.99Å; E317-F320 WeakPolarHBondContact O-CB 3.19Å; E317-F320 PolarHBondContact O-N 3.29Å; E317-Y321 HydrophobicContact CB-CE2 4.35Å; E317-Y321 WeakPolarHBondContact O-CD2 3.43Å; E317-Y321 PolarHBondContact O-N 2.8Å
318Y82.6Confident83.2Confident191 Ų19186.5 Ų86.575%0.74943%0.428SS*.Hα-helixtrans-60.4-44.1177.9-67.9-76000112.6T316 F320 Y321 I322T316-Y318 PolarHBondContact O-N 3.21Å; Y318-F320 VanDerWaalsContact C-N 3.34Å; Y318-Y321 PolarHBondContact O-N 3.29Å; Y318-I322 WeakPolarHBondContact O-CG1 3.37Å; Y318-I322 PolarHBondContact O-N 2.97Å
319L86.2Confident84Confident76 Ų7683.6 Ų83.640%0.39841%0.414SS..Hα-helixtrans-65.5-40.8178.5-17564.6000110.7P313 T316 E317 Y321 I322 L323P313-L319 HydrophobicContact CB-CD2 4.44Å; T316-L319 HydrophobicContact CG2-CB 4.07Å; T316-L319 PolarHBondContact O-N 2.82Å; T316-L319 VanDerWaalsContact O-N 3.14Å; E317-L319 PolarHBondContact O-N 2.99Å; L319-Y321 PolarHBondContact O-N 3.26Å; L319-I322 PolarHBondContact O-N 3.22Å; L319-L323 HydrophobicContact CD1-CD1 3.9Å; L319-L323 HydrophobicContact CD1-CG 4.03Å; L319-L323 HydrophobicContact CD2-CD1 4.35Å; L319-L323 HydrophobicContact CG-CD1 3.73Å; L319-L323 HydrophobicContact CG-CG 4.23Å; L319-L323 VanDerWaalsContact O-CB 3.31Å; L319-L323 WeakPolarHBondContact O-CB 3.32Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.42Å; L319-L323 PolarHBondContact O-N 3.06Å
320F86.7Confident84.7Confident11 Ų1177.9 Ų77.95%0.04840%0.396CS..Hα-helixtrans-58.1-47.9176171.5-97.6000111.6D252 A257 I312 T314 T316 E317 Y318 S324D252-F320 WeakPolarHBondContact OD1-CE2 3.5Å; D252-F320 WeakPolarHBondContact OD1-CZ 3.4Å; A257-F320 HydrophobicContact CB-CE1 4.01Å; A257-F320 HydrophobicContact CB-CZ 4.36Å; I312-F320 HydrophobicContact CB-CD2 4.44Å; I312-F320 HydrophobicContact CG2-CD2 3.74Å; I312-F320 HydrophobicContact CG2-CE2 4.36Å; T314-F320 HydrophobicContact CG2-CD2 4.08Å; T314-F320 HydrophobicContact CG2-CE2 4.19Å; T316-F320 PolarHBondContact O-N 3.16Å; E317-F320 WeakPolarHBondContact O-CB 3.19Å; E317-F320 PolarHBondContact O-N 3.29Å; Y318-F320 VanDerWaalsContact C-N 3.34Å; F320-S324 WeakPolarHBondContact O-CB 3.46Å; F320-S324 PolarHBondContact O-N 3.45Å; F320-S324 PolarHBondContact O-OG 3.32Å
321Y88.1Confident85.3Confident68 Ų6874.7 Ų74.727%0.26738%0.376SS..Hα-helixtrans-66.4-44.7178.9-68.7-57.4000112.4F256 A257 V260 E317 Y318 L319 L323 S324 F325F256-Y321 HydrophobicContact CB-CE1 3.99Å; A257-Y321 HydrophobicContact CB-CE1 4.37Å; V260-Y321 VanDerWaalsContact CG1-O 3.25Å; V260-Y321 WeakPolarHBondContact CG1-O 3.24Å; V260-Y321 HydrophobicContact CG2-CD1 4.06Å; E317-Y321 HydrophobicContact CB-CE2 4.35Å; E317-Y321 WeakPolarHBondContact O-CD2 3.43Å; E317-Y321 PolarHBondContact O-N 2.8Å; Y318-Y321 PolarHBondContact O-N 3.29Å; L319-Y321 PolarHBondContact O-N 3.26Å; Y321-L323 PolarHBondContact O-N 3.09Å; Y321-S324 PolarHBondContact O-N 3.47Å; Y321-F325 PolarHBondContact O-N 3.22Å
322I88.4Confident86.1Confident104 Ų10465.5 Ų65.553%0.53334%0.336SS..Hα-helixtrans-61.9-47.7179-68.2168.4000110.7Y318 L319 S324 F325 C326Y318-I322 WeakPolarHBondContact O-CG1 3.37Å; Y318-I322 PolarHBondContact O-N 2.97Å; L319-I322 PolarHBondContact O-N 3.22Å; I322-S324 VanDerWaalsContact C-N 3.32Å; I322-S324 PolarHBondContact O-N 2.81Å; I322-F325 WeakPolarHBondContact O-CB 3.38Å; I322-F325 PolarHBondContact O-N 3.39Å; I322-C326 PolarHBondContact O-N 3.31Å; I322-C326 PolarHBondContact O-SG 3.4Å
323L89.8Confident86.9Confident62 Ų6265.9 Ų65.933%0.32534%0.338SS..Hα-helixtrans-66.3-35.6178.6-69177.3000112I312 P313 L319 Y321 C326 K327I312-L323 HydrophobicContact CG2-CB 3.77Å; I312-L323 HydrophobicContact CG2-CD1 4.13Å; P313-L323 HydrophobicContact CG-CD1 4.26Å; L319-L323 HydrophobicContact CD1-CD1 3.9Å; L319-L323 HydrophobicContact CD1-CG 4.03Å; L319-L323 HydrophobicContact CD2-CD1 4.35Å; L319-L323 HydrophobicContact CG-CD1 3.73Å; L319-L323 HydrophobicContact CG-CG 4.23Å; L319-L323 VanDerWaalsContact O-CB 3.31Å; L319-L323 WeakPolarHBondContact O-CB 3.32Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.42Å; L319-L323 PolarHBondContact O-N 3.06Å; Y321-L323 PolarHBondContact O-N 3.09Å; L323-C326 PolarHBondContact O-N 2.96Å; L323-K327 VanDerWaalsContact O-CB 3.27Å; L323-K327 WeakPolarHBondContact O-CB 3.47Å; L323-K327 PolarHBondContact O-N 3.49Å
324S89.8Confident87.6Confident12 Ų1263.6 Ų63.68%0.08432%0.323CS..Hα-helixtrans-63.1-42.6173.7-65.30000111.7F320 Y321 I322 S328F320-S324 WeakPolarHBondContact O-CB 3.46Å; F320-S324 PolarHBondContact O-N 3.45Å; F320-S324 PolarHBondContact O-OG 3.32Å; Y321-S324 PolarHBondContact O-N 3.47Å; I322-S324 VanDerWaalsContact C-N 3.32Å; I322-S324 PolarHBondContact O-N 2.81Å; S324-S328 VanDerWaalsContact O-CB 3.27Å; S324-S328 WeakPolarHBondContact O-CB 3.32Å; S324-S328 PolarHBondContact O-N 2.71Å; S324-S328 PolarHBondContact O-OG 3.39Å
325F92.4Very high88.6Confident65 Ų6560 Ų6029%0.28530%0.301SS..Hα-helixtrans-59.7-52.6173.5-177.6-92.9000111V260 L263 G264 F267 Y321 I322 K327 S328 A329V260-F325 HydrophobicContact CG1-CB 3.59Å; V260-F325 HydrophobicContact CG1-CD2 4.26Å; V260-F325 HydrophobicContact CG1-CG 4.44Å; L263-F325 HydrophobicContact CB-CD2 4.4Å; L263-F325 HydrophobicContact CB-CE2 4.05Å; G264-F325 VanDerWaalsContact CA-CE2 3.41Å; G264-F325 VanDerWaalsContact N-CE2 3.35Å; F267-F325 HydrophobicContact CB-CZ 4.07Å; F267-F325 HydrophobicContact CD1-CE1 4.07Å; F267-F325 AromaticContact CD1-CZ 3.81Å; F267-F325 HydrophobicContact CD1-CZ 3.81Å; F267-F325 HydrophobicContact CG-CZ 4.06Å; Y321-F325 PolarHBondContact O-N 3.22Å; I322-F325 WeakPolarHBondContact O-CB 3.38Å; I322-F325 PolarHBondContact O-N 3.39Å; F325-K327 PolarHBondContact O-N 2.88Å; F325-S328 PolarHBondContact O-N 2.98Å; F325-A329 HydrophobicContact CE1-CB 4.5Å; F325-A329 WeakPolarHBondContact O-CB 3.39Å; F325-A329 PolarHBondContact O-N 3.49Å
326C92.6Very high89.7Confident67 Ų6751.4 Ų51.445%0.45326%0.261SS..Hα-helixtrans-60.6-45.8-178.2-69.50000112.1I322 L323 S328 A329 A330I322-C326 PolarHBondContact O-N 3.31Å; I322-C326 PolarHBondContact O-SG 3.4Å; L323-C326 PolarHBondContact O-N 2.96Å; C326-S328 VanDerWaalsContact C-N 3.3Å; C326-S328 PolarHBondContact O-N 2.99Å; C326-A329 PolarHBondContact O-N 2.91Å; C326-A330 VanDerWaalsContact O-CB 3.3Å; C326-A330 WeakPolarHBondContact O-CB 3.26Å; C326-A330 PolarHBondContact O-N 3.46Å
327K91.5Very high90.3Very high53 Ų5347.8 Ų47.823%0.2324%0.239CC..Hα-helixtrans-59.1-44.1175.9-176.2176.3-176.4170.60111C307 V310 I312 L323 F325 A330 M331C307-K327 WeakPolarHBondContact O-CE 3.35Å; C307-K327 PolarHBondContact O-NZ 3.03Å; C307-K327 VanDerWaalsContact O-NZ 3.08Å; V310-K327 PolarHBondContact O-NZ 3.2Å; I312-K327 HydrophobicContact CD1-CB 4.41Å; I312-K327 HydrophobicContact CD1-CD 3.82Å; I312-K327 HydrophobicContact CG1-CD 4.27Å; L323-K327 VanDerWaalsContact O-CB 3.27Å; L323-K327 WeakPolarHBondContact O-CB 3.47Å; L323-K327 PolarHBondContact O-N 3.49Å; F325-K327 PolarHBondContact O-N 2.88Å; K327-A330 PolarHBondContact O-N 3.05Å; K327-M331 HydrophobicContact CG-CE 4.44Å; K327-M331 WeakPolarHBondContact O-CG 3.24Å; K327-M331 PolarHBondContact O-N 2.85Å
328S92.3Very high90.8Very high10 Ų1044.4 Ų44.47%0.0723%0.225CC..Hα-helixtrans-71.5-34.6-178-52.70000112.7R261 A265 S324 F325 C326 P332R261-S328 WeakPolarHBondContact CA-OG 3.27Å; R261-S328 VanDerWaalsContact CG-OG 3.29Å; R261-S328 WeakPolarHBondContact CG-OG 3.32Å; R261-S328 VanDerWaalsContact O-CB 3.23Å; R261-S328 WeakPolarHBondContact O-CB 3.41Å; A265-S328 WeakPolarHBondContact CA-O 3.49Å; S324-S328 VanDerWaalsContact O-CB 3.27Å; S324-S328 WeakPolarHBondContact O-CB 3.32Å; S324-S328 PolarHBondContact O-N 2.71Å; S324-S328 PolarHBondContact O-OG 3.39Å; F325-S328 PolarHBondContact O-N 2.98Å; C326-S328 VanDerWaalsContact C-N 3.3Å; C326-S328 PolarHBondContact O-N 2.99Å; S328-P332 WeakPolarHBondContact O-CD 3.45Å
329A94.1Very high91.3Very high12 Ų1235.9 Ų35.910%0.09919%0.193CC..Hα-helixtrans-70.8-37.8173.400000112.6G264 F267 G268 F325 C326 M331 L333G264-A329 WeakPolarHBondContact O-CA 3.28Å; G264-A329 VanDerWaalsContact O-CB 3.25Å; G264-A329 WeakPolarHBondContact O-CB 3.4Å; F267-A329 HydrophobicContact CD1-CB 4.49Å; G268-A329 WeakPolarHBondContact CA-O 3.31Å; F325-A329 HydrophobicContact CE1-CB 4.5Å; F325-A329 WeakPolarHBondContact O-CB 3.39Å; F325-A329 PolarHBondContact O-N 3.49Å; C326-A329 PolarHBondContact O-N 2.91Å; A329-M331 VanDerWaalsContact C-N 3.25Å; A329-M331 PolarHBondContact O-N 3.2Å; A329-L333 WeakPolarHBondContact O-CB 3.45Å; A329-L333 PolarHBondContact O-N 3.16Å
330A92.7Very high91.5Very high40 Ų4032.2 Ų32.233%0.33117%0.174SC..Hα-helixtrans-62.1-33.4177.300000112.2C326 K327 L333 T334C326-A330 VanDerWaalsContact O-CB 3.3Å; C326-A330 WeakPolarHBondContact O-CB 3.26Å; C326-A330 PolarHBondContact O-N 3.46Å; K327-A330 PolarHBondContact O-N 3.05Å; A330-L333 PolarHBondContact O-N 2.91Å; A330-T334 WeakPolarHBondContact O-CB 3.12Å; A330-T334 PolarHBondContact O-N 3.4Å; A330-T334 PolarHBondContact O-OG1 2.84Å
331M92.4Very high91.7Very high26 Ų2635.4 Ų35.413%0.12819%0.186CC..Hα-helixtrans-59-61.4-178.7-73.2-176.5177.500112.4F39 L304 K327 A329 L333 T334 V335F39-M331 HydrophobicContact CB-SD 4.2Å; L304-M331 HydrophobicContact CD2-CB 3.84Å; L304-M331 HydrophobicContact CD2-CG 3.67Å; K327-M331 HydrophobicContact CG-CE 4.44Å; K327-M331 WeakPolarHBondContact O-CG 3.24Å; K327-M331 PolarHBondContact O-N 2.85Å; A329-M331 VanDerWaalsContact C-N 3.25Å; A329-M331 PolarHBondContact O-N 3.2Å; M331-L333 PolarHBondContact O-N 2.85Å; M331-T334 PolarHBondContact O-N 3.38Å; M331-V335 WeakPolarHBondContact O-CG2 3.27Å; M331-V335 PolarHBondContact O-N 3.16Å
332P93.2Very high91.8Very high1 Ų136 Ų361%0.00620%0.199CC..Hα-helixtrans-64.4-36.6176.9-26.438.6000114.2F43 A265 L269 S328 T334 V335 V336F43-P332 HydrophobicContact CE1-CB 4.09Å; F43-P332 HydrophobicContact CZ-CB 4.24Å; A265-P332 HydrophobicContact CB-CG 4.16Å; A265-P332 WeakPolarHBondContact O-CG 3.35Å; L269-P332 HydrophobicContact CB-CB 3.98Å; L269-P332 HydrophobicContact CD1-CB 4.43Å; S328-P332 WeakPolarHBondContact O-CD 3.45Å; P332-T334 VanDerWaalsContact C-N 3.25Å; P332-T334 PolarHBondContact O-N 3.01Å; P332-V335 PolarHBondContact O-N 2.97Å; P332-V336 VanDerWaalsContact O-CB 3.27Å; P332-V336 WeakPolarHBondContact O-CB 3.37Å; P332-V336 WeakPolarHBondContact O-CG2 3.43Å; P332-V336 PolarHBondContact O-N 3.25Å
333L93.5Very high91.8Very high48 Ų4831.5 Ų31.525%0.25118%0.177SC..Hα-helixtrans-59.3-39.6177.4-177.264.8000111.7L271 A329 A330 M331 A337 L338L271-L333 HydrophobicContact CB-CD1 4.19Å; A329-L333 WeakPolarHBondContact O-CB 3.45Å; A329-L333 PolarHBondContact O-N 3.16Å; A330-L333 PolarHBondContact O-N 2.91Å; M331-L333 PolarHBondContact O-N 2.85Å; L333-A337 HydrophobicContact CD1-CB 4.18Å; L333-A337 WeakPolarHBondContact O-CB 3.45Å; L333-A337 PolarHBondContact O-N 3.33Å; L333-L338 PolarHBondContact O-N 2.7Å
334T92.9Very high91.7Very high15 Ų1529.7 Ų29.79%0.09217%0.166CC..Iπ-helixtrans-65.2-48.8179.2-62.30000111.6T303 A330 M331 P332 V336 L338 V339T303-T334 HydrophobicContact CG2-CG2 3.88Å; A330-T334 WeakPolarHBondContact O-CB 3.12Å; A330-T334 PolarHBondContact O-N 3.4Å; A330-T334 PolarHBondContact O-OG1 2.84Å; M331-T334 PolarHBondContact O-N 3.38Å; P332-T334 VanDerWaalsContact C-N 3.25Å; P332-T334 PolarHBondContact O-N 3.01Å; T334-V336 PolarHBondContact O-N 3.08Å; T334-L338 PolarHBondContact O-N 3.3Å; T334-V339 HydrophobicContact CG2-CG2 3.65Å; T334-V339 WeakPolarHBondContact O-CB 3.33Å; T334-V339 PolarHBondContact O-N 2.81Å
335V92.8Very high91.6Very high0 Ų032.4 Ų32.40%018%0.18CC..Iπ-helixtrans-66.2-38.7-178.4175.80000112F43 P44 F47 Q48 L304 M331 P332 P340F43-V335 HydrophobicContact CD1-CB 4.27Å; F43-V335 HydrophobicContact CD1-CG1 4.09Å; F43-V335 HydrophobicContact CD1-CG2 4.1Å; F43-V335 HydrophobicContact CE1-CB 3.57Å; F43-V335 HydrophobicContact CE1-CG1 3.56Å; F43-V335 HydrophobicContact CE1-CG2 3.83Å; F43-V335 HydrophobicContact CZ-CB 4.32Å; F43-V335 HydrophobicContact CZ-CG1 4.09Å; P44-V335 HydrophobicContact CB-CG1 4.31Å; P44-V335 HydrophobicContact CB-CG2 4.34Å; P44-V335 HydrophobicContact CG-CG2 3.92Å; F47-V335 HydrophobicContact CB-CG1 4.21Å; F47-V335 HydrophobicContact CD1-CG1 4.12Å; F47-V335 HydrophobicContact CG-CG1 4.34Å; Q48-V335 PolarHBondContact NE2-O 3.33Å; L304-V335 HydrophobicContact CD1-CG2 3.68Å; L304-V335 HydrophobicContact CG-CG2 4.48Å; M331-V335 WeakPolarHBondContact O-CG2 3.27Å; M331-V335 PolarHBondContact O-N 3.16Å; P332-V335 PolarHBondContact O-N 2.97Å; V335-P340 VanDerWaalsContact O-CD 3.3Å; V335-P340 WeakPolarHBondContact O-CD 3.36Å; V335-P340 VanDerWaalsContact O-CG 3.27Å; V335-P340 WeakPolarHBondContact O-CG 3.38Å
336V92.4Very high91.3Very high0 Ų036.2 Ų36.20%020%0.196CC..Iπ-helixtrans-87.2-41.8-170.6174.10000111.8F43 F47 L269 I273 F278 P332 T334F43-V336 HydrophobicContact CE1-CG2 4.43Å; F43-V336 HydrophobicContact CZ-CG2 3.7Å; F47-V336 HydrophobicContact CD1-CG2 4.32Å; F47-V336 HydrophobicContact CD2-CG2 4.22Å; F47-V336 HydrophobicContact CE1-CB 4.13Å; F47-V336 HydrophobicContact CE1-CG1 4.18Å; F47-V336 HydrophobicContact CE1-CG2 3.9Å; F47-V336 HydrophobicContact CE2-CG1 4.41Å; F47-V336 HydrophobicContact CE2-CG2 3.79Å; F47-V336 HydrophobicContact CG-CG2 4.48Å; F47-V336 HydrophobicContact CZ-CB 4.01Å; F47-V336 HydrophobicContact CZ-CG1 3.68Å; F47-V336 HydrophobicContact CZ-CG2 3.63Å; L269-V336 HydrophobicContact CD1-CG2 3.8Å; I273-V336 HydrophobicContact CG1-CG1 3.84Å; F278-V336 HydrophobicContact CD2-CG1 3.76Å; F278-V336 WeakPolarHBondContact CD2-O 3.38Å; F278-V336 HydrophobicContact CE2-CG1 4.27Å; F278-V336 HydrophobicContact CG-CG1 4.27Å; P332-V336 VanDerWaalsContact O-CB 3.27Å; P332-V336 WeakPolarHBondContact O-CB 3.37Å; P332-V336 WeakPolarHBondContact O-CG2 3.43Å; P332-V336 PolarHBondContact O-N 3.25Å; T334-V336 PolarHBondContact O-N 3.08Å
337A91.6Very high91Very high1 Ų134.3 Ų34.31%0.00818%0.181CC..Iπ-helixtrans-115.5-57.4-170.300000112.7S275 M277 L333 Y341S275-A337 WeakPolarHBondContact OG-CB 3.08Å; M277-A337 HydrophobicContact CB-CB 4.15Å; L333-A337 HydrophobicContact CD1-CB 4.18Å; L333-A337 WeakPolarHBondContact O-CB 3.45Å; L333-A337 PolarHBondContact O-N 3.33Å; A337-Y341 WeakPolarHBondContact O-CB 3.43Å; A337-Y341 PolarHBondContact O-N 2.9Å; A337-Y341 VanDerWaalsContact O-N 3.11Å
338L91.8Very high90.5Very high70 Ų7038 Ų3837%0.36619%0.193SC..Iπ-helixtrans-67.2-52.5-168.7-59.3174.5000112.7M277 L333 T334 Y341 C342M277-L338 HydrophobicContact SD-CD2 3.92Å; L333-L338 PolarHBondContact O-N 2.7Å; T334-L338 PolarHBondContact O-N 3.3Å; L338-Y341 PolarHBondContact O-N 3.46Å; L338-C342 PolarHBondContact O-N 2.91Å; L338-C342 PolarHBondContact O-SG 3.22Å; L338-C342 VanDerWaalsContact O-SG 3.32Å
339V92.6Very high89.8Confident12 Ų1241.1 Ų41.17%0.07321%0.212CC..Hα-helixtrans-64.1-50.7-178168.10000111.2C296 A299 T334 Y341 C342 V343C296-V339 HydrophobicContact CB-CG1 4.36Å; C296-V339 WeakPolarHBondContact O-CG1 3.46Å; A299-V339 HydrophobicContact CB-CG1 3.65Å; T334-V339 HydrophobicContact CG2-CG2 3.65Å; T334-V339 WeakPolarHBondContact O-CB 3.33Å; T334-V339 PolarHBondContact O-N 2.81Å; V339-Y341 PolarHBondContact O-N 3.47Å; V339-C342 PolarHBondContact O-N 3.13Å; V339-V343 HydrophobicContact CG1-CG2 4.23Å; V339-V343 WeakPolarHBondContact O-CB 3.42Å; V339-V343 VanDerWaalsContact O-CG2 3.32Å; V339-V343 WeakPolarHBondContact O-CG2 3.49Å; V339-V343 PolarHBondContact O-N 3.43Å
340P90.1Very high88.9Confident0 Ų042.7 Ų42.70%023%0.225CC..Hα-helixtrans-56.7-36.9176.6-28.738.5000113.4C282 F292 V335 H344C282-P340 VanDerWaalsContact SG-CB 3.57Å; F292-P340 HydrophobicContact CZ-CB 3.98Å; V335-P340 VanDerWaalsContact O-CD 3.3Å; V335-P340 WeakPolarHBondContact O-CD 3.36Å; V335-P340 VanDerWaalsContact O-CG 3.27Å; V335-P340 WeakPolarHBondContact O-CG 3.38Å; P340-H344 WeakPolarHBondContact O-CB 3.46Å; P340-H344 PolarHBondContact O-N 3.25Å
341Y89.9Confident88Confident78 Ų7844.4 Ų44.431%0.30623%0.227SC..Hα-helixtrans-68.3-47.9177.6-177.2-103000113.2M277 S281 A337 L338 V339 V343 H344 L345M277-Y341 HydrophobicContact CB-CD2 4.16Å; M277-Y341 HydrophobicContact CB-CG 4.16Å; M277-Y341 HydrophobicContact CG-CD1 4.38Å; M277-Y341 HydrophobicContact CG-CD2 4.17Å; M277-Y341 HydrophobicContact CG-CG 4.09Å; S281-Y341 WeakPolarHBondContact OG-CA 3.33Å; S281-Y341 WeakPolarHBondContact OG-CB 3.25Å; S281-Y341 PolarHBondContact OG-N 2.89Å; A337-Y341 WeakPolarHBondContact O-CB 3.43Å; A337-Y341 PolarHBondContact O-N 2.9Å; A337-Y341 VanDerWaalsContact O-N 3.11Å; L338-Y341 PolarHBondContact O-N 3.46Å; V339-Y341 PolarHBondContact O-N 3.47Å; Y341-V343 VanDerWaalsContact C-N 3.33Å; Y341-V343 PolarHBondContact O-N 3.36Å; Y341-H344 PolarHBondContact O-N 3.06Å; Y341-L345 HydrophobicContact CD1-CD1 3.94Å; Y341-L345 HydrophobicContact CE1-CD1 3.41Å; Y341-L345 VanDerWaalsContact CE1-CD1 3.41Å; Y341-L345 HydrophobicContact CE1-CG 4.21Å; Y341-L345 HydrophobicContact CE2-CD1 4.49Å; Y341-L345 WeakPolarHBondContact O-CG 3.32Å; Y341-L345 PolarHBondContact O-N 3.4Å
342C90.4Very high87.1Confident79 Ų7949.9 Ų49.953%0.53425%0.25SC..Hα-helixtrans-60.1-43.6175.6-69.20000111.7L338 V339 L345 F346L338-C342 PolarHBondContact O-N 2.91Å; L338-C342 PolarHBondContact O-SG 3.22Å; L338-C342 VanDerWaalsContact O-SG 3.32Å; V339-C342 PolarHBondContact O-N 3.13Å; C342-L345 PolarHBondContact O-N 3.39Å; C342-F346 WeakPolarHBondContact O-CB 3.45Å; C342-F346 PolarHBondContact O-N 2.94Å
343V88.9Confident85.8Confident11 Ų1158.3 Ų58.37%0.06729%0.286CS..Hα-helixtrans-64.6-41.7176.9173.60000111.1F292 L295 V339 Y341 L345 F346 M347F292-V343 HydrophobicContact CD2-CB 4.48Å; F292-V343 HydrophobicContact CD2-CG1 3.65Å; F292-V343 HydrophobicContact CE2-CB 4.14Å; F292-V343 HydrophobicContact CE2-CG1 3.8Å; L295-V343 HydrophobicContact CB-CG1 4.16Å; L295-V343 HydrophobicContact CD2-CG1 3.66Å; L295-V343 HydrophobicContact CD2-CG2 4.38Å; L295-V343 HydrophobicContact CG-CG1 3.88Å; L295-V343 HydrophobicContact CG-CG2 4.01Å; V339-V343 HydrophobicContact CG1-CG2 4.23Å; V339-V343 WeakPolarHBondContact O-CB 3.42Å; V339-V343 VanDerWaalsContact O-CG2 3.32Å; V339-V343 WeakPolarHBondContact O-CG2 3.49Å; V339-V343 PolarHBondContact O-N 3.43Å; Y341-V343 VanDerWaalsContact C-N 3.33Å; Y341-V343 PolarHBondContact O-N 3.36Å; V343-L345 PolarHBondContact O-N 3.13Å; V343-F346 PolarHBondContact O-N 2.95Å; V343-M347 HydrophobicContact CG1-CG 4.35Å; V343-M347 HydrophobicContact CG1-SD 4.12Å; V343-M347 WeakPolarHBondContact O-CG 3.23Å; V343-M347 PolarHBondContact O-N 2.84Å
344H87.9Confident84.3Confident23 Ų2363.6 Ų63.611%0.10631%0.314CS..Hα-helixtrans-60.5-45.4177.1-178.178.4000111.9F292 P340 Y341 M347 R348F292-H344 HydrophobicContact CE2-CB 4.06Å; P340-H344 WeakPolarHBondContact O-CB 3.46Å; P340-H344 PolarHBondContact O-N 3.25Å; Y341-H344 PolarHBondContact O-N 3.06Å; H344-M347 PolarHBondContact O-N 3.5Å; H344-R348 WeakPolarHBondContact O-CB 3.44Å; H344-R348 PolarHBondContact O-N 2.91Å
345L87.6Confident82.2Confident70 Ų7072.1 Ų72.137%0.36636%0.359SS..Hα-helixtrans-62.7-42.5176.2-71.3177.7000112.3Y341 C342 V343 R348 T349Y341-L345 HydrophobicContact CD1-CD1 3.94Å; Y341-L345 HydrophobicContact CE1-CD1 3.41Å; Y341-L345 VanDerWaalsContact CE1-CD1 3.41Å; Y341-L345 HydrophobicContact CE1-CG 4.21Å; Y341-L345 HydrophobicContact CE2-CD1 4.49Å; Y341-L345 WeakPolarHBondContact O-CG 3.32Å; Y341-L345 PolarHBondContact O-N 3.4Å; C342-L345 PolarHBondContact O-N 3.39Å; V343-L345 PolarHBondContact O-N 3.13Å; L345-R348 PolarHBondContact O-N 3.08Å; L345-T349 WeakPolarHBondContact O-CB 2.86Å; L345-T349 PolarHBondContact O-N 3.43Å; L345-T349 PolarHBondContact O-OG1 3.45Å
346F86.9Confident81.7Confident145 Ų14575.8 Ų75.864%0.63638%0.377SS*.Hα-helixtrans-62.2-48.9177.9-177.8-98.2000111.6C342 V343 R348 T349 A350C342-F346 WeakPolarHBondContact O-CB 3.45Å; C342-F346 PolarHBondContact O-N 2.94Å; V343-F346 PolarHBondContact O-N 2.95Å; F346-R348 PolarHBondContact O-N 3.07Å; F346-T349 PolarHBondContact O-N 3.24Å; F346-A350 PolarHBondContact O-N 3.39Å
347M84.4Confident81.1Confident26 Ų2679.7 Ų79.713%0.12840%0.397CS..Hα-helixtrans-63.7-40.8178.6-70.4-174.273.600112.4K289 F292 V343 H344 T349 A350 E351K289-M347 HydrophobicContact CD-CE 4.27Å; F292-M347 HydrophobicContact CB-CE 4.43Å; F292-M347 HydrophobicContact CB-SD 3.85Å; F292-M347 HydrophobicContact CD2-SD 3.76Å; F292-M347 HydrophobicContact CG-SD 4.32Å; V343-M347 HydrophobicContact CG1-CG 4.35Å; V343-M347 HydrophobicContact CG1-SD 4.12Å; V343-M347 WeakPolarHBondContact O-CG 3.23Å; V343-M347 PolarHBondContact O-N 2.84Å; H344-M347 PolarHBondContact O-N 3.5Å; M347-T349 VanDerWaalsContact C-N 3.28Å; M347-T349 PolarHBondContact O-N 2.92Å; M347-A350 PolarHBondContact O-N 3.19Å; M347-E351 WeakPolarHBondContact O-CG 3.09Å; M347-E351 PolarHBondContact O-N 3.04Å
348R81.6Confident80.5Confident131 Ų13184.1 Ų84.149%0.49442%0.418SS..Hα-helixtrans-62.8-36.8176.5-172.1179.2-176.2-172.10.7112.1H344 L345 F346 K352H344-R348 WeakPolarHBondContact O-CB 3.44Å; H344-R348 PolarHBondContact O-N 2.91Å; L345-R348 PolarHBondContact O-N 3.08Å; F346-R348 PolarHBondContact O-N 3.07Å; R348-K352 WeakPolarHBondContact O-CG 3.49Å; R348-K352 PolarHBondContact O-N 3.14Å; R348-K352 VanDerWaalsContact O-N 3.16Å
349T78.7Confident79.9Confident75 Ų7584.9 Ų84.946%0.4642%0.421SS..Hα-helixtrans-70.7-38.3177.4-54.30000111.4L345 F346 M347 K352 K353L345-T349 WeakPolarHBondContact O-CB 2.86Å; L345-T349 PolarHBondContact O-N 3.43Å; L345-T349 PolarHBondContact O-OG1 3.45Å; F346-T349 PolarHBondContact O-N 3.24Å; M347-T349 VanDerWaalsContact C-N 3.28Å; M347-T349 PolarHBondContact O-N 2.92Å; T349-K352 PolarHBondContact O-N 3.43Å; T349-K353 PolarHBondContact O-N 3.2Å
350A74.5Confident79.1Confident46 Ų4689.5 Ų89.538%0.3844%0.443SS..Hα-helixtrans-65-43.8174.900000112F346 M347 K352 K353 L354F346-A350 PolarHBondContact O-N 3.39Å; M347-A350 PolarHBondContact O-N 3.19Å; A350-K352 VanDerWaalsContact C-N 3.3Å; A350-K352 PolarHBondContact O-N 2.93Å; A350-K353 PolarHBondContact O-N 2.93Å; A350-K353 VanDerWaalsContact O-N 3.13Å; A350-L354 PolarHBondContact O-N 3.35Å
351E74.7Confident78.3Confident76 Ų7695.5 Ų95.536%0.35547%0.473SS..Hα-helixtrans-61.6-36.7175.9-73.1174.6173.700112K289 M347 K353 L354 N355K289-E351 IonicContact NZ-OE1 3.13Å; K289-E351 PolarHBondContact NZ-OE1 3.08Å; M347-E351 WeakPolarHBondContact O-CG 3.09Å; M347-E351 PolarHBondContact O-N 3.04Å; E351-K353 VanDerWaalsContact C-N 3.33Å; E351-K353 PolarHBondContact O-N 2.76Å; E351-L354 PolarHBondContact O-N 3.48Å; E351-N355 PolarHBondContact O-N 2.99Å
352K72.6Confident77.5Confident141 Ų14196.7 Ų96.761%0.61349%0.485SS*.Hα-helixtrans-71.5-19.7175.1-78-175178.4-171.60115R348 T349 A350R348-K352 WeakPolarHBondContact O-CG 3.49Å; R348-K352 PolarHBondContact O-N 3.14Å; R348-K352 VanDerWaalsContact O-N 3.16Å; T349-K352 PolarHBondContact O-N 3.43Å; A350-K352 VanDerWaalsContact C-N 3.3Å; A350-K352 PolarHBondContact O-N 2.93Å
353K66.3Low76.5Confident177 Ų17798.1 Ų98.177%0.7748%0.481SS*.Hα-helixtrans-89.9-16.3177.3-76.8-175.5177.5-175.20112.8T349 A350 E351T349-K353 PolarHBondContact O-N 3.2Å; A350-K353 PolarHBondContact O-N 2.93Å; A350-K353 VanDerWaalsContact O-N 3.13Å; E351-K353 VanDerWaalsContact C-N 3.33Å; E351-K353 PolarHBondContact O-N 2.76Å
354L60.8Low75.5Confident160 Ų160105.3 Ų105.384%0.83852%0.515SS*.Hα-helixtrans-93.4-19.5-178.9-128.992.3000113.2A350 E351A350-L354 PolarHBondContact O-N 3.35Å; E351-L354 PolarHBondContact O-N 3.48Å
355N49.6Very low74.3Confident194 Ų194112.8 Ų112.8100%1.03755%0.553SS**  trans-99.10169.9-67.2-13.3000109.4E351E351-N355 PolarHBondContact O-N 2.99Å

Retrieved 355 of 355 residues in 243.9 ms (Link to these results)

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