A0A5K4F1J5_SCHMA Loading...

TLC domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1J5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 275 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
1M53.7Low62.3Low174 Ų174105.5 Ų105.586%0.85754%0.536SS*.  0115.80-149.1167-171.900107.5
2N52.9Low62.2Low107 Ų107106.2 Ų106.257%0.57254%0.538SS*.  trans-69.3141.6-169.3-143-8.4000109.8I4 D5N2-I4 PolarHBondContact O-N 3.46Å; N2-I4 VanDerWaalsContact O-N 3.17Å; N2-D5 HydrophobicContact CB-CB 4.44Å; N2-D5 VanDerWaalsContact O-CB 3.31Å; N2-D5 WeakPolarHBondContact O-CB 3.43Å; N2-D5 PolarHBondContact O-N 2.92Å; N2-D5 VanDerWaalsContact O-N 3.12Å
3P59.6Low62Low99 Ų99106.3 Ų106.364%0.64354%0.54SS*.Hα-helixtrans-58.5-28.3180-24.634.2000114.2K6 S7P3-K6 PolarHBondContact O-N 2.89Å; P3-S7 PolarHBondContact O-N 3.15Å
4I59.6Low61.2Low108 Ų108111.8 Ų111.855%0.55455%0.551SS**Hα-helixtrans-66-40.5177.3-61.3168.6000111.2N2 K6 S7 D8N2-I4 PolarHBondContact O-N 3.46Å; N2-I4 VanDerWaalsContact O-N 3.17Å; I4-K6 VanDerWaalsContact C-N 3.31Å; I4-K6 PolarHBondContact O-N 3.12Å; I4-S7 WeakPolarHBondContact CA-OG 3.31Å; I4-S7 PolarHBondContact O-N 3.39Å; I4-S7 VanDerWaalsContact O-N 3.08Å; I4-S7 PolarHBondContact O-OG 2.84Å; I4-D8 PolarHBondContact O-N 3.38Å
5D62.9Low61.5Low80 Ų80108 Ų10843%0.42854%0.54SS..Hα-helixtrans-61.7-41.8178.4-145.612.3000110.7N2 S7 D8 D9N2-D5 HydrophobicContact CB-CB 4.44Å; N2-D5 VanDerWaalsContact O-CB 3.31Å; N2-D5 WeakPolarHBondContact O-CB 3.43Å; N2-D5 PolarHBondContact O-N 2.92Å; N2-D5 VanDerWaalsContact O-N 3.12Å; D5-S7 VanDerWaalsContact C-N 3.34Å; D5-S7 PolarHBondContact O-N 3.22Å; D5-D8 PolarHBondContact O-N 3.26Å; D5-D9 WeakPolarHBondContact O-CB 3.38Å; D5-D9 PolarHBondContact O-N 3.14Å
6K64Low61.9Low110 Ų110106.6 Ų106.648%0.47853%0.534SS..Hα-helixtrans-71.2-22.4175.8-71.6-171.2177.3-176.30114.1P3 I4 R10P3-K6 PolarHBondContact O-N 2.89Å; I4-K6 VanDerWaalsContact C-N 3.31Å; I4-K6 PolarHBondContact O-N 3.12Å; K6-R10 WeakPolarHBondContact O-CG 3.49Å; K6-R10 PolarHBondContact O-NE 3.02Å
7S65.3Low62.2Low45 Ų45104.6 Ų104.632%0.31553%0.529SS..Hα-helixtrans-79.1-40.5173.5500000111.1P3 I4 D5 R10 I11P3-S7 PolarHBondContact O-N 3.15Å; I4-S7 WeakPolarHBondContact CA-OG 3.31Å; I4-S7 PolarHBondContact O-N 3.39Å; I4-S7 VanDerWaalsContact O-N 3.08Å; I4-S7 PolarHBondContact O-OG 2.84Å; D5-S7 VanDerWaalsContact C-N 3.34Å; D5-S7 PolarHBondContact O-N 3.22Å; S7-R10 PolarHBondContact O-N 3.41Å; S7-I11 VanDerWaalsContact O-CG1 3.32Å; S7-I11 WeakPolarHBondContact O-CG1 3.27Å; S7-I11 PolarHBondContact O-N 3.09Å
8D69.2Low62.7Low91 Ų91104.3 Ų104.349%0.48753%0.529SS..Hα-helixtrans-67.7-42.7179.8-68.5-16.8000111.2I4 D5 R10 I11 M12I4-D8 PolarHBondContact O-N 3.38Å; D5-D8 PolarHBondContact O-N 3.26Å; D8-R10 VanDerWaalsContact C-N 3.28Å; D8-R10 PolarHBondContact O-N 3.17Å; D8-I11 PolarHBondContact O-N 3.22Å; D8-M12 WeakPolarHBondContact O-CB 3.33Å; D8-M12 PolarHBondContact O-N 3.03Å
9D69.6Low63.4Low69 Ų69103.8 Ų103.837%0.36952%0.524SS..Hα-helixtrans-56.4-42.6171.7-77.9-20.1000111.9D5 M12 L13D5-D9 WeakPolarHBondContact O-CB 3.38Å; D5-D9 PolarHBondContact O-N 3.14Å; D9-M12 PolarHBondContact O-N 3.29Å; D9-L13 VanDerWaalsContact O-CB 3.31Å; D9-L13 WeakPolarHBondContact O-CB 3.35Å; D9-L13 WeakPolarHBondContact O-CD1 3.45Å; D9-L13 WeakPolarHBondContact O-CG 3.29Å; D9-L13 PolarHBondContact O-N 3.16Å
10R62.6Low64.1Low165 Ų165102.1 Ų102.162%0.62352%0.519SS*.Hα-helixtrans-68.7-37.5179.2-84.5-175.8-76.1-157.42112.4K6 S7 D8 R14K6-R10 WeakPolarHBondContact O-CG 3.49Å; K6-R10 PolarHBondContact O-NE 3.02Å; S7-R10 PolarHBondContact O-N 3.41Å; D8-R10 VanDerWaalsContact C-N 3.28Å; D8-R10 PolarHBondContact O-N 3.17Å; R10-R14 VanDerWaalsContact O-CB 3.24Å; R10-R14 WeakPolarHBondContact O-CB 3.25Å; R10-R14 PolarHBondContact O-N 3.28Å
11I66.2Low65Low112 Ų11299.8 Ų99.857%0.57451%0.512SS*.Hα-helixtrans-68-45.3176.8-68.4165000109.9S7 D8 R14 S15S7-I11 VanDerWaalsContact O-CG1 3.32Å; S7-I11 WeakPolarHBondContact O-CG1 3.27Å; S7-I11 PolarHBondContact O-N 3.09Å; D8-I11 PolarHBondContact O-N 3.22Å; I11-R14 PolarHBondContact O-N 3.43Å; I11-S15 PolarHBondContact O-N 3.29Å
12M60.8Low66.7Low114 Ų11494.7 Ų94.756%0.56249%0.486SS*.Hα-helixtrans-59.3-52.2176.8-171.3-164.6-6300110.9D8 D9 R14 S15 I16D8-M12 WeakPolarHBondContact O-CB 3.33Å; D8-M12 PolarHBondContact O-N 3.03Å; D9-M12 PolarHBondContact O-N 3.29Å; M12-R14 VanDerWaalsContact C-N 3.28Å; M12-R14 PolarHBondContact O-N 3.42Å; M12-S15 PolarHBondContact O-N 3.09Å; M12-S15 VanDerWaalsContact O-N 3.12Å; M12-S15 PolarHBondContact O-OG 3.4Å; M12-I16 HydrophobicContact CG-CD1 4.07Å; M12-I16 WeakPolarHBondContact O-CG1 3.31Å; M12-I16 PolarHBondContact O-N 3.31Å
13L59.1Low68.7Low108 Ų10890.7 Ų90.757%0.56546%0.463SS*.Hα-helixtrans-56.4-42.7176.1-75168.2000111.6D9 S15 I16 T17D9-L13 VanDerWaalsContact O-CB 3.31Å; D9-L13 WeakPolarHBondContact O-CB 3.35Å; D9-L13 WeakPolarHBondContact O-CD1 3.45Å; D9-L13 WeakPolarHBondContact O-CG 3.29Å; D9-L13 PolarHBondContact O-N 3.16Å; L13-S15 PolarHBondContact O-N 3.41Å; L13-I16 PolarHBondContact O-N 3.25Å; L13-T17 VanDerWaalsContact O-CG2 3.29Å; L13-T17 WeakPolarHBondContact O-CG2 3.18Å; L13-T17 PolarHBondContact O-N 2.85Å; L13-T17 PolarHBondContact O-OG1 2.74Å; L13-T17 VanDerWaalsContact O-OG1 3.14Å
14R52Low70.3Confident183 Ų18390.7 Ų90.769%0.69146%0.457SS*.Hα-helixtrans-64.5-40178.9-158.7173.5-169.1-173.22.2111.8R10 I11 M12 T17 N18R10-R14 VanDerWaalsContact O-CB 3.24Å; R10-R14 WeakPolarHBondContact O-CB 3.25Å; R10-R14 PolarHBondContact O-N 3.28Å; I11-R14 PolarHBondContact O-N 3.43Å; M12-R14 VanDerWaalsContact C-N 3.28Å; M12-R14 PolarHBondContact O-N 3.42Å; R14-T17 WeakPolarHBondContact CA-OG1 3.33Å; R14-T17 PolarHBondContact O-N 2.72Å; R14-T17 PolarHBondContact O-OG1 3.14Å; R14-N18 WeakPolarHBondContact O-CB 3.29Å; R14-N18 PolarHBondContact O-N 3.03Å; R14-N18 PolarHBondContact O-ND2 3.14Å
15S65Low72Confident55 Ų5593.8 Ų93.839%0.38546%0.461SS..Hα-helixtrans-62.3-47.8175.278.40000111.8I11 M12 L13 T17 N18 E19I11-S15 PolarHBondContact O-N 3.29Å; M12-S15 PolarHBondContact O-N 3.09Å; M12-S15 VanDerWaalsContact O-N 3.12Å; M12-S15 PolarHBondContact O-OG 3.4Å; L13-S15 PolarHBondContact O-N 3.41Å; S15-T17 VanDerWaalsContact C-N 3.33Å; S15-T17 PolarHBondContact O-N 2.64Å; S15-N18 PolarHBondContact O-N 3.23Å; S15-N18 VanDerWaalsContact O-N 3.1Å; S15-E19 PolarHBondContact O-N 2.84Å
16I67.7Low73.7Confident85 Ų8593 Ų9344%0.43645%0.453SS..Hα-helixtrans-61-43.4178.2-65.3167.4000110.6M12 L13 N18 E19 T20M12-I16 HydrophobicContact CG-CD1 4.07Å; M12-I16 WeakPolarHBondContact O-CG1 3.31Å; M12-I16 PolarHBondContact O-N 3.31Å; L13-I16 PolarHBondContact O-N 3.25Å; I16-N18 VanDerWaalsContact C-N 3.32Å; I16-N18 PolarHBondContact O-N 2.68Å; I16-E19 PolarHBondContact O-N 3.12Å; I16-T20 WeakPolarHBondContact O-CB 3.41Å; I16-T20 PolarHBondContact O-N 3.24Å; I16-T20 PolarHBondContact O-OG1 3.48Å
17T66.9Low75.3Confident73 Ų7388.9 Ų88.945%0.44844%0.435SS..Hα-helixtrans-65.4-36177.556.10000112.4L13 R14 S15 S21L13-T17 VanDerWaalsContact O-CG2 3.29Å; L13-T17 WeakPolarHBondContact O-CG2 3.18Å; L13-T17 PolarHBondContact O-N 2.85Å; L13-T17 PolarHBondContact O-OG1 2.74Å; L13-T17 VanDerWaalsContact O-OG1 3.14Å; R14-T17 WeakPolarHBondContact CA-OG1 3.33Å; R14-T17 PolarHBondContact O-N 2.72Å; R14-T17 PolarHBondContact O-OG1 3.14Å; S15-T17 VanDerWaalsContact C-N 3.33Å; S15-T17 PolarHBondContact O-N 2.64Å; T17-S21 VanDerWaalsContact O-CB 3.23Å; T17-S21 WeakPolarHBondContact O-CB 3.44Å; T17-S21 PolarHBondContact O-N 2.8Å; T17-S21 PolarHBondContact O-OG 2.85Å
18N72Confident76.8Confident99 Ų9990.6 Ų90.653%0.52944%0.441SS..Hα-helixtrans-69.5-43.1178.4-73.3-16.9000111.3R14 S15 I16 S21 F22R14-N18 WeakPolarHBondContact O-CB 3.29Å; R14-N18 PolarHBondContact O-N 3.03Å; R14-N18 PolarHBondContact O-ND2 3.14Å; S15-N18 PolarHBondContact O-N 3.23Å; S15-N18 VanDerWaalsContact O-N 3.1Å; I16-N18 VanDerWaalsContact C-N 3.32Å; I16-N18 PolarHBondContact O-N 2.68Å; N18-S21 PolarHBondContact O-N 3.11Å; N18-F22 WeakPolarHBondContact O-CB 3.36Å; N18-F22 PolarHBondContact O-N 3.02Å
19E74.8Confident78.2Confident96 Ų9689.7 Ų89.745%0.44944%0.435SS..Hα-helixtrans-66.5-44.6176.7-71.7-176.3176.500111.9S15 I16 S21 F22 Y23S15-E19 PolarHBondContact O-N 2.84Å; I16-E19 PolarHBondContact O-N 3.12Å; E19-S21 VanDerWaalsContact C-N 3.3Å; E19-S21 PolarHBondContact O-N 2.93Å; E19-F22 WeakPolarHBondContact O-CB 3.32Å; E19-F22 PolarHBondContact O-N 2.74Å; E19-F22 VanDerWaalsContact O-N 3.12Å; E19-Y23 HydrophobicContact CB-CE2 4.12Å; E19-Y23 WeakPolarHBondContact O-CD2 2.97Å; E19-Y23 PolarHBondContact O-N 3.43Å
20T78.5Confident79.6Confident69 Ų6986.4 Ų86.442%0.42342%0.418SS..Hα-helixtrans-59.9-44.4175.3-55.40000110.9I16 F22 Y23 L24I16-T20 WeakPolarHBondContact O-CB 3.41Å; I16-T20 PolarHBondContact O-N 3.24Å; I16-T20 PolarHBondContact O-OG1 3.48Å; T20-F22 VanDerWaalsContact C-N 3.32Å; T20-F22 PolarHBondContact O-N 2.88Å; T20-Y23 PolarHBondContact O-N 3Å; T20-L24 HydrophobicContact CG2-CD1 4.15Å; T20-L24 WeakPolarHBondContact O-CG 3.08Å; T20-L24 PolarHBondContact O-N 3.13Å
21S83.4Confident81.3Confident53 Ų5381 Ų8137%0.37140%0.399SS..Hα-helixtrans-61.4-42.9175.7-61.20000111T17 N18 E19 Y23 L24 W25T17-S21 VanDerWaalsContact O-CB 3.23Å; T17-S21 WeakPolarHBondContact O-CB 3.44Å; T17-S21 PolarHBondContact O-N 2.8Å; T17-S21 PolarHBondContact O-OG 2.85Å; N18-S21 PolarHBondContact O-N 3.11Å; E19-S21 VanDerWaalsContact C-N 3.3Å; E19-S21 PolarHBondContact O-N 2.93Å; S21-Y23 PolarHBondContact O-N 3.18Å; S21-L24 PolarHBondContact O-N 3.32Å; S21-W25 PolarHBondContact O-N 3.21Å
22F88.2Confident82.8Confident68 Ų6881.6 Ų81.630%0.29840%0.398SS..Hα-helixtrans-57.1-49.4176.3172.8-88.2000111.7N18 E19 T20 L24 W25 W26 F101 N104N18-F22 WeakPolarHBondContact O-CB 3.36Å; N18-F22 PolarHBondContact O-N 3.02Å; E19-F22 WeakPolarHBondContact O-CB 3.32Å; E19-F22 PolarHBondContact O-N 2.74Å; E19-F22 VanDerWaalsContact O-N 3.12Å; T20-F22 VanDerWaalsContact C-N 3.32Å; T20-F22 PolarHBondContact O-N 2.88Å; F22-L24 PolarHBondContact O-N 3.13Å; F22-W25 PolarHBondContact O-N 3.31Å; F22-W26 AromaticContact CD1-CD1 3.84Å; F22-W26 AromaticContact CD2-CD1 3.88Å; F22-W26 AromaticContact CD2-NE1 3.52Å; F22-W26 AromaticContact CE1-CD1 3.54Å; F22-W26 AromaticContact CE1-NE1 3.78Å; F22-W26 AromaticContact CE2-CD1 3.62Å; F22-W26 AromaticContact CE2-NE1 3Å; F22-W26 AromaticContact CG-CD1 3.98Å; F22-W26 AromaticContact CZ-CD1 3.42Å; F22-W26 VanDerWaalsContact CZ-CD1 3.42Å; F22-W26 AromaticContact CZ-NE1 3.14Å; F22-W26 PolarHBondContact O-N 3.02Å; F22-F101 HydrophobicContact CE2-CD2 4.17Å; F22-F101 AromaticContact CE2-CE2 3.96Å; F22-F101 HydrophobicContact CE2-CE2 3.96Å; F22-F101 AromaticContact CZ-CD2 3.75Å; F22-F101 HydrophobicContact CZ-CD2 3.75Å; F22-F101 AromaticContact CZ-CE2 3.74Å; F22-F101 HydrophobicContact CZ-CE2 3.74Å; F22-N104 HydrophobicContact CE1-CB 4.46Å
23Y94.5Very high84.6Confident22 Ų2278.5 Ų78.59%0.08639%0.387CS..Hα-helixtrans-63.4-44179.5-57.7-43.4000112.3E19 T20 S21 W25 W26 I27 N104 L148 E151E19-Y23 HydrophobicContact CB-CE2 4.12Å; E19-Y23 WeakPolarHBondContact O-CD2 2.97Å; E19-Y23 PolarHBondContact O-N 3.43Å; T20-Y23 PolarHBondContact O-N 3Å; S21-Y23 PolarHBondContact O-N 3.18Å; Y23-W25 VanDerWaalsContact C-N 3.33Å; Y23-W25 PolarHBondContact O-N 3.04Å; Y23-W26 PolarHBondContact O-N 2.99Å; Y23-I27 WeakPolarHBondContact O-CB 3.3Å; Y23-I27 WeakPolarHBondContact O-CG1 3.41Å; Y23-I27 PolarHBondContact O-N 3.38Å; Y23-N104 HydrophobicContact CE1-CB 4.09Å; Y23-L148 HydrophobicContact CD1-CD2 3.92Å; Y23-L148 HydrophobicContact CD2-CB 4.41Å; Y23-L148 HydrophobicContact CE1-CD2 4.06Å; Y23-L148 HydrophobicContact CG-CB 4.49Å; Y23-L148 HydrophobicContact CG-CD2 4.43Å; Y23-E151 PolarHBondContact OH-OE1 3.02Å; Y23-E151 PolarHBondContact OH-OE2 3.25Å
24L94.7Very high86.5Confident100 Ų10073.6 Ų73.652%0.52436%0.362SS..Hα-helixtrans-61.1-42.1178.6-70.8174.3000111.7T20 S21 F22 W26 I27 L28T20-L24 HydrophobicContact CG2-CD1 4.15Å; T20-L24 WeakPolarHBondContact O-CG 3.08Å; T20-L24 PolarHBondContact O-N 3.13Å; S21-L24 PolarHBondContact O-N 3.32Å; F22-L24 PolarHBondContact O-N 3.13Å; L24-W26 PolarHBondContact O-N 3.41Å; L24-I27 PolarHBondContact O-N 3.28Å; L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.28Å; L24-L28 WeakPolarHBondContact O-CG 3.48Å; L24-L28 PolarHBondContact O-N 3.13Å
25W95.8Very high88.7Confident172 Ų17269.2 Ų69.265%0.65235%0.348SS*.Hα-helixtrans-59-46.6175.9-78.6121.7000112.2S21 F22 Y23 L28 I29S21-W25 PolarHBondContact O-N 3.21Å; F22-W25 PolarHBondContact O-N 3.31Å; Y23-W25 VanDerWaalsContact C-N 3.33Å; Y23-W25 PolarHBondContact O-N 3.04Å; W25-L28 HydrophobicContact CE3-CD1 4.41Å; W25-L28 PolarHBondContact O-N 3.3Å; W25-I29 VanDerWaalsContact O-CG1 3.29Å; W25-I29 WeakPolarHBondContact O-CG1 3.45Å; W25-I29 PolarHBondContact O-N 2.81Å
26W97Very high90.3Very high64 Ų6470.4 Ų70.424%0.24235%0.35CS..Hα-helixtrans-71.2-33.3179-70.5113.2000113.4F22 Y23 L24 I29 G30 F101 F105 C108 I109F22-W26 AromaticContact CD1-CD1 3.84Å; F22-W26 AromaticContact CD2-CD1 3.88Å; F22-W26 AromaticContact CD2-NE1 3.52Å; F22-W26 AromaticContact CE1-CD1 3.54Å; F22-W26 AromaticContact CE1-NE1 3.78Å; F22-W26 AromaticContact CE2-CD1 3.62Å; F22-W26 AromaticContact CE2-NE1 3Å; F22-W26 AromaticContact CG-CD1 3.98Å; F22-W26 AromaticContact CZ-CD1 3.42Å; F22-W26 VanDerWaalsContact CZ-CD1 3.42Å; F22-W26 AromaticContact CZ-NE1 3.14Å; F22-W26 PolarHBondContact O-N 3.02Å; Y23-W26 PolarHBondContact O-N 2.99Å; L24-W26 PolarHBondContact O-N 3.41Å; W26-I29 HydrophobicContact CD2-CD1 4.23Å; W26-I29 HydrophobicContact CE3-CB 4.32Å; W26-I29 HydrophobicContact CE3-CD1 3.59Å; W26-I29 HydrophobicContact CE3-CG2 4.29Å; W26-I29 HydrophobicContact CZ3-CD1 3.76Å; W26-I29 HydrophobicContact CZ3-CG2 4.46Å; W26-I29 PolarHBondContact O-N 3.04Å; W26-G30 PolarHBondContact O-N 3.18Å; W26-F101 HydrophobicContact CH2-CZ 4.36Å; W26-F101 AromaticContact CZ2-CE2 3.96Å; W26-F101 HydrophobicContact CZ2-CE2 3.96Å; W26-F101 AromaticContact CZ2-CZ 3.87Å; W26-F101 HydrophobicContact CZ2-CZ 3.87Å; W26-F105 AromaticContact CD2-CD2 3.92Å; W26-F105 HydrophobicContact CD2-CD2 3.92Å; W26-F105 HydrophobicContact CD2-CE2 4.36Å; W26-F105 AromaticContact CE3-CD2 3.6Å; W26-F105 HydrophobicContact CE3-CD2 3.6Å; W26-F105 AromaticContact CE3-CE2 3.58Å; W26-F105 HydrophobicContact CE3-CE2 3.58Å; W26-F105 HydrophobicContact CH2-CD2 4.31Å; W26-F105 HydrophobicContact CH2-CE2 4.26Å; W26-F105 AromaticContact CZ3-CD2 3.82Å; W26-F105 HydrophobicContact CZ3-CD2 3.82Å; W26-F105 AromaticContact CZ3-CE2 3.53Å; W26-F105 HydrophobicContact CZ3-CE2 3.53Å; W26-C108 HydrophobicContact CB-CB 3.43Å; W26-C108 VanDerWaalsContact CB-CB 3.43Å; W26-I109 HydrophobicContact CE3-CD1 4.43Å
27I97.6Very high91.7Very high23 Ų2367.9 Ų67.912%0.11834%0.337CS..Hα-helixtrans-62.8-44.8172.3-69.9167.5000110.1Y23 L24 G30 F31 C108 C111 G112 I115Y23-I27 WeakPolarHBondContact O-CB 3.3Å; Y23-I27 WeakPolarHBondContact O-CG1 3.41Å; Y23-I27 PolarHBondContact O-N 3.38Å; L24-I27 PolarHBondContact O-N 3.28Å; I27-G30 PolarHBondContact O-N 3.48Å; I27-F31 PolarHBondContact O-N 2.89Å; I27-C108 HydrophobicContact CG1-CB 3.98Å; I27-C111 HydrophobicContact CD1-CB 4.45Å; I27-C111 HydrophobicContact CG1-CB 4.17Å; I27-G112 VanDerWaalsContact O-CA 3.32Å; I27-G112 WeakPolarHBondContact O-CA 3.4Å; I27-I115 HydrophobicContact CG2-CD1 3.97Å
28L97.8Very high93.2Very high82 Ų8264.7 Ų64.743%0.42932%0.317SS..Hα-helixtrans-62-43.9175.4-72.2171.1000111.4L24 W25 G30 F31 F32L24-L28 WeakPolarHBondContact O-CB 3.31Å; L24-L28 VanDerWaalsContact O-CG 3.28Å; L24-L28 WeakPolarHBondContact O-CG 3.48Å; L24-L28 PolarHBondContact O-N 3.13Å; W25-L28 HydrophobicContact CE3-CD1 4.41Å; W25-L28 PolarHBondContact O-N 3.3Å; L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 2.84Å; L28-F31 WeakPolarHBondContact O-CB 3.26Å; L28-F31 PolarHBondContact O-N 3.41Å; L28-F32 WeakPolarHBondContact O-CD2 2.99Å; L28-F32 PolarHBondContact O-N 3.11Å
29I97.9Very high94.3Very high71 Ų7163.5 Ų63.536%0.36431%0.308SS..Hα-helixtrans-59.1-42.5174.5-70.4165.2000110.7W25 W26 F31 F32 S33 I109W25-I29 VanDerWaalsContact O-CG1 3.29Å; W25-I29 WeakPolarHBondContact O-CG1 3.45Å; W25-I29 PolarHBondContact O-N 2.81Å; W26-I29 HydrophobicContact CD2-CD1 4.23Å; W26-I29 HydrophobicContact CE3-CB 4.32Å; W26-I29 HydrophobicContact CE3-CD1 3.59Å; W26-I29 HydrophobicContact CE3-CG2 4.29Å; W26-I29 HydrophobicContact CZ3-CD1 3.76Å; W26-I29 HydrophobicContact CZ3-CG2 4.46Å; W26-I29 PolarHBondContact O-N 3.04Å; I29-F31 PolarHBondContact O-N 3.16Å; I29-F32 PolarHBondContact O-N 3.33Å; I29-S33 VanDerWaalsContact O-CB 3.23Å; I29-S33 WeakPolarHBondContact O-CB 3.47Å; I29-S33 PolarHBondContact O-N 3.01Å; I29-S33 PolarHBondContact O-OG 3.35Å; I29-I109 HydrophobicContact CB-CD1 4.49Å; I29-I109 HydrophobicContact CG2-CD1 4.05Å
30G98.3Very high95.4Very high0 Ų064 Ų640%031%0.314CS..Hα-helixtrans-60.4-43.417500000112.6W26 I27 L28 S34W26-G30 PolarHBondContact O-N 3.18Å; I27-G30 PolarHBondContact O-N 3.48Å; L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 2.84Å; G30-S34 WeakPolarHBondContact O-CB 3.32Å; G30-S34 PolarHBondContact O-N 3.08Å; G30-S34 PolarHBondContact O-OG 3.21Å
31F98.5Very high96.3Very high53 Ų5364.8 Ų64.823%0.23231%0.314CS..Hα-helixtrans-63.1-50.7176.1-176.6-84.1000112I27 L28 I29 S33 S34 F35 I115 Y116 L119I27-F31 PolarHBondContact O-N 2.89Å; L28-F31 WeakPolarHBondContact O-CB 3.26Å; L28-F31 PolarHBondContact O-N 3.41Å; I29-F31 PolarHBondContact O-N 3.16Å; F31-S33 PolarHBondContact O-N 3.45Å; F31-S34 WeakPolarHBondContact O-CB 3.26Å; F31-S34 PolarHBondContact O-N 3.17Å; F31-F35 PolarHBondContact O-N 3.43Å; F31-I115 HydrophobicContact CD2-CB 4.29Å; F31-I115 HydrophobicContact CD2-CG2 3.94Å; F31-I115 HydrophobicContact CE2-CG2 3.99Å; F31-Y116 HydrophobicContact CD2-CD2 4.36Å; F31-Y116 HydrophobicContact CE1-CD2 4.18Å; F31-Y116 AromaticContact CE2-CD2 3.96Å; F31-Y116 HydrophobicContact CE2-CD2 3.96Å; F31-Y116 HydrophobicContact CE2-CG 4.37Å; F31-Y116 AromaticContact CZ-CD2 3.85Å; F31-Y116 HydrophobicContact CZ-CD2 3.85Å; F31-L119 HydrophobicContact CE2-CD1 3.89Å; F31-L119 HydrophobicContact CZ-CD1 4.12Å
32F98.4Very high97Very high124 Ų12462.3 Ų62.354%0.54430%0.297SS..Hα-helixtrans-66.2-37.8179.6-80-70.4000112.3L28 I29 S34 F35 L36L28-F32 WeakPolarHBondContact O-CD2 2.99Å; L28-F32 PolarHBondContact O-N 3.11Å; I29-F32 PolarHBondContact O-N 3.33Å; F32-S34 VanDerWaalsContact C-N 3.27Å; F32-S34 PolarHBondContact O-N 3.01Å; F32-F35 WeakPolarHBondContact O-CB 3.24Å; F32-F35 PolarHBondContact O-N 3.41Å; F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 3.21Å
33S98.4Very high97.4Very high48 Ų4859.3 Ų59.334%0.33628%0.284SS..Hα-helixtrans-61.6-40.5173.4-58.40000110.8I29 F31 L36 I37I29-S33 VanDerWaalsContact O-CB 3.23Å; I29-S33 WeakPolarHBondContact O-CB 3.47Å; I29-S33 PolarHBondContact O-N 3.01Å; I29-S33 PolarHBondContact O-OG 3.35Å; F31-S33 PolarHBondContact O-N 3.45Å; S33-L36 PolarHBondContact O-N 3.38Å; S33-I37 WeakPolarHBondContact O-CB 3.45Å; S33-I37 WeakPolarHBondContact O-CD1 3.32Å; S33-I37 VanDerWaalsContact O-CG1 3.27Å; S33-I37 WeakPolarHBondContact O-CG1 3.48Å; S33-I37 PolarHBondContact O-N 2.94Å
34S98.6Very high97.5Very high6 Ų660.8 Ų60.84%0.04230%0.301CS..Hα-helixtrans-63.5-41.2176.4-60.10000112.3G30 F31 F32 I37 T38 Y113G30-S34 WeakPolarHBondContact O-CB 3.32Å; G30-S34 PolarHBondContact O-N 3.08Å; G30-S34 PolarHBondContact O-OG 3.21Å; F31-S34 WeakPolarHBondContact O-CB 3.26Å; F31-S34 PolarHBondContact O-N 3.17Å; F32-S34 VanDerWaalsContact C-N 3.27Å; F32-S34 PolarHBondContact O-N 3.01Å; S34-I37 PolarHBondContact O-N 3.27Å; S34-T38 WeakPolarHBondContact O-CB 3.38Å; S34-T38 PolarHBondContact O-N 3.32Å; S34-T38 PolarHBondContact O-OG1 2.89Å; S34-Y113 WeakPolarHBondContact OG-CA 3.49Å
35F98.3Very high97.6Very high90 Ų9057.9 Ų57.940%0.39529%0.287SS..Hα-helixtrans-59.3-50.6171.5170.2-93.9000112.1F31 F32 I37 T38 E39 Y116F31-F35 PolarHBondContact O-N 3.43Å; F32-F35 WeakPolarHBondContact O-CB 3.24Å; F32-F35 PolarHBondContact O-N 3.41Å; F35-I37 VanDerWaalsContact C-N 3.33Å; F35-I37 PolarHBondContact O-N 3.4Å; F35-T38 PolarHBondContact O-N 2.74Å; F35-E39 HydrophobicContact CD2-CG 3.74Å; F35-E39 HydrophobicContact CE2-CB 4.28Å; F35-E39 HydrophobicContact CE2-CG 3.59Å; F35-E39 HydrophobicContact CG-CG 4.43Å; F35-E39 HydrophobicContact CZ-CB 4.35Å; F35-E39 HydrophobicContact CZ-CG 4.15Å; F35-E39 WeakPolarHBondContact O-CB 3.35Å; F35-E39 PolarHBondContact O-N 3.41Å; F35-Y116 HydrophobicContact CB-CD2 4.16Å; F35-Y116 HydrophobicContact CB-CE2 3.66Å; F35-Y116 HydrophobicContact CD2-CE2 4.08Å; F35-Y116 HydrophobicContact CG-CE2 4.39Å
36L98.2Very high97.6Very high81 Ų8149.9 Ų49.942%0.42426%0.257SS..Hα-helixtrans-62.1-41-179.5-66.4173.6000111.9F32 S33 L40 I41F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 3.21Å; S33-L36 PolarHBondContact O-N 3.38Å; L36-L40 HydrophobicContact CD2-CD1 3.64Å; L36-L40 VanDerWaalsContact O-CB 3.31Å; L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 PolarHBondContact O-N 3.43Å; L36-I41 PolarHBondContact O-N 2.92Å; L36-I41 VanDerWaalsContact O-N 3.14Å
37I98.2Very high97.5Very high32 Ų3253.5 Ų53.516%0.16427%0.271CS..Iπ-helixtrans-62.5-45.6176.4-70.1162.7000110.6S33 S34 F35 I41 S42 L69 V72S33-I37 WeakPolarHBondContact O-CB 3.45Å; S33-I37 WeakPolarHBondContact O-CD1 3.32Å; S33-I37 VanDerWaalsContact O-CG1 3.27Å; S33-I37 WeakPolarHBondContact O-CG1 3.48Å; S33-I37 PolarHBondContact O-N 2.94Å; S34-I37 PolarHBondContact O-N 3.27Å; F35-I37 VanDerWaalsContact C-N 3.33Å; F35-I37 PolarHBondContact O-N 3.4Å; I37-I41 HydrophobicContact CG1-CD1 4.04Å; I37-I41 PolarHBondContact O-N 3.5Å; I37-S42 WeakPolarHBondContact O-CB 3.5Å; I37-S42 PolarHBondContact O-N 3.3Å; I37-L69 HydrophobicContact CB-CD1 3.92Å; I37-L69 HydrophobicContact CD1-CD1 4.09Å; I37-L69 HydrophobicContact CG2-CB 4.31Å; I37-L69 HydrophobicContact CG2-CD1 3.8Å; I37-V72 HydrophobicContact CD1-CG1 4.08Å
38T98Very high97.4Very high5 Ų558.5 Ų58.53%0.03130%0.297CS..Iπ-helixtrans-75.1-40.8-173.5-550000112.7S34 F35 P43 N65 L69 Y116S34-T38 WeakPolarHBondContact O-CB 3.38Å; S34-T38 PolarHBondContact O-N 3.32Å; S34-T38 PolarHBondContact O-OG1 2.89Å; F35-T38 PolarHBondContact O-N 2.74Å; T38-P43 VanDerWaalsContact O-CD 3.26Å; T38-P43 WeakPolarHBondContact O-CD 3.31Å; T38-N65 HydrophobicContact CG2-CB 3.75Å; T38-L69 WeakPolarHBondContact OG1-CD2 3.43Å; T38-Y116 VanDerWaalsContact CB-OH 3.27Å; T38-Y116 WeakPolarHBondContact CB-OH 3.33Å; T38-Y116 HydrophobicContact CG2-CE1 4.07Å; T38-Y116 WeakPolarHBondContact CG2-OH 3.36Å; T38-Y116 VanDerWaalsContact OG1-CE1 3.32Å; T38-Y116 WeakPolarHBondContact OG1-CE1 3.35Å
39E96.4Very high97.1Very high74 Ų7463.8 Ų63.835%0.34631%0.312SS..Iπ-helixtrans-94-23.3-172.1-61.3-57.8151.400113.5F35 Y116F35-E39 HydrophobicContact CD2-CG 3.74Å; F35-E39 HydrophobicContact CE2-CB 4.28Å; F35-E39 HydrophobicContact CE2-CG 3.59Å; F35-E39 HydrophobicContact CG-CG 4.43Å; F35-E39 HydrophobicContact CZ-CB 4.35Å; F35-E39 HydrophobicContact CZ-CG 4.15Å; F35-E39 WeakPolarHBondContact O-CB 3.35Å; F35-E39 PolarHBondContact O-N 3.41Å; E39-Y116 PolarHBondContact OE1-OH 3.47Å
40L96.8Very high96.9Very high108 Ų10861.1 Ų61.157%0.56530%0.3SS*.Iπ-helixtrans-116.6-57.5-177.5-54.6177.7000112.4L36 A44L36-L40 HydrophobicContact CD2-CD1 3.64Å; L36-L40 VanDerWaalsContact O-CB 3.31Å; L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 PolarHBondContact O-N 3.43Å; L40-A44 VanDerWaalsContact O-CB 3.27Å; L40-A44 WeakPolarHBondContact O-CB 3.23Å; L40-A44 PolarHBondContact O-N 2.97Å; L40-A44 VanDerWaalsContact O-N 3.14Å
41I97.3Very high96.5Very high85 Ų8570.5 Ų70.544%0.43634%0.341SS..Iπ-helixtrans-71.3-50.8-170-56.8178000110.8L36 I37 A44 V45L36-I41 PolarHBondContact O-N 2.92Å; L36-I41 VanDerWaalsContact O-N 3.14Å; I37-I41 HydrophobicContact CG1-CD1 4.04Å; I37-I41 PolarHBondContact O-N 3.5Å; I41-A44 PolarHBondContact O-N 2.77Å; I41-V45 HydrophobicContact CG2-CG2 4.08Å; I41-V45 WeakPolarHBondContact O-CG2 3.35Å; I41-V45 PolarHBondContact O-N 3Å
42S97.7Very high96.2Very high0 Ų069.4 Ų69.40%034%0.34CS..Hα-helixtrans-57.6-48.6-179171.60000112I37 S46 N65 W68I37-S42 WeakPolarHBondContact O-CB 3.5Å; I37-S42 PolarHBondContact O-N 3.3Å; S42-S46 WeakPolarHBondContact O-CB 3.45Å; S42-S46 PolarHBondContact O-N 3.07Å; S42-S46 PolarHBondContact O-OG 2.87Å; S42-N65 WeakPolarHBondContact OG-CA 3.07Å; S42-N65 PolarHBondContact OG-OD1 3.22Å; S42-W68 VanDerWaalsContact OG-CB 3.3Å; S42-W68 WeakPolarHBondContact OG-CB 3.46Å
43P96.9Very high96Very high6 Ų663.8 Ų63.84%0.03932%0.315CS..Hα-helixtrans-61.8-43175.2-25.334.9000113.8T38 R47 Y53T38-P43 VanDerWaalsContact O-CD 3.26Å; T38-P43 WeakPolarHBondContact O-CD 3.31Å; P43-R47 WeakPolarHBondContact O-CG 3.27Å; P43-R47 PolarHBondContact O-N 3.49Å; P43-R47 VanDerWaalsContact O-N 3.09Å; P43-Y53 WeakPolarHBondContact CA-OH 3.49Å; P43-Y53 HydrophobicContact CB-CE1 4.31Å; P43-Y53 WeakPolarHBondContact CB-OH 3.48Å; P43-Y53 WeakPolarHBondContact CG-OH 3.49Å
44A96.4Very high95.7Very high53 Ų5368.6 Ų68.644%0.43833%0.332SS..Hα-helixtrans-61.8-48.7-179.600000111.5L40 I41 I48L40-A44 VanDerWaalsContact O-CB 3.27Å; L40-A44 WeakPolarHBondContact O-CB 3.23Å; L40-A44 PolarHBondContact O-N 2.97Å; L40-A44 VanDerWaalsContact O-N 3.14Å; I41-A44 PolarHBondContact O-N 2.77Å; A44-I48 WeakPolarHBondContact O-CD1 3.43Å; A44-I48 WeakPolarHBondContact O-CG1 3.41Å
45V96.3Very high95.4Very high39 Ų3973 Ų7324%0.23636%0.363CS..Hα-helixtrans-69.1-43.9179.3178.40000110.8I41 R47 I48 Y49 W68I41-V45 HydrophobicContact CG2-CG2 4.08Å; I41-V45 WeakPolarHBondContact O-CG2 3.35Å; I41-V45 PolarHBondContact O-N 3Å; V45-R47 PolarHBondContact O-N 3.07Å; V45-I48 PolarHBondContact O-N 3.39Å; V45-I48 VanDerWaalsContact O-N 3.12Å; V45-Y49 HydrophobicContact CG1-CD2 3.63Å; V45-Y49 HydrophobicContact CG1-CE2 3.91Å; V45-Y49 VanDerWaalsContact O-CD2 3.31Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.19Å; V45-Y49 VanDerWaalsContact O-N 3.15Å; V45-W68 HydrophobicContact CB-CH2 4.29Å; V45-W68 HydrophobicContact CB-CZ2 4.26Å; V45-W68 HydrophobicContact CG1-CH2 3.64Å; V45-W68 HydrophobicContact CG1-CZ2 3.57Å
46S96.8Very high95.3Very high3 Ų370 Ų702%0.02135%0.35CS..Hα-helixtrans-65.9-36.3-174.9-61.80000113S42 I48 Y49 S50 W64 W68S42-S46 WeakPolarHBondContact O-CB 3.45Å; S42-S46 PolarHBondContact O-N 3.07Å; S42-S46 PolarHBondContact O-OG 2.87Å; S46-I48 VanDerWaalsContact C-N 3.28Å; S46-I48 PolarHBondContact O-N 3.33Å; S46-Y49 PolarHBondContact O-N 3.49Å; S46-S50 WeakPolarHBondContact O-CA 3.15Å; S46-S50 WeakPolarHBondContact O-CB 3.34Å; S46-S50 PolarHBondContact O-N 3.43Å; S46-W64 PolarHBondContact OG-NE1 3.4Å; S46-W68 PolarHBondContact OG-NE1 2.87Å
47R95.1Very high95.2Very high140 Ų14068.9 Ų68.953%0.52835%0.35SS..Hα-helixtrans-62.9-34173.8-74.2178.2-170150.34.5112.8P43 V45 Y53P43-R47 WeakPolarHBondContact O-CG 3.27Å; P43-R47 PolarHBondContact O-N 3.49Å; P43-R47 VanDerWaalsContact O-N 3.09Å; V45-R47 PolarHBondContact O-N 3.07Å; R47-Y53 HydrophobicContact CG-CD1 3.62Å; R47-Y53 HydrophobicContact CG-CE1 3.89Å
48I94.3Very high95.1Very high129 Ų12974.7 Ų74.766%0.66237%0.37SS*.Hα-helixtrans-72.2-45179.8-64.5167.1000110.7A44 V45 S46A44-I48 WeakPolarHBondContact O-CD1 3.43Å; A44-I48 WeakPolarHBondContact O-CG1 3.41Å; V45-I48 PolarHBondContact O-N 3.39Å; V45-I48 VanDerWaalsContact O-N 3.12Å; S46-I48 VanDerWaalsContact C-N 3.28Å; S46-I48 PolarHBondContact O-N 3.33Å
49Y92.8Very high95Very high193 Ų19379.8 Ų79.876%0.75739%0.391SS*.Hα-helixtrans-98.9-16.2-168.9-68.3-73.7000115.1V45 S46V45-Y49 HydrophobicContact CG1-CD2 3.63Å; V45-Y49 HydrophobicContact CG1-CE2 3.91Å; V45-Y49 VanDerWaalsContact O-CD2 3.31Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.19Å; V45-Y49 VanDerWaalsContact O-N 3.15Å; S46-Y49 PolarHBondContact O-N 3.49Å
50S92.4Very high95Very high15 Ų1579.5 Ų79.511%0.10539%0.39CS..  trans-133.7104.3-175.4-178.20000111.6S46 S52 Y53 W64S46-S50 WeakPolarHBondContact O-CA 3.15Å; S46-S50 WeakPolarHBondContact O-CB 3.34Å; S46-S50 PolarHBondContact O-N 3.43Å; S50-S52 PolarHBondContact O-N 2.81Å; S50-Y53 WeakPolarHBondContact O-CB 3.35Å; S50-Y53 PolarHBondContact O-N 3Å; S50-W64 VanDerWaalsContact OG-CH2 3.29Å; S50-W64 WeakPolarHBondContact OG-CH2 3.43Å
51K90.3Very high95Very high196 Ų19676.6 Ų76.685%0.85237%0.372SS*.THydrogen-bonded Turntrans-57.3-32.9172.5-66.3-174.8179.2-178.50112.2Y53 E54K51-Y53 PolarHBondContact O-N 3.4Å; K51-Y53 VanDerWaalsContact O-N 3.17Å; K51-E54 PolarHBondContact O-N 3.36Å
52S92.3Very high95Very high30 Ų3073.7 Ų73.721%0.2136%0.357CS..Hα-helixtrans-61.1-24.1177.9-50.90000112.8S50 E54 S55 I56S50-S52 PolarHBondContact O-N 2.81Å; S52-E54 PolarHBondContact O-N 3.21Å; S52-S55 PolarHBondContact O-N 3.33Å; S52-S55 VanDerWaalsContact O-N 3.16Å; S52-S55 PolarHBondContact O-OG 3.31Å; S52-I56 WeakPolarHBondContact O-CG2 3.4Å; S52-I56 PolarHBondContact O-N 3.37Å
53Y94.6Very high95Very high6 Ų674.8 Ų74.82%0.02436%0.362CS..Hα-helixtrans-63.4-27.4-177.1-172-104.6000113.5P43 R47 S50 K51 I56 Y61 W64 N65P43-Y53 WeakPolarHBondContact CA-OH 3.49Å; P43-Y53 HydrophobicContact CB-CE1 4.31Å; P43-Y53 WeakPolarHBondContact CB-OH 3.48Å; P43-Y53 WeakPolarHBondContact CG-OH 3.49Å; R47-Y53 HydrophobicContact CG-CD1 3.62Å; R47-Y53 HydrophobicContact CG-CE1 3.89Å; S50-Y53 WeakPolarHBondContact O-CB 3.35Å; S50-Y53 PolarHBondContact O-N 3Å; K51-Y53 PolarHBondContact O-N 3.4Å; K51-Y53 VanDerWaalsContact O-N 3.17Å; Y53-I56 HydrophobicContact CD2-CD1 3.94Å; Y53-I56 HydrophobicContact CE2-CD1 4.39Å; Y53-I56 VanDerWaalsContact O-CG1 3.25Å; Y53-I56 WeakPolarHBondContact O-CG1 3.32Å; Y53-Y61 HydrophobicContact CE1-CD2 4.14Å; Y53-Y61 AromaticContact CE1-CE2 3.76Å; Y53-Y61 HydrophobicContact CE1-CE2 3.76Å; Y53-Y61 HydrophobicContact CE2-CD2 4.12Å; Y53-Y61 HydrophobicContact CE2-CE2 4.3Å; Y53-Y61 AromaticContact CZ-CD2 3.69Å; Y53-Y61 AromaticContact CZ-CE2 3.43Å; Y53-Y61 VanDerWaalsContact CZ-CE2 3.43Å; Y53-Y61 WeakPolarHBondContact OH-CE2 3.27Å; Y53-W64 HydrophobicContact CD2-CB 4.5Å; Y53-W64 AromaticContact CD2-CD1 3.57Å; Y53-W64 AromaticContact CD2-CD2 3.73Å; Y53-W64 HydrophobicContact CD2-CD2 3.73Å; Y53-W64 AromaticContact CD2-CE2 3.68Å; Y53-W64 HydrophobicContact CD2-CE3 4.45Å; Y53-W64 AromaticContact CD2-CG 3.71Å; Y53-W64 HydrophobicContact CD2-CG 3.71Å; Y53-W64 HydrophobicContact CD2-CZ2 4.4Å; Y53-W64 AromaticContact CD2-NE1 3.52Å; Y53-W64 HydrophobicContact CE2-CB 4.18Å; Y53-W64 AromaticContact CE2-CD1 3.32Å; Y53-W64 HydrophobicContact CE2-CD2 4.19Å; Y53-W64 AromaticContact CE2-CG 3.65Å; Y53-W64 HydrophobicContact CE2-CG 3.65Å; Y53-W64 AromaticContact CE2-NE1 3.7Å; Y53-N65 VanDerWaalsContact OH-CG 3.3Å; Y53-N65 PolarHBondContact OH-ND2 3.27Å; Y53-N65 VanDerWaalsContact OH-ND2 3.11Å; Y53-N65 PolarHBondContact OH-OD1 2.89Å
54E92.3Very high95.1Very high150 Ų15075 Ų7570%0.70136%0.362SS*.Hα-helixtrans-84-20.7178.4-62.4-169.9165.500113K51 S52K51-E54 PolarHBondContact O-N 3.36Å; S52-E54 PolarHBondContact O-N 3.21Å
55S93Very high95.2Very high98 Ų9872.5 Ų72.569%0.68534%0.342SS*.Hα-helixtrans-99.7-5.3-175.8600000114.4S52S52-S55 PolarHBondContact O-N 3.33Å; S52-S55 VanDerWaalsContact O-N 3.16Å; S52-S55 PolarHBondContact O-OG 3.31Å
56I95.6Very high95.2Very high26 Ų2670.8 Ų70.813%0.13333%0.332CS..SBendtrans-77.5153.4-177.550.8173.9000112.6S52 Y53 Q60 W64 T178S52-I56 WeakPolarHBondContact O-CG2 3.4Å; S52-I56 PolarHBondContact O-N 3.37Å; Y53-I56 HydrophobicContact CD2-CD1 3.94Å; Y53-I56 HydrophobicContact CE2-CD1 4.39Å; Y53-I56 VanDerWaalsContact O-CG1 3.25Å; Y53-I56 WeakPolarHBondContact O-CG1 3.32Å; I56-Q60 HydrophobicContact CB-CB 3.86Å; I56-Q60 HydrophobicContact CD1-CB 4.27Å; I56-Q60 HydrophobicContact CG1-CB 4.49Å; I56-Q60 HydrophobicContact CG2-CB 4.33Å; I56-W64 HydrophobicContact CD1-CB 4.18Å; I56-W64 HydrophobicContact CD1-CD2 4.33Å; I56-W64 HydrophobicContact CD1-CE3 4.01Å; I56-W64 HydrophobicContact CD1-CG 4.43Å; I56-T178 HydrophobicContact CG2-CG2 3.64Å
57S95.9Very high95.3Very high59 Ų5973 Ų7341%0.41334%0.339SS..  trans-62.2157.1175.165.80000112.1K59 Q60 Y61S57-K59 PolarHBondContact O-N 3Å; S57-K59 VanDerWaalsContact O-N 3.14Å; S57-Q60 VanDerWaalsContact N-OE1 3.11Å; S57-Q60 PolarHBondContact O-N 3.32Å; S57-Q60 WeakPolarHBondContact OG-CG 3.33Å; S57-Q60 PolarHBondContact OG-N 3.3Å; S57-Q60 PolarHBondContact OG-OE1 3.49Å; S57-Y61 PolarHBondContact O-N 3.45Å
58R95.8Very high95.4Very high154 Ų15469.9 Ų69.958%0.58133%0.328SS*.Hα-helixtrans-53.1-38.3176.2178.658.1175.5146.71.3113Y61 L62R58-Y61 WeakPolarHBondContact O-CB 3.4Å; R58-Y61 PolarHBondContact O-N 3.14Å; R58-L62 WeakPolarHBondContact O-CG 3.4Å; R58-L62 PolarHBondContact O-N 2.93Å
59K95.9Very high95.6Very high112 Ų11263.9 Ų63.949%0.48730%0.297SS..Hα-helixtrans-63.7-48.2176.8-173.6-169.2179.7-166.90111.4S57 Y61 L62 E63 Y124S57-K59 PolarHBondContact O-N 3Å; S57-K59 VanDerWaalsContact O-N 3.14Å; K59-Y61 VanDerWaalsContact C-N 3.32Å; K59-Y61 PolarHBondContact O-N 2.98Å; K59-L62 PolarHBondContact O-N 3.15Å; K59-E63 PolarHBondContact O-N 3.35Å; K59-Y124 WeakPolarHBondContact CE-O 3.33Å
60Q96.7Very high95.9Very high67 Ų6755.3 Ų55.331%0.31327%0.265SS..Hα-helixtrans-66-34.4177.3-75.5167.2-53.800112I56 S57 L62 E63 W64I56-Q60 HydrophobicContact CB-CB 3.86Å; I56-Q60 HydrophobicContact CD1-CB 4.27Å; I56-Q60 HydrophobicContact CG1-CB 4.49Å; I56-Q60 HydrophobicContact CG2-CB 4.33Å; S57-Q60 VanDerWaalsContact N-OE1 3.11Å; S57-Q60 PolarHBondContact O-N 3.32Å; S57-Q60 WeakPolarHBondContact OG-CG 3.33Å; S57-Q60 PolarHBondContact OG-N 3.3Å; S57-Q60 PolarHBondContact OG-OE1 3.49Å; Q60-L62 VanDerWaalsContact C-N 3.34Å; Q60-L62 PolarHBondContact O-N 3.35Å; Q60-E63 PolarHBondContact O-N 2.89Å; Q60-W64 WeakPolarHBondContact O-CB 3.31Å; Q60-W64 PolarHBondContact O-N 2.97Å
61Y97Very high96.2Very high47 Ų4756 Ų5618%0.18427%0.269CS..Hα-helixtrans-58.2-47.2174.2172.1-81.2000111.4Y53 S57 R58 K59 W64 N65Y53-Y61 HydrophobicContact CE1-CD2 4.14Å; Y53-Y61 AromaticContact CE1-CE2 3.76Å; Y53-Y61 HydrophobicContact CE1-CE2 3.76Å; Y53-Y61 HydrophobicContact CE2-CD2 4.12Å; Y53-Y61 HydrophobicContact CE2-CE2 4.3Å; Y53-Y61 AromaticContact CZ-CD2 3.69Å; Y53-Y61 AromaticContact CZ-CE2 3.43Å; Y53-Y61 VanDerWaalsContact CZ-CE2 3.43Å; Y53-Y61 WeakPolarHBondContact OH-CE2 3.27Å; S57-Y61 PolarHBondContact O-N 3.45Å; R58-Y61 WeakPolarHBondContact O-CB 3.4Å; R58-Y61 PolarHBondContact O-N 3.14Å; K59-Y61 VanDerWaalsContact C-N 3.32Å; K59-Y61 PolarHBondContact O-N 2.98Å; Y61-W64 PolarHBondContact O-N 3.01Å; Y61-N65 WeakPolarHBondContact CE1-ND2 3.08Å; Y61-N65 VanDerWaalsContact CZ-ND2 3.34Å; Y61-N65 PolarHBondContact O-N 3.45Å
62L97.4Very high96.6Very high24 Ų2449.4 Ų49.413%0.12625%0.245CC..Hα-helixtrans-64-47.4178.2-68.5170.8000111R58 K59 Q60 W64 N65 A66 M123 Y124R58-L62 WeakPolarHBondContact O-CG 3.4Å; R58-L62 PolarHBondContact O-N 2.93Å; K59-L62 PolarHBondContact O-N 3.15Å; Q60-L62 VanDerWaalsContact C-N 3.34Å; Q60-L62 PolarHBondContact O-N 3.35Å; L62-W64 VanDerWaalsContact C-N 3.3Å; L62-W64 PolarHBondContact O-N 3.41Å; L62-N65 PolarHBondContact O-N 3.16Å; L62-A66 PolarHBondContact O-N 3.44Å; L62-M123 HydrophobicContact CD1-CB 3.93Å; L62-M123 HydrophobicContact CD1-CE 3.97Å; L62-M123 HydrophobicContact CD2-CE 4.08Å; L62-Y124 HydrophobicContact CB-CD1 3.98Å; L62-Y124 HydrophobicContact CB-CG 4.4Å
63E97.7Very high96.9Very high23 Ų2348.4 Ų48.411%0.10724%0.237CC..Hα-helixtrans-63.9-35.6177.9-171.9173.417400112.1K59 Q60 A66 R67 Y124 W174K59-E63 PolarHBondContact O-N 3.35Å; Q60-E63 PolarHBondContact O-N 2.89Å; E63-A66 PolarHBondContact O-N 2.89Å; E63-R67 HydrophobicContact CG-CG 4.34Å; E63-R67 WeakPolarHBondContact O-CB 3.42Å; E63-R67 VanDerWaalsContact O-CG 3.23Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.66Å; E63-R67 IonicContact OE1-CZ 3.33Å; E63-R67 IonicContact OE1-NE 2.98Å; E63-R67 PolarHBondContact OE1-NE 3.39Å; E63-R67 IonicContact OE1-NH2 2.77Å; E63-R67 PolarHBondContact OE1-NH2 2.96Å; E63-Y124 HydrophobicContact CB-CD2 3.61Å; E63-Y124 HydrophobicContact CB-CE2 4.06Å; E63-Y124 HydrophobicContact CB-CG 3.97Å; E63-Y124 HydrophobicContact CG-CD2 3.73Å; E63-Y124 HydrophobicContact CG-CE2 3.81Å; E63-W174 HydrophobicContact CB-CH2 4.2Å; E63-W174 HydrophobicContact CB-CZ2 3.84Å; E63-W174 VanDerWaalsContact CD-NE1 3.29Å; E63-W174 HydrophobicContact CG-CH2 4.24Å; E63-W174 HydrophobicContact CG-CZ2 3.62Å; E63-W174 PolarHBondContact OE1-NE1 3.15Å
64W98Very high97Very high10 Ų1048.1 Ų48.14%0.03824%0.235CC..Hα-helixtrans-60.5-48.6177.3-176.2-67.5000111S46 S50 Y53 I56 Q60 Y61 L62 R67 W68 W174 F175 T178S46-W64 PolarHBondContact OG-NE1 3.4Å; S50-W64 VanDerWaalsContact OG-CH2 3.29Å; S50-W64 WeakPolarHBondContact OG-CH2 3.43Å; Y53-W64 HydrophobicContact CD2-CB 4.5Å; Y53-W64 AromaticContact CD2-CD1 3.57Å; Y53-W64 AromaticContact CD2-CD2 3.73Å; Y53-W64 HydrophobicContact CD2-CD2 3.73Å; Y53-W64 AromaticContact CD2-CE2 3.68Å; Y53-W64 HydrophobicContact CD2-CE3 4.45Å; Y53-W64 AromaticContact CD2-CG 3.71Å; Y53-W64 HydrophobicContact CD2-CG 3.71Å; Y53-W64 HydrophobicContact CD2-CZ2 4.4Å; Y53-W64 AromaticContact CD2-NE1 3.52Å; Y53-W64 HydrophobicContact CE2-CB 4.18Å; Y53-W64 AromaticContact CE2-CD1 3.32Å; Y53-W64 HydrophobicContact CE2-CD2 4.19Å; Y53-W64 AromaticContact CE2-CG 3.65Å; Y53-W64 HydrophobicContact CE2-CG 3.65Å; Y53-W64 AromaticContact CE2-NE1 3.7Å; I56-W64 HydrophobicContact CD1-CB 4.18Å; I56-W64 HydrophobicContact CD1-CD2 4.33Å; I56-W64 HydrophobicContact CD1-CE3 4.01Å; I56-W64 HydrophobicContact CD1-CG 4.43Å; Q60-W64 WeakPolarHBondContact O-CB 3.31Å; Q60-W64 PolarHBondContact O-N 2.97Å; Y61-W64 PolarHBondContact O-N 3.01Å; L62-W64 VanDerWaalsContact C-N 3.3Å; L62-W64 PolarHBondContact O-N 3.41Å; W64-R67 PolarHBondContact O-N 3.48Å; W64-W68 AromaticContact CD1-CD1 3.79Å; W64-W68 AromaticContact NE1-CD1 3.52Å; W64-W68 AromaticContact NE1-NE1 3.76Å; W64-W68 PolarHBondContact O-N 3.46Å; W64-W174 HydrophobicContact CB-CH2 3.96Å; W64-W174 HydrophobicContact CB-CZ3 3.94Å; W64-W174 HydrophobicContact CD2-CZ3 4.12Å; W64-W174 HydrophobicContact CE3-CH2 4.22Å; W64-W174 AromaticContact CE3-CZ3 3.64Å; W64-W174 HydrophobicContact CE3-CZ3 3.64Å; W64-W174 HydrophobicContact CG-CZ3 4.3Å; W64-W174 HydrophobicContact CZ3-CZ3 4.43Å; W64-F175 AromaticContact CD1-CE1 3.86Å; W64-F175 AromaticContact CD2-CD1 3.75Å; W64-F175 HydrophobicContact CD2-CD1 3.75Å; W64-F175 AromaticContact CD2-CE1 3.61Å; W64-F175 HydrophobicContact CD2-CE1 3.61Å; W64-F175 AromaticContact CE2-CD1 3.73Å; W64-F175 AromaticContact CE2-CE1 3.6Å; W64-F175 AromaticContact CE3-CD1 3.88Å; W64-F175 HydrophobicContact CE3-CD1 3.88Å; W64-F175 HydrophobicContact CE3-CE1 4.18Å; W64-F175 HydrophobicContact CG-CD1 4.38Å; W64-F175 AromaticContact CG-CE1 3.77Å; W64-F175 HydrophobicContact CG-CE1 3.77Å; W64-F175 AromaticContact CH2-CD1 3.89Å; W64-F175 HydrophobicContact CH2-CD1 3.89Å; W64-F175 AromaticContact CZ2-CD1 3.82Å; W64-F175 HydrophobicContact CZ2-CD1 3.82Å; W64-F175 HydrophobicContact CZ2-CE1 4.12Å; W64-F175 AromaticContact CZ3-CD1 3.94Å; W64-F175 HydrophobicContact CZ3-CD1 3.94Å; W64-F175 AromaticContact NE1-CE1 3.77Å; W64-T178 HydrophobicContact CE3-CG2 3.79Å; W64-T178 HydrophobicContact CZ3-CG2 3.78Å
65N98.1Very high97.3Very high2 Ų245 Ų451%0.01122%0.223CC..Hα-helixtrans-68.4-39.1-179.6-66.4-23.2000112T38 S42 Y53 Y61 L62 R67 W68 L69T38-N65 HydrophobicContact CG2-CB 3.75Å; S42-N65 WeakPolarHBondContact OG-CA 3.07Å; S42-N65 PolarHBondContact OG-OD1 3.22Å; Y53-N65 VanDerWaalsContact OH-CG 3.3Å; Y53-N65 PolarHBondContact OH-ND2 3.27Å; Y53-N65 VanDerWaalsContact OH-ND2 3.11Å; Y53-N65 PolarHBondContact OH-OD1 2.89Å; Y61-N65 WeakPolarHBondContact CE1-ND2 3.08Å; Y61-N65 VanDerWaalsContact CZ-ND2 3.34Å; Y61-N65 PolarHBondContact O-N 3.45Å; L62-N65 PolarHBondContact O-N 3.16Å; N65-R67 VanDerWaalsContact C-N 3.32Å; N65-R67 PolarHBondContact O-N 3.2Å; N65-W68 VanDerWaalsContact O-CB 3.31Å; N65-W68 WeakPolarHBondContact O-CB 3.31Å; N65-W68 PolarHBondContact O-N 3.39Å; N65-L69 PolarHBondContact O-N 3Å
66A98.1Very high97.6Very high3 Ų343 Ų433%0.02520%0.202CC..Hα-helixtrans-63.8-36.9174.100000112.4L62 E63 W68 L69 S70 Y124L62-A66 PolarHBondContact O-N 3.44Å; E63-A66 PolarHBondContact O-N 2.89Å; A66-W68 VanDerWaalsContact C-N 3.33Å; A66-L69 PolarHBondContact O-N 2.77Å; A66-S70 PolarHBondContact O-N 2.96Å; A66-S70 PolarHBondContact O-OG 3.09Å; A66-Y124 HydrophobicContact CB-CE1 3.71Å; A66-Y124 VanDerWaalsContact CB-OH 3.25Å; A66-Y124 WeakPolarHBondContact CB-OH 3.29Å
67R98Very high97.7Very high48 Ų4841.8 Ų41.818%0.18120%0.195CC..Hα-helixtrans-69.3-30.8174.3-73.6-179179.4-78.11.4113.2E63 W64 N65 S70 T71 N171 W174 F175E63-R67 HydrophobicContact CG-CG 4.34Å; E63-R67 WeakPolarHBondContact O-CB 3.42Å; E63-R67 VanDerWaalsContact O-CG 3.23Å; E63-R67 WeakPolarHBondContact O-CG 3.47Å; E63-R67 PolarHBondContact O-N 2.66Å; E63-R67 IonicContact OE1-CZ 3.33Å; E63-R67 IonicContact OE1-NE 2.98Å; E63-R67 PolarHBondContact OE1-NE 3.39Å; E63-R67 IonicContact OE1-NH2 2.77Å; E63-R67 PolarHBondContact OE1-NH2 2.96Å; W64-R67 PolarHBondContact O-N 3.48Å; N65-R67 VanDerWaalsContact C-N 3.32Å; N65-R67 PolarHBondContact O-N 3.2Å; R67-S70 VanDerWaalsContact CA-OG 3.3Å; R67-S70 WeakPolarHBondContact CA-OG 3.44Å; R67-S70 PolarHBondContact O-OG 3.15Å; R67-S70 VanDerWaalsContact O-OG 3.14Å; R67-T71 WeakPolarHBondContact O-CB 3.42Å; R67-T71 PolarHBondContact O-N 3.29Å; R67-T71 VanDerWaalsContact O-N 3.12Å; R67-T71 PolarHBondContact O-OG1 2.87Å; R67-N171 HydrophobicContact CB-CB 4.38Å; R67-N171 WeakPolarHBondContact CG-OD1 3.21Å; R67-N171 PolarHBondContact NH1-OD1 3.25Å; R67-N171 PolarHBondContact O-ND2 3.08Å; R67-N171 VanDerWaalsContact O-ND2 3.1Å; R67-W174 VanDerWaalsContact CD-CE3 3.4Å; R67-W174 VanDerWaalsContact CD-CG 3.47Å; R67-W174 VanDerWaalsContact CZ-CD1 3.41Å; R67-W174 VanDerWaalsContact NE-CD2 3.3Å; R67-W174 VanDerWaalsContact NH2-CD1 3.35Å; R67-F175 HydrophobicContact CB-CE1 4.16Å; R67-F175 HydrophobicContact CB-CE2 4.22Å; R67-F175 HydrophobicContact CB-CZ 3.65Å
68W97.5Very high97.9Very high76 Ų7639.5 Ų39.529%0.28818%0.179SC..Hα-helixtrans-63.3-51.1169.5-112.893.6000110.8S42 V45 S46 W64 N65 A66 S70 T71 V72 F175S42-W68 VanDerWaalsContact OG-CB 3.3Å; S42-W68 WeakPolarHBondContact OG-CB 3.46Å; V45-W68 HydrophobicContact CB-CH2 4.29Å; V45-W68 HydrophobicContact CB-CZ2 4.26Å; V45-W68 HydrophobicContact CG1-CH2 3.64Å; V45-W68 HydrophobicContact CG1-CZ2 3.57Å; S46-W68 PolarHBondContact OG-NE1 2.87Å; W64-W68 AromaticContact CD1-CD1 3.79Å; W64-W68 AromaticContact NE1-CD1 3.52Å; W64-W68 AromaticContact NE1-NE1 3.76Å; W64-W68 PolarHBondContact O-N 3.46Å; N65-W68 VanDerWaalsContact O-CB 3.31Å; N65-W68 WeakPolarHBondContact O-CB 3.31Å; N65-W68 PolarHBondContact O-N 3.39Å; A66-W68 VanDerWaalsContact C-N 3.33Å; W68-S70 PolarHBondContact O-N 3.45Å; W68-T71 WeakPolarHBondContact O-CB 3.33Å; W68-T71 PolarHBondContact O-N 3.22Å; W68-V72 HydrophobicContact CE3-CG2 4.21Å; W68-V72 HydrophobicContact CZ3-CG2 4.44Å; W68-V72 WeakPolarHBondContact O-CG2 3.32Å; W68-V72 PolarHBondContact O-N 3Å; W68-F175 AromaticContact CD1-CZ 3.67Å; W68-F175 HydrophobicContact CG-CZ 4.33Å
69L98.5Very high98Very high3 Ų337.6 Ų37.62%0.01618%0.18CC..Hα-helixtrans-57.8-50.2178.4175.766.6000112.1I37 T38 N65 A66 T71 V72 H73 Y113 Y116I37-L69 HydrophobicContact CB-CD1 3.92Å; I37-L69 HydrophobicContact CD1-CD1 4.09Å; I37-L69 HydrophobicContact CG2-CB 4.31Å; I37-L69 HydrophobicContact CG2-CD1 3.8Å; T38-L69 WeakPolarHBondContact OG1-CD2 3.43Å; N65-L69 PolarHBondContact O-N 3Å; A66-L69 PolarHBondContact O-N 2.77Å; L69-T71 PolarHBondContact O-N 3.12Å; L69-V72 PolarHBondContact O-N 2.96Å; L69-V72 VanDerWaalsContact O-N 3.09Å; L69-H73 PolarHBondContact O-N 3.1Å; L69-Y113 HydrophobicContact CD1-CD2 4.17Å; L69-Y113 HydrophobicContact CD2-CD2 3.73Å; L69-Y113 HydrophobicContact CD2-CE2 3.79Å; L69-Y113 HydrophobicContact CG-CD2 3.72Å; L69-Y113 HydrophobicContact CG-CE2 3.68Å; L69-Y116 HydrophobicContact CD2-CD1 3.45Å; L69-Y116 VanDerWaalsContact CD2-CD1 3.45Å; L69-Y116 HydrophobicContact CD2-CE1 3.69Å
70S98.4Very high98.1Very high12 Ų1233 Ų338%0.08416%0.16CC..Hα-helixtrans-62.9-29.9178.853.80000113A66 R67 W68 S74 Y113 N171A66-S70 PolarHBondContact O-N 2.96Å; A66-S70 PolarHBondContact O-OG 3.09Å; R67-S70 VanDerWaalsContact CA-OG 3.3Å; R67-S70 WeakPolarHBondContact CA-OG 3.44Å; R67-S70 PolarHBondContact O-OG 3.15Å; R67-S70 VanDerWaalsContact O-OG 3.14Å; W68-S70 PolarHBondContact O-N 3.45Å; S70-S74 VanDerWaalsContact O-CB 3.32Å; S70-S74 WeakPolarHBondContact O-CB 3.35Å; S70-S74 PolarHBondContact O-N 2.69Å; S70-S74 PolarHBondContact O-OG 3.14Å; S70-Y113 WeakPolarHBondContact CA-OH 3.26Å; S70-Y113 WeakPolarHBondContact CB-OH 3.46Å; S70-N171 PolarHBondContact OG-ND2 2.98Å
71T98.5Very high98.2Very high30 Ų3029.8 Ų29.818%0.18415%0.145CC..Hα-helixtrans-68.3-43.4172.2-55.80000111.4R67 W68 L69 S74 I75 P168 N171R67-T71 WeakPolarHBondContact O-CB 3.42Å; R67-T71 PolarHBondContact O-N 3.29Å; R67-T71 VanDerWaalsContact O-N 3.12Å; R67-T71 PolarHBondContact O-OG1 2.87Å; W68-T71 WeakPolarHBondContact O-CB 3.33Å; W68-T71 PolarHBondContact O-N 3.22Å; L69-T71 PolarHBondContact O-N 3.12Å; T71-S74 WeakPolarHBondContact CA-OG 3.38Å; T71-S74 PolarHBondContact O-OG 2.99Å; T71-I75 HydrophobicContact CG2-CD1 4.13Å; T71-I75 VanDerWaalsContact O-CG1 3.32Å; T71-I75 WeakPolarHBondContact O-CG1 3.43Å; T71-I75 PolarHBondContact O-N 2.91Å; T71-I75 VanDerWaalsContact O-N 3.16Å; T71-P168 HydrophobicContact CG2-CB 4.32Å; T71-N171 WeakPolarHBondContact OG1-CB 3.34Å; T71-N171 PolarHBondContact OG1-ND2 3.39Å
72V98.4Very high98.2Very high57 Ų5731.7 Ų31.735%0.34516%0.155SC..Hα-helixtrans-64.3-46.1176.6174.20000111.2I37 W68 L69 I75 F76I37-V72 HydrophobicContact CD1-CG1 4.08Å; W68-V72 HydrophobicContact CE3-CG2 4.21Å; W68-V72 HydrophobicContact CZ3-CG2 4.44Å; W68-V72 WeakPolarHBondContact O-CG2 3.32Å; W68-V72 PolarHBondContact O-N 3Å; L69-V72 PolarHBondContact O-N 2.96Å; L69-V72 VanDerWaalsContact O-N 3.09Å; V72-I75 PolarHBondContact O-N 3.02Å; V72-F76 WeakPolarHBondContact O-CB 3.47Å; V72-F76 PolarHBondContact O-N 2.93Å
73H98.6Very high98.3Very high9 Ų936.3 Ų36.34%0.04217%0.171CC..Hα-helixtrans-61.1-47.7177.7166.2-88.8000112.1L69 I75 F76 I77 S110 Y113L69-H73 PolarHBondContact O-N 3.1Å; H73-I75 VanDerWaalsContact C-N 3.34Å; H73-I75 PolarHBondContact O-N 2.77Å; H73-F76 WeakPolarHBondContact O-CB 3.42Å; H73-F76 PolarHBondContact O-N 2.7Å; H73-F76 VanDerWaalsContact O-N 3.15Å; H73-I77 PolarHBondContact O-N 3.46Å; H73-S110 PolarHBondContact NE2-OG 2.85Å; H73-Y113 HydrophobicContact CB-CD1 4.05Å; H73-Y113 HydrophobicContact CB-CD2 3.83Å; H73-Y113 HydrophobicContact CB-CE1 4.1Å; H73-Y113 HydrophobicContact CB-CE2 3.91Å; H73-Y113 HydrophobicContact CB-CG 3.9Å; H73-Y113 AromaticContact CD2-CD1 3.21Å; H73-Y113 WeakPolarHBondContact CD2-CD1 3.24Å; H73-Y113 AromaticContact CD2-CE1 3.86Å; H73-Y113 AromaticContact CD2-CG 3.44Å; H73-Y113 VanDerWaalsContact CD2-CG 3.44Å; H73-Y113 AromaticContact CE1-CD1 3.58Å; H73-Y113 AromaticContact CE1-CE1 3.62Å; H73-Y113 AromaticContact CG-CD1 3.32Å; H73-Y113 AromaticContact CG-CE1 3.49Å; H73-Y113 VanDerWaalsContact CG-CE1 3.49Å; H73-Y113 AromaticContact CG-CG 3.6Å; H73-Y113 AromaticContact CG-CZ 3.94Å; H73-Y113 AromaticContact ND1-CD1 3.58Å; H73-Y113 AromaticContact ND1-CE1 3.36Å; H73-Y113 WeakPolarHBondContact ND1-CE1 3.17Å; H73-Y113 AromaticContact ND1-CZ 3.95Å; H73-Y113 AromaticContact NE2-CD1 3.36Å; H73-Y113 WeakPolarHBondContact NE2-CD1 3.46Å; H73-Y113 AromaticContact NE2-CE1 3.91Å
74S98.5Very high98.2Very high0 Ų035.2 Ų35.20%017%0.166CC..Hα-helixtrans-61.3-42.2-179.551.60000111.8S70 T71 L78 P168S70-S74 VanDerWaalsContact O-CB 3.32Å; S70-S74 WeakPolarHBondContact O-CB 3.35Å; S70-S74 PolarHBondContact O-N 2.69Å; S70-S74 PolarHBondContact O-OG 3.14Å; T71-S74 WeakPolarHBondContact CA-OG 3.38Å; T71-S74 PolarHBondContact O-OG 2.99Å; S74-L78 VanDerWaalsContact O-CB 3.23Å; S74-L78 WeakPolarHBondContact O-CB 3.39Å; S74-L78 VanDerWaalsContact O-CD1 3.23Å; S74-L78 WeakPolarHBondContact O-CD1 3.13Å; S74-L78 WeakPolarHBondContact O-CG 3.37Å; S74-L78 PolarHBondContact O-N 3.5Å; S74-P168 WeakPolarHBondContact OG-CD 3.46Å; S74-P168 WeakPolarHBondContact OG-CG 3.48Å
75I98.6Very high98.2Very high84 Ų8435.7 Ų35.743%0.43117%0.169SC..Hα-helixtrans-61.5-48.1173.8-66.5167.6000110.7T71 V72 H73 I77 L78 L79 P168T71-I75 HydrophobicContact CG2-CD1 4.13Å; T71-I75 VanDerWaalsContact O-CG1 3.32Å; T71-I75 WeakPolarHBondContact O-CG1 3.43Å; T71-I75 PolarHBondContact O-N 2.91Å; T71-I75 VanDerWaalsContact O-N 3.16Å; V72-I75 PolarHBondContact O-N 3.02Å; H73-I75 VanDerWaalsContact C-N 3.34Å; H73-I75 PolarHBondContact O-N 2.77Å; I75-I77 PolarHBondContact O-N 2.98Å; I75-L78 PolarHBondContact O-N 2.84Å; I75-L79 HydrophobicContact CG2-CD1 4.03Å; I75-L79 HydrophobicContact CG2-CG 4.44Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 3.09Å; I75-L79 PolarHBondContact O-N 3.37Å; I75-P168 HydrophobicContact CG1-CG 4.41Å
76F98.5Very high98.2Very high57 Ų5741.2 Ų41.225%0.2520%0.198CC..Hα-helixtrans-56-52.2179.2166-98000112.2V72 H73 L78 L79 I80 F105 I109V72-F76 WeakPolarHBondContact O-CB 3.47Å; V72-F76 PolarHBondContact O-N 2.93Å; H73-F76 WeakPolarHBondContact O-CB 3.42Å; H73-F76 PolarHBondContact O-N 2.7Å; H73-F76 VanDerWaalsContact O-N 3.15Å; F76-L78 PolarHBondContact O-N 2.84Å; F76-L79 PolarHBondContact O-N 3.48Å; F76-I80 HydrophobicContact CD1-CD1 4.45Å; F76-I80 HydrophobicContact CD2-CD1 4.29Å; F76-I80 HydrophobicContact CE1-CD1 3.78Å; F76-I80 HydrophobicContact CE2-CD1 3.61Å; F76-I80 HydrophobicContact CZ-CD1 3.32Å; F76-I80 PolarHBondContact O-N 2.73Å; F76-F105 AromaticContact CE2-CE1 3.9Å; F76-F105 HydrophobicContact CE2-CE1 3.9Å; F76-F105 HydrophobicContact CE2-CZ 4.45Å; F76-F105 HydrophobicContact CZ-CD1 4.35Å; F76-F105 AromaticContact CZ-CE1 3.71Å; F76-F105 HydrophobicContact CZ-CE1 3.71Å; F76-F105 HydrophobicContact CZ-CZ 4.28Å; F76-I109 HydrophobicContact CD1-CG2 4.25Å; F76-I109 HydrophobicContact CE1-CB 3.83Å; F76-I109 HydrophobicContact CE1-CG2 3.57Å; F76-I109 HydrophobicContact CZ-CB 3.98Å; F76-I109 HydrophobicContact CZ-CG1 4.22Å; F76-I109 HydrophobicContact CZ-CG2 3.86Å
77I98.4Very high98.1Very high0 Ų048 Ų480%023%0.227CC..Hα-helixtrans-72.6-31.5-175.4-159.762.8000111.7H73 I75 I80 S81 Y158 Y161 E164H73-I77 PolarHBondContact O-N 3.46Å; I75-I77 PolarHBondContact O-N 2.98Å; I77-I80 PolarHBondContact O-N 2.99Å; I77-S81 VanDerWaalsContact O-CB 3.29Å; I77-S81 WeakPolarHBondContact O-CB 3.32Å; I77-S81 PolarHBondContact O-N 3.4Å; I77-S81 PolarHBondContact O-OG 2.87Å; I77-Y158 HydrophobicContact CD1-CE1 4Å; I77-Y161 HydrophobicContact CD1-CD1 4.47Å; I77-Y161 HydrophobicContact CD1-CD2 4Å; I77-Y161 HydrophobicContact CD1-CE1 4.48Å; I77-Y161 HydrophobicContact CD1-CE2 4.02Å; I77-Y161 HydrophobicContact CD1-CG 4.24Å; I77-Y161 HydrophobicContact CG1-CD1 3.65Å; I77-Y161 HydrophobicContact CG1-CD2 3.82Å; I77-Y161 HydrophobicContact CG1-CE1 4.04Å; I77-Y161 HydrophobicContact CG1-CE2 4.2Å; I77-Y161 HydrophobicContact CG1-CG 3.54Å; I77-E164 HydrophobicContact CG2-CB 4.01Å; I77-E164 HydrophobicContact CG2-CG 3.9Å
78L98.6Very high98.1Very high12 Ų1246.5 Ų46.56%0.06322%0.223CC..Hα-helixtrans-65.1-42.6173.4-73.9166.1000111.6S74 I75 F76 I80 S81 F82 L162 E164 L165S74-L78 VanDerWaalsContact O-CB 3.23Å; S74-L78 WeakPolarHBondContact O-CB 3.39Å; S74-L78 VanDerWaalsContact O-CD1 3.23Å; S74-L78 WeakPolarHBondContact O-CD1 3.13Å; S74-L78 WeakPolarHBondContact O-CG 3.37Å; S74-L78 PolarHBondContact O-N 3.5Å; I75-L78 PolarHBondContact O-N 2.84Å; F76-L78 PolarHBondContact O-N 2.84Å; L78-I80 PolarHBondContact O-N 2.91Å; L78-S81 PolarHBondContact O-N 3.18Å; L78-F82 HydrophobicContact CB-CD2 4.41Å; L78-F82 HydrophobicContact CB-CE2 4.19Å; L78-F82 HydrophobicContact CD2-CE2 4.39Å; L78-F82 WeakPolarHBondContact O-CD2 3.29Å; L78-F82 WeakPolarHBondContact O-CG 3.3Å; L78-F82 PolarHBondContact O-N 2.88Å; L78-L162 HydrophobicContact CD2-CD2 4.37Å; L78-E164 HydrophobicContact CD2-CB 4.46Å; L78-E164 HydrophobicContact CG-CB 4.31Å; L78-L165 HydrophobicContact CD1-CB 4.36Å; L78-L165 HydrophobicContact CD1-CD1 4.17Å; L78-L165 HydrophobicContact CD2-CB 4.09Å
79L98.5Very high98Very high114 Ų11450.8 Ų50.860%0.59724%0.243SC*.Hα-helixtrans-60.1-45.3176.5-72172.9000111.5I75 F76 Y83I75-L79 HydrophobicContact CG2-CD1 4.03Å; I75-L79 HydrophobicContact CG2-CG 4.44Å; I75-L79 VanDerWaalsContact O-CG 3.31Å; I75-L79 WeakPolarHBondContact O-CG 3.09Å; I75-L79 PolarHBondContact O-N 3.37Å; F76-L79 PolarHBondContact O-N 3.48Å; L79-Y83 WeakPolarHBondContact O-CB 3.23Å; L79-Y83 PolarHBondContact O-N 3.25Å
80I98.3Very high97.9Very high14 Ų1456.5 Ų56.57%0.07227%0.268CS..Hα-helixtrans-65.6-43.4175.8-60.9-179.6000110.6F76 I77 L78 F82 Y83 C84 L102 F105 Y158F76-I80 HydrophobicContact CD1-CD1 4.45Å; F76-I80 HydrophobicContact CD2-CD1 4.29Å; F76-I80 HydrophobicContact CE1-CD1 3.78Å; F76-I80 HydrophobicContact CE2-CD1 3.61Å; F76-I80 HydrophobicContact CZ-CD1 3.32Å; F76-I80 PolarHBondContact O-N 2.73Å; I77-I80 PolarHBondContact O-N 2.99Å; L78-I80 PolarHBondContact O-N 2.91Å; I80-F82 PolarHBondContact O-N 3.17Å; I80-Y83 PolarHBondContact O-N 3.23Å; I80-Y83 VanDerWaalsContact O-N 3.16Å; I80-C84 WeakPolarHBondContact O-CB 3.41Å; I80-C84 PolarHBondContact O-N 3.23Å; I80-C84 PolarHBondContact O-SG 3.2Å; I80-L102 HydrophobicContact CD1-CD1 4.3Å; I80-L102 HydrophobicContact CG1-CD1 4.41Å; I80-L102 HydrophobicContact CG2-CD1 4.38Å; I80-L102 HydrophobicContact CG2-CG 4.13Å; I80-F105 HydrophobicContact CD1-CD1 4.42Å; I80-Y158 HydrophobicContact CB-CE1 4.05Å; I80-Y158 HydrophobicContact CG2-CD1 4.25Å; I80-Y158 HydrophobicContact CG2-CE1 3.37Å
81S98.3Very high97.8Very high0 Ų056 Ų560%026%0.264CS..Hα-helixtrans-57.7-49178.2-57.20000111.5I77 L78 Y83 C84 L85 Y158 Y161I77-S81 VanDerWaalsContact O-CB 3.29Å; I77-S81 WeakPolarHBondContact O-CB 3.32Å; I77-S81 PolarHBondContact O-N 3.4Å; I77-S81 PolarHBondContact O-OG 2.87Å; L78-S81 PolarHBondContact O-N 3.18Å; S81-Y83 VanDerWaalsContact C-N 3.32Å; S81-Y83 PolarHBondContact O-N 3.18Å; S81-C84 PolarHBondContact O-N 3.17Å; S81-L85 VanDerWaalsContact O-CB 3.27Å; S81-L85 WeakPolarHBondContact O-CB 3.37Å; S81-L85 WeakPolarHBondContact O-CD1 3.36Å; S81-L85 WeakPolarHBondContact O-CG 3.39Å; S81-L85 PolarHBondContact O-N 2.79Å; S81-Y158 WeakPolarHBondContact OG-CD1 3.43Å; S81-Y161 VanDerWaalsContact OG-CB 3.25Å; S81-Y161 WeakPolarHBondContact OG-CB 3.22Å
82F98.3Very high97.7Very high88 Ų8858 Ų5839%0.38627%0.272SS..Hα-helixtrans-62.7-40.5176.9-71.9-53.7000111.7L78 I80 L86 L162L78-F82 HydrophobicContact CB-CD2 4.41Å; L78-F82 HydrophobicContact CB-CE2 4.19Å; L78-F82 HydrophobicContact CD2-CE2 4.39Å; L78-F82 WeakPolarHBondContact O-CD2 3.29Å; L78-F82 WeakPolarHBondContact O-CG 3.3Å; L78-F82 PolarHBondContact O-N 2.88Å; I80-F82 PolarHBondContact O-N 3.17Å; F82-L86 HydrophobicContact CB-CD1 4.34Å; F82-L86 HydrophobicContact CD1-CD1 4.49Å; F82-L86 WeakPolarHBondContact O-CB 3.41Å; F82-L86 VanDerWaalsContact O-CG 3.25Å; F82-L86 WeakPolarHBondContact O-CG 3.25Å; F82-L86 PolarHBondContact O-N 3.22Å; F82-L162 HydrophobicContact CD1-CD2 4.04Å; F82-L162 HydrophobicContact CE1-CD2 3.71Å; F82-L162 HydrophobicContact CZ-CD2 4.06Å
83Y98.1Very high97.5Very high121 Ų12162.8 Ų62.848%0.47529%0.29SS..Hα-helixtrans-62-52.1176.9178.7-89.3000112.2L79 I80 S81 L85 F87 L102L79-Y83 WeakPolarHBondContact O-CB 3.23Å; L79-Y83 PolarHBondContact O-N 3.25Å; I80-Y83 PolarHBondContact O-N 3.23Å; I80-Y83 VanDerWaalsContact O-N 3.16Å; S81-Y83 VanDerWaalsContact C-N 3.32Å; S81-Y83 PolarHBondContact O-N 3.18Å; Y83-L85 VanDerWaalsContact C-N 3.33Å; Y83-L85 PolarHBondContact O-N 2.99Å; Y83-F87 HydrophobicContact CD2-CB 4.44Å; Y83-F87 AromaticContact CD2-CD2 3.9Å; Y83-F87 HydrophobicContact CD2-CD2 3.9Å; Y83-F87 HydrophobicContact CE2-CB 4.35Å; Y83-F87 HydrophobicContact CE2-CD2 4.44Å; Y83-F87 HydrophobicContact CG-CD2 4.48Å; Y83-F87 PolarHBondContact O-N 2.97Å; Y83-L102 HydrophobicContact CD1-CD2 3.29Å; Y83-L102 HydrophobicContact CE1-CD2 3.43Å; Y83-L102 VanDerWaalsContact CE1-CD2 3.43Å; Y83-L102 HydrophobicContact CG-CD2 4.2Å
84C96.9Very high97.4Very high0 Ų065.1 Ų65.10%030%0.303CS..Hα-helixtrans-59.3-43.6179.4-72.10000111.5I80 S81 N88 M91 Y158I80-C84 WeakPolarHBondContact O-CB 3.41Å; I80-C84 PolarHBondContact O-N 3.23Å; I80-C84 PolarHBondContact O-SG 3.2Å; S81-C84 PolarHBondContact O-N 3.17Å; C84-N88 WeakPolarHBondContact O-CB 3.43Å; C84-N88 PolarHBondContact O-N 3.29Å; C84-M91 HydrophobicContact CB-CE 4.14Å; C84-M91 HydrophobicContact CB-SD 3.9Å; C84-Y158 HydrophobicContact CB-CD2 4.29Å; C84-Y158 HydrophobicContact CB-CG 4.17Å
85L97.3Very high97.3Very high19 Ų1967.7 Ų67.710%0.09931%0.314CS..Hα-helixtrans-80.4-27.7-175.2-64.4171.4000114S81 Y83 H92 Y155 L159 L162S81-L85 VanDerWaalsContact O-CB 3.27Å; S81-L85 WeakPolarHBondContact O-CB 3.37Å; S81-L85 WeakPolarHBondContact O-CD1 3.36Å; S81-L85 WeakPolarHBondContact O-CG 3.39Å; S81-L85 PolarHBondContact O-N 2.79Å; Y83-L85 VanDerWaalsContact C-N 3.33Å; Y83-L85 PolarHBondContact O-N 2.99Å; L85-H92 PolarHBondContact O-CE1 3.02Å; L85-H92 PolarHBondContact O-NE2 3.24Å; L85-Y155 HydrophobicContact CD2-CD2 3.99Å; L85-Y155 HydrophobicContact CD2-CE2 3.76Å; L85-L159 HydrophobicContact CD1-CD2 3.86Å; L85-L159 HydrophobicContact CD1-CG 4.31Å; L85-L159 HydrophobicContact CD2-CD2 3.94Å; L85-L159 HydrophobicContact CD2-CG 3.8Å; L85-L162 HydrophobicContact CD1-CD1 3.71Å; L85-L162 HydrophobicContact CD1-CD2 4.17Å; L85-L162 HydrophobicContact CD1-CG 3.96Å
86L97.5Very high97.2Very high118 Ų11863.9 Ų63.962%0.61829%0.294SS*.Hα-helixtrans-96.8-32.7-177.6-61.9176.2000113.2F82F82-L86 HydrophobicContact CB-CD1 4.34Å; F82-L86 HydrophobicContact CD1-CD1 4.49Å; F82-L86 WeakPolarHBondContact O-CB 3.41Å; F82-L86 VanDerWaalsContact O-CG 3.25Å; F82-L86 WeakPolarHBondContact O-CG 3.25Å; F82-L86 PolarHBondContact O-N 3.22Å
87F97.2Very high97.1Very high146 Ų14663.4 Ų63.464%0.6429%0.292SS*.Hα-helixtrans-117.8-19.7-168.9-55.3-64.9000114.4Y83 K89Y83-F87 HydrophobicContact CD2-CB 4.44Å; Y83-F87 AromaticContact CD2-CD2 3.9Å; Y83-F87 HydrophobicContact CD2-CD2 3.9Å; Y83-F87 HydrophobicContact CE2-CB 4.35Å; Y83-F87 HydrophobicContact CE2-CD2 4.44Å; Y83-F87 HydrophobicContact CG-CD2 4.48Å; Y83-F87 PolarHBondContact O-N 2.97Å; F87-K89 PolarHBondContact O-N 3.45Å; F87-K89 VanDerWaalsContact O-N 3.09Å
88N96.3Very high97Very high16 Ų1665.8 Ų65.89%0.08630%0.302CS..  trans-85.883.6-177.9-161.5-25.3000112.1C84 K90 M91 H92 D100C84-N88 WeakPolarHBondContact O-CB 3.43Å; C84-N88 PolarHBondContact O-N 3.29Å; N88-K90 VanDerWaalsContact C-N 3.28Å; N88-K90 PolarHBondContact O-N 3.16Å; N88-M91 HydrophobicContact CB-CB 4.06Å; N88-M91 WeakPolarHBondContact O-CB 2.74Å; N88-M91 PolarHBondContact O-N 3.44Å; N88-M91 VanDerWaalsContact O-N 3.12Å; N88-M91 PolarHBondContact OD1-N 2.94Å; N88-H92 PolarHBondContact O-CD2 3.47Å; N88-D100 PolarHBondContact ND2-OD2 3.39Å
89K96.8Very high96.7Very high167 Ų16767 Ų6773%0.72631%0.311SS*.Hα-helixtrans-55.8-39.5-179.1-65.4-175.5-179.3-178.50113.4F87 M91 H92 E93F87-K89 PolarHBondContact O-N 3.45Å; F87-K89 VanDerWaalsContact O-N 3.09Å; K89-M91 PolarHBondContact O-N 2.84Å; K89-H92 WeakPolarHBondContact O-CB 3.46Å; K89-H92 PolarHBondContact O-N 3.01Å; K89-E93 PolarHBondContact O-N 3.44Å; K89-E93 VanDerWaalsContact O-N 3.08Å
90K96.8Very high96.5Very high123 Ų12363.4 Ų63.454%0.53529%0.292SS..Hα-helixtrans-61.1-35.8179.7-65.5-175.9176.9-177.10112.2N88 H92 E93 D94 Y98N88-K90 VanDerWaalsContact C-N 3.28Å; N88-K90 PolarHBondContact O-N 3.16Å; K90-H92 VanDerWaalsContact C-N 3.27Å; K90-H92 PolarHBondContact O-N 3.25Å; K90-E93 PolarHBondContact O-N 3.02Å; K90-D94 PolarHBondContact O-N 2.69Å; K90-Y98 HydrophobicContact CB-CD1 4.15Å; K90-Y98 HydrophobicContact CB-CD2 3.79Å; K90-Y98 HydrophobicContact CB-CE1 3.83Å; K90-Y98 HydrophobicContact CB-CE2 3.45Å; K90-Y98 VanDerWaalsContact CB-CE2 3.45Å; K90-Y98 HydrophobicContact CB-CG 4.13Å; K90-Y98 VanDerWaalsContact CB-CZ 3.46Å; K90-Y98 HydrophobicContact CD-CE2 3.55Å; K90-Y98 WeakPolarHBondContact CD-OH 3.43Å; K90-Y98 HydrophobicContact CG-CE2 4.15Å
91M95.7Very high96.3Very high0 Ų068.3 Ų68.30%031%0.313CS..Hα-helixtrans-69.4-22.9176.1-160.9178.9-76.100113.1C84 N88 K89 D94 K95 Y98 K154 Y155C84-M91 HydrophobicContact CB-CE 4.14Å; C84-M91 HydrophobicContact CB-SD 3.9Å; N88-M91 HydrophobicContact CB-CB 4.06Å; N88-M91 WeakPolarHBondContact O-CB 2.74Å; N88-M91 PolarHBondContact O-N 3.44Å; N88-M91 VanDerWaalsContact O-N 3.12Å; N88-M91 PolarHBondContact OD1-N 2.94Å; K89-M91 PolarHBondContact O-N 2.84Å; M91-D94 CarbonylContact O-C 3.42Å; M91-K95 WeakPolarHBondContact O-CA 3.21Å; M91-Y98 HydrophobicContact CB-CD1 3.76Å; M91-Y98 HydrophobicContact CB-CE1 4.25Å; M91-Y98 HydrophobicContact CE-CD1 4.32Å; M91-Y98 HydrophobicContact CE-CE1 4.49Å; M91-Y98 HydrophobicContact CG-CD1 4.15Å; M91-K154 HydrophobicContact CE-CB 4.34Å; M91-Y155 HydrophobicContact CG-CD2 4Å; M91-Y155 HydrophobicContact CG-CG 4.45Å; M91-Y155 WeakPolarHBondContact O-CD2 3.22Å; M91-Y155 HydrophobicContact SD-CD2 4.46Å
92H95.7Very high96.2Very high73 Ų7370.7 Ų70.734%0.33833%0.326SS..Hα-helixtrans-82.3-35.4172.7-79-92000112.9L85 N88 K89 K90 K95 Y155L85-H92 PolarHBondContact O-CE1 3.02Å; L85-H92 PolarHBondContact O-NE2 3.24Å; N88-H92 PolarHBondContact O-CD2 3.47Å; K89-H92 WeakPolarHBondContact O-CB 3.46Å; K89-H92 PolarHBondContact O-N 3.01Å; K90-H92 VanDerWaalsContact C-N 3.27Å; K90-H92 PolarHBondContact O-N 3.25Å; H92-K95 WeakPolarHBondContact O-CG 3.29Å; H92-Y155 AromaticContact CE1-CE2 3.58Å; H92-Y155 AromaticContact ND1-CE2 3.67Å; H92-Y155 AromaticContact NE2-CE2 3.94Å
93E95.6Very high96.1Very high157 Ų15766.5 Ų66.573%0.73431%0.308SS*.Hα-helixtrans-65.4-44.5176.3-71.1168.3-173.300110.9K89 K90K89-E93 PolarHBondContact O-N 3.44Å; K89-E93 VanDerWaalsContact O-N 3.08Å; K90-E93 PolarHBondContact O-N 3.02Å
94D95.5Very high96Very high59 Ų5961.2 Ų61.232%0.31629%0.288SS..SBendtrans-125.689175179.42.6000110.9K90 M91 F96 F97 Y98K90-D94 PolarHBondContact O-N 2.69Å; M91-D94 CarbonylContact O-C 3.42Å; D94-F96 PolarHBondContact O-N 3.3Å; D94-F96 PolarHBondContact OD1-N 2.89Å; D94-F97 PolarHBondContact OD1-N 2.87Å; D94-F97 WeakPolarHBondContact OD2-CB 3.49Å; D94-Y98 WeakPolarHBondContact O-CB 3.41Å; D94-Y98 PolarHBondContact O-N 3.45Å; D94-Y98 PolarHBondContact OD2-N 3.05Å
95K96.5Very high96Very high53 Ų5363.3 Ų63.323%0.2330%0.297CS..THydrogen-bonded Turntrans-70.4-17.9-175.4-55.5-171.2-173.377.70113.7M91 H92 Y155 Y156 N217M91-K95 WeakPolarHBondContact O-CA 3.21Å; H92-K95 WeakPolarHBondContact O-CG 3.29Å; K95-Y155 HydrophobicContact CB-CD1 4.01Å; K95-Y155 HydrophobicContact CB-CG 4.05Å; K95-Y155 HydrophobicContact CD-CD1 3.97Å; K95-Y155 HydrophobicContact CD-CE1 3.84Å; K95-Y155 HydrophobicContact CD-CG 4.49Å; K95-Y155 HydrophobicContact CG-CD1 4.15Å; K95-Y155 HydrophobicContact CG-CE1 4.42Å; K95-Y155 HydrophobicContact CG-CG 4.21Å; K95-Y155 VanDerWaalsContact O-CB 3.29Å; K95-Y155 WeakPolarHBondContact O-CB 3.37Å; K95-Y156 HydrophobicContact CB-CE2 3.99Å; K95-N217 PolarHBondContact NZ-OD1 3.49Å; K95-N217 VanDerWaalsContact NZ-OD1 3.17Å
96F96.4Very high96Very high4 Ų462.4 Ų62.42%0.01829%0.292CS..THydrogen-bonded Turntrans-105.3-42.4-173.3-74.4-72.7000112.9D94 I152 G153 Y156 N217 M218 H221 L230 F234D94-F96 PolarHBondContact O-N 3.3Å; D94-F96 PolarHBondContact OD1-N 2.89Å; F96-I152 CarbonylContact O-C 3.55Å; F96-I152 WeakPolarHBondContact O-CA 3.18Å; F96-I152 VanDerWaalsContact O-CB 3.31Å; F96-I152 WeakPolarHBondContact O-CB 3.49Å; F96-G153 PolarHBondContact O-N 3.39Å; F96-Y156 HydrophobicContact CD1-CD2 4.24Å; F96-Y156 AromaticContact CD1-CE2 3.85Å; F96-Y156 HydrophobicContact CD1-CE2 3.85Å; F96-Y156 HydrophobicContact CD2-CE2 4.49Å; F96-Y156 AromaticContact CE1-CD2 3.92Å; F96-Y156 HydrophobicContact CE1-CD2 3.92Å; F96-Y156 AromaticContact CE1-CE2 3.39Å; F96-Y156 HydrophobicContact CE1-CE2 3.39Å; F96-Y156 HydrophobicContact CE2-CE2 4.1Å; F96-Y156 HydrophobicContact CG-CE2 4.38Å; F96-Y156 HydrophobicContact CZ-CD2 4.45Å; F96-Y156 AromaticContact CZ-CE2 3.51Å; F96-Y156 HydrophobicContact CZ-CE2 3.51Å; F96-N217 HydrophobicContact CE2-CB 3.68Å; F96-N217 HydrophobicContact CZ-CB 4.07Å; F96-M218 HydrophobicContact CE1-CB 4.35Å; F96-M218 HydrophobicContact CE2-CB 4.25Å; F96-M218 HydrophobicContact CZ-CB 3.66Å; F96-H221 AromaticContact CD2-CD2 3.89Å; F96-L230 HydrophobicContact CB-CD1 3.91Å; F96-L230 HydrophobicContact CB-CD2 3.9Å; F96-L230 HydrophobicContact CD1-CD1 3.94Å; F96-L230 HydrophobicContact CD1-CD2 3.67Å; F96-L230 HydrophobicContact CD1-CG 4.4Å; F96-L230 HydrophobicContact CD2-CD1 3.73Å; F96-L230 HydrophobicContact CE1-CD1 4.4Å; F96-L230 HydrophobicContact CE1-CD2 4.43Å; F96-L230 HydrophobicContact CE2-CD1 4.2Å; F96-L230 HydrophobicContact CG-CD1 3.58Å; F96-L230 HydrophobicContact CG-CD2 3.9Å; F96-L230 HydrophobicContact CG-CG 4.4Å; F96-F234 AromaticContact CD1-CE2 3.79Å; F96-F234 HydrophobicContact CD1-CE2 3.79Å; F96-F234 AromaticContact CD1-CZ 3.93Å; F96-F234 HydrophobicContact CD1-CZ 3.93Å; F96-F234 HydrophobicContact CE1-CD2 4.44Å; F96-F234 HydrophobicContact CE1-CE1 4.36Å; F96-F234 AromaticContact CE1-CE2 3.83Å; F96-F234 HydrophobicContact CE1-CE2 3.83Å; F96-F234 AromaticContact CE1-CZ 3.78Å; F96-F234 HydrophobicContact CE1-CZ 3.78Å
97F96.2Very high96Very high48 Ų4856.8 Ų56.821%0.21126%0.263CS..THydrogen-bonded Turntrans-111.2-11.7-170.5-58.4-86.1000113.5D94 S99 I152 H221 Q226 F229 L230D94-F97 PolarHBondContact OD1-N 2.87Å; D94-F97 WeakPolarHBondContact OD2-CB 3.49Å; F97-S99 PolarHBondContact O-N 2.92Å; F97-I152 HydrophobicContact CD1-CG2 3.59Å; F97-I152 HydrophobicContact CE1-CG2 3.71Å; F97-H221 AromaticContact CD2-NE2 3.99Å; F97-H221 AromaticContact CE2-NE2 3.63Å; F97-Q226 HydrophobicContact CE2-CB 3.93Å; F97-Q226 HydrophobicContact CE2-CG 4.11Å; F97-Q226 HydrophobicContact CZ-CB 3.78Å; F97-Q226 HydrophobicContact CZ-CG 3.9Å; F97-F229 HydrophobicContact CE1-CD1 4.06Å; F97-F229 HydrophobicContact CE1-CE1 4.09Å; F97-F229 HydrophobicContact CZ-CD1 4.27Å; F97-L230 HydrophobicContact CE1-CD2 4.29Å; F97-L230 HydrophobicContact CE2-CD1 3.8Å; F97-L230 HydrophobicContact CE2-CD2 4.21Å; F97-L230 HydrophobicContact CE2-CG 4.13Å; F97-L230 HydrophobicContact CZ-CD1 3.96Å; F97-L230 HydrophobicContact CZ-CD2 3.77Å; F97-L230 HydrophobicContact CZ-CG 3.75Å
98Y95.6Very high96Very high50 Ų5049.9 Ų49.920%0.19623%0.232CC..  trans-70.1123.9175.8-175-98.1000111.6K90 M91 D94 D100K90-Y98 HydrophobicContact CB-CD1 4.15Å; K90-Y98 HydrophobicContact CB-CD2 3.79Å; K90-Y98 HydrophobicContact CB-CE1 3.83Å; K90-Y98 HydrophobicContact CB-CE2 3.45Å; K90-Y98 VanDerWaalsContact CB-CE2 3.45Å; K90-Y98 HydrophobicContact CB-CG 4.13Å; K90-Y98 VanDerWaalsContact CB-CZ 3.46Å; K90-Y98 HydrophobicContact CD-CE2 3.55Å; K90-Y98 WeakPolarHBondContact CD-OH 3.43Å; K90-Y98 HydrophobicContact CG-CE2 4.15Å; M91-Y98 HydrophobicContact CB-CD1 3.76Å; M91-Y98 HydrophobicContact CB-CE1 4.25Å; M91-Y98 HydrophobicContact CE-CD1 4.32Å; M91-Y98 HydrophobicContact CE-CE1 4.49Å; M91-Y98 HydrophobicContact CG-CD1 4.15Å; D94-Y98 WeakPolarHBondContact O-CB 3.41Å; D94-Y98 PolarHBondContact O-N 3.45Å; D94-Y98 PolarHBondContact OD2-N 3.05Å; Y98-D100 HydrophobicContact CE1-CB 4.21Å; Y98-D100 PolarHBondContact OH-OD2 3.42Å
99S93.3Very high96.1Very high38 Ų3850.2 Ų50.227%0.26623%0.234SC..  trans-131.9155.1167.469.90000110.5F97 E151F97-S99 PolarHBondContact O-N 2.92Å; S99-E151 WeakPolarHBondContact CB-OE2 3.47Å; S99-E151 PolarHBondContact OG-OE2 2.86Å
100D93.8Very high96.2Very high37 Ų3742.3 Ų42.320%0.19820%0.2CC..  trans-143.7171.7172.362.223.4000110.7N88 Y98 L102 S103 N104N88-D100 PolarHBondContact ND2-OD2 3.39Å; Y98-D100 HydrophobicContact CE1-CB 4.21Å; Y98-D100 PolarHBondContact OH-OD2 3.42Å; D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.63Å; D100-L102 PolarHBondContact OD1-N 3.32Å; D100-S103 PolarHBondContact N-OG 3.39Å; D100-S103 PolarHBondContact O-N 3.47Å; D100-S103 PolarHBondContact O-OG 3.43Å; D100-S103 WeakPolarHBondContact OD1-CB 3.48Å; D100-S103 PolarHBondContact OD1-N 3.11Å; D100-S103 PolarHBondContact OD1-OG 2.83Å; D100-N104 PolarHBondContact O-N 2.95Å
101F95Very high96.2Very high117 Ų11736.5 Ų36.551%0.51317%0.174SC..Hα-helixtrans-52.8-45.6-179.1174.7-93.8000112.2F22 W26 N104 F105F22-F101 HydrophobicContact CE2-CD2 4.17Å; F22-F101 AromaticContact CE2-CE2 3.96Å; F22-F101 HydrophobicContact CE2-CE2 3.96Å; F22-F101 AromaticContact CZ-CD2 3.75Å; F22-F101 HydrophobicContact CZ-CD2 3.75Å; F22-F101 AromaticContact CZ-CE2 3.74Å; F22-F101 HydrophobicContact CZ-CE2 3.74Å; W26-F101 HydrophobicContact CH2-CZ 4.36Å; W26-F101 AromaticContact CZ2-CE2 3.96Å; W26-F101 HydrophobicContact CZ2-CE2 3.96Å; W26-F101 AromaticContact CZ2-CZ 3.87Å; W26-F101 HydrophobicContact CZ2-CZ 3.87Å; F101-N104 PolarHBondContact O-N 3.46Å; F101-F105 HydrophobicContact CD1-CB 4.49Å; F101-F105 HydrophobicContact CE1-CB 4.14Å; F101-F105 HydrophobicContact CE1-CG 4.34Å; F101-F105 HydrophobicContact CZ-CB 4.27Å; F101-F105 HydrophobicContact CZ-CD2 4.38Å; F101-F105 HydrophobicContact CZ-CG 4.45Å; F101-F105 WeakPolarHBondContact O-CB 3.27Å; F101-F105 PolarHBondContact O-N 3.22Å
102L96.5Very high96.3Very high51 Ų5136.5 Ų36.527%0.26717%0.174SC..Hα-helixtrans-66.4-43.7-176.1-178.763.5000111.5I80 Y83 D100 F105 G106I80-L102 HydrophobicContact CD1-CD1 4.3Å; I80-L102 HydrophobicContact CG1-CD1 4.41Å; I80-L102 HydrophobicContact CG2-CD1 4.38Å; I80-L102 HydrophobicContact CG2-CG 4.13Å; Y83-L102 HydrophobicContact CD1-CD2 3.29Å; Y83-L102 HydrophobicContact CE1-CD2 3.43Å; Y83-L102 VanDerWaalsContact CE1-CD2 3.43Å; Y83-L102 HydrophobicContact CG-CD2 4.2Å; D100-L102 VanDerWaalsContact C-N 3.27Å; D100-L102 PolarHBondContact O-N 2.63Å; D100-L102 PolarHBondContact OD1-N 3.32Å; L102-F105 HydrophobicContact CD1-CD1 4.46Å; L102-F105 PolarHBondContact O-N 3.35Å; L102-G106 PolarHBondContact O-N 2.81Å
103S95.9Very high96.4Very high0 Ų033.4 Ų33.40%016%0.16CC..Hα-helixtrans-63.5-41.6178.768.50000112D100 M107 Y158D100-S103 PolarHBondContact N-OG 3.39Å; D100-S103 PolarHBondContact O-N 3.47Å; D100-S103 PolarHBondContact O-OG 3.43Å; D100-S103 WeakPolarHBondContact OD1-CB 3.48Å; D100-S103 PolarHBondContact OD1-N 3.11Å; D100-S103 PolarHBondContact OD1-OG 2.83Å; S103-M107 WeakPolarHBondContact O-CG 3.49Å; S103-M107 PolarHBondContact O-N 3.49Å; S103-Y158 WeakPolarHBondContact CA-OH 3.5Å; S103-Y158 WeakPolarHBondContact O-CE2 3.49Å; S103-Y158 PolarHBondContact O-OH 2.99Å
104N95.8Very high96.5Very high10 Ų1026.1 Ų26.15%0.05313%0.126CC..Hα-helixtrans-71.9-44.1177-75.8-19.4000111.6F22 Y23 D100 F101 G106 M107 C108 L148 E151 K154F22-N104 HydrophobicContact CE1-CB 4.46Å; Y23-N104 HydrophobicContact CE1-CB 4.09Å; D100-N104 PolarHBondContact O-N 2.95Å; F101-N104 PolarHBondContact O-N 3.46Å; N104-G106 PolarHBondContact O-N 3.44Å; N104-M107 PolarHBondContact O-N 3.48Å; N104-C108 WeakPolarHBondContact O-CB 3.44Å; N104-C108 PolarHBondContact O-N 3.13Å; N104-C108 PolarHBondContact O-SG 2.91Å; N104-L148 HydrophobicContact CB-CD2 4.49Å; N104-E151 PolarHBondContact ND2-OE2 2.94Å; N104-E151 PolarHBondContact OD1-OE1 3.37Å; N104-K154 WeakPolarHBondContact OD1-CE 3.35Å; N104-K154 PolarHBondContact OD1-NZ 2.97Å
105F96.4Very high96.7Very high44 Ų4426.1 Ų26.119%0.19313%0.125CC..Hα-helixtrans-56-52.2176.3168.4-103000112.1W26 F76 I80 F101 L102 M107 C108 I109W26-F105 AromaticContact CD2-CD2 3.92Å; W26-F105 HydrophobicContact CD2-CD2 3.92Å; W26-F105 HydrophobicContact CD2-CE2 4.36Å; W26-F105 AromaticContact CE3-CD2 3.6Å; W26-F105 HydrophobicContact CE3-CD2 3.6Å; W26-F105 AromaticContact CE3-CE2 3.58Å; W26-F105 HydrophobicContact CE3-CE2 3.58Å; W26-F105 HydrophobicContact CH2-CD2 4.31Å; W26-F105 HydrophobicContact CH2-CE2 4.26Å; W26-F105 AromaticContact CZ3-CD2 3.82Å; W26-F105 HydrophobicContact CZ3-CD2 3.82Å; W26-F105 AromaticContact CZ3-CE2 3.53Å; W26-F105 HydrophobicContact CZ3-CE2 3.53Å; F76-F105 AromaticContact CE2-CE1 3.9Å; F76-F105 HydrophobicContact CE2-CE1 3.9Å; F76-F105 HydrophobicContact CE2-CZ 4.45Å; F76-F105 HydrophobicContact CZ-CD1 4.35Å; F76-F105 AromaticContact CZ-CE1 3.71Å; F76-F105 HydrophobicContact CZ-CE1 3.71Å; F76-F105 HydrophobicContact CZ-CZ 4.28Å; I80-F105 HydrophobicContact CD1-CD1 4.42Å; F101-F105 HydrophobicContact CD1-CB 4.49Å; F101-F105 HydrophobicContact CE1-CB 4.14Å; F101-F105 HydrophobicContact CE1-CG 4.34Å; F101-F105 HydrophobicContact CZ-CB 4.27Å; F101-F105 HydrophobicContact CZ-CD2 4.38Å; F101-F105 HydrophobicContact CZ-CG 4.45Å; F101-F105 WeakPolarHBondContact O-CB 3.27Å; F101-F105 PolarHBondContact O-N 3.22Å; L102-F105 HydrophobicContact CD1-CD1 4.46Å; L102-F105 PolarHBondContact O-N 3.35Å; F105-M107 VanDerWaalsContact C-N 3.31Å; F105-M107 PolarHBondContact O-N 3.47Å; F105-C108 PolarHBondContact O-N 3.09Å; F105-I109 HydrophobicContact CD2-CD1 4.49Å; F105-I109 HydrophobicContact CD2-CG1 3.99Å; F105-I109 HydrophobicContact CE1-CG1 4.3Å; F105-I109 HydrophobicContact CE2-CD1 3.85Å; F105-I109 HydrophobicContact CE2-CG1 3.58Å; F105-I109 HydrophobicContact CZ-CD1 4.27Å; F105-I109 HydrophobicContact CZ-CG1 3.75Å; F105-I109 WeakPolarHBondContact O-CG1 3.48Å; F105-I109 PolarHBondContact O-N 3.25Å
106G97.5Very high96.8Very high0 Ų024.1 Ų24.10%012%0.116CC..Hα-helixtrans-59.9-41.1-179.400000112.7L102 N104 S110 Y158L102-G106 PolarHBondContact O-N 2.81Å; N104-G106 PolarHBondContact O-N 3.44Å; G106-S110 VanDerWaalsContact O-CB 3.29Å; G106-S110 WeakPolarHBondContact O-CB 3.45Å; G106-S110 PolarHBondContact O-N 2.96Å; G106-Y158 WeakPolarHBondContact CA-OH 3.04Å
107M97.3Very high96.8Very high0 Ų024.4 Ų24.40%012%0.118CC..Hα-helixtrans-66-43.1176-75-175.170.600112.7S103 N104 F105 S110 C111 C144 L147 L148 K154 A157 Y158 Y161S103-M107 WeakPolarHBondContact O-CG 3.49Å; S103-M107 PolarHBondContact O-N 3.49Å; N104-M107 PolarHBondContact O-N 3.48Å; F105-M107 VanDerWaalsContact C-N 3.31Å; F105-M107 PolarHBondContact O-N 3.47Å; M107-S110 PolarHBondContact O-N 3.42Å; M107-C111 WeakPolarHBondContact O-CB 3.24Å; M107-C111 PolarHBondContact O-N 2.97Å; M107-C144 HydrophobicContact CE-CB 4.41Å; M107-L147 HydrophobicContact CE-CB 3.72Å; M107-L147 HydrophobicContact CE-CD1 3.94Å; M107-L147 HydrophobicContact CE-CG 4.49Å; M107-L148 HydrophobicContact CB-CD1 4.43Å; M107-L148 HydrophobicContact CB-CD2 4.14Å; M107-L148 HydrophobicContact CB-CG 4.45Å; M107-L148 HydrophobicContact CE-CG 4.43Å; M107-K154 HydrophobicContact SD-CD 3.63Å; M107-A157 HydrophobicContact CE-CB 3.98Å; M107-A157 HydrophobicContact SD-CB 3.96Å; M107-Y158 HydrophobicContact CG-CE2 4.22Å; M107-Y158 PolarHBondContact N-OH 2.86Å; M107-Y158 HydrophobicContact SD-CE2 4.49Å; M107-Y161 HydrophobicContact CG-CE2 3.92Å
108C97.8Very high96.9Very high0 Ų023.4 Ų23.40%012%0.117CC..Hα-helixtrans-63-46.9177.5-72.60000112W26 I27 N104 F105 S110 C111 G112W26-C108 HydrophobicContact CB-CB 3.43Å; W26-C108 VanDerWaalsContact CB-CB 3.43Å; I27-C108 HydrophobicContact CG1-CB 3.98Å; N104-C108 WeakPolarHBondContact O-CB 3.44Å; N104-C108 PolarHBondContact O-N 3.13Å; N104-C108 PolarHBondContact O-SG 2.91Å; F105-C108 PolarHBondContact O-N 3.09Å; C108-S110 VanDerWaalsContact C-N 3.3Å; C108-S110 PolarHBondContact O-N 3.37Å; C108-C111 PolarHBondContact O-N 3.02Å; C108-G112 PolarHBondContact O-N 2.86Å
109I98.1Very high97Very high24 Ų2426 Ų2612%0.12313%0.133CC..Hα-helixtrans-60.3-43.3176.8-64.3-63000110.6W26 I29 F76 F105 C111 G112 Y113W26-I109 HydrophobicContact CE3-CD1 4.43Å; I29-I109 HydrophobicContact CB-CD1 4.49Å; I29-I109 HydrophobicContact CG2-CD1 4.05Å; F76-I109 HydrophobicContact CD1-CG2 4.25Å; F76-I109 HydrophobicContact CE1-CB 3.83Å; F76-I109 HydrophobicContact CE1-CG2 3.57Å; F76-I109 HydrophobicContact CZ-CB 3.98Å; F76-I109 HydrophobicContact CZ-CG1 4.22Å; F76-I109 HydrophobicContact CZ-CG2 3.86Å; F105-I109 HydrophobicContact CD2-CD1 4.49Å; F105-I109 HydrophobicContact CD2-CG1 3.99Å; F105-I109 HydrophobicContact CE1-CG1 4.3Å; F105-I109 HydrophobicContact CE2-CD1 3.85Å; F105-I109 HydrophobicContact CE2-CG1 3.58Å; F105-I109 HydrophobicContact CZ-CD1 4.27Å; F105-I109 HydrophobicContact CZ-CG1 3.75Å; F105-I109 WeakPolarHBondContact O-CG1 3.48Å; F105-I109 PolarHBondContact O-N 3.25Å; I109-C111 PolarHBondContact O-N 2.65Å; I109-G112 PolarHBondContact O-N 3.23Å; I109-Y113 PolarHBondContact O-N 2.97Å
110S98.1Very high97.2Very high0 Ų025.1 Ų25.10%013%0.127CC..Hα-helixtrans-60.7-42.9176.3-171.50000112.3H73 G106 M107 C108 Y113 M114 Y161H73-S110 PolarHBondContact NE2-OG 2.85Å; G106-S110 VanDerWaalsContact O-CB 3.29Å; G106-S110 WeakPolarHBondContact O-CB 3.45Å; G106-S110 PolarHBondContact O-N 2.96Å; M107-S110 PolarHBondContact O-N 3.42Å; C108-S110 VanDerWaalsContact C-N 3.3Å; C108-S110 PolarHBondContact O-N 3.37Å; S110-Y113 WeakPolarHBondContact O-CB 3.23Å; S110-Y113 PolarHBondContact O-N 3.48Å; S110-M114 VanDerWaalsContact O-CG 3.26Å; S110-M114 WeakPolarHBondContact O-CG 3.33Å; S110-M114 PolarHBondContact O-N 3.31Å; S110-Y161 WeakPolarHBondContact OG-CE1 3.45Å; S110-Y161 PolarHBondContact OG-OH 3.05Å
111C97.6Very high97.3Very high1 Ų123.4 Ų23.41%0.00712%0.117CC..Hα-helixtrans-63.5-43.9176.3-169.20000111.8I27 M107 C108 I109 Y113 M114 I115I27-C111 HydrophobicContact CD1-CB 4.45Å; I27-C111 HydrophobicContact CG1-CB 4.17Å; M107-C111 WeakPolarHBondContact O-CB 3.24Å; M107-C111 PolarHBondContact O-N 2.97Å; C108-C111 PolarHBondContact O-N 3.02Å; I109-C111 PolarHBondContact O-N 2.65Å; C111-Y113 VanDerWaalsContact C-N 3.35Å; C111-Y113 PolarHBondContact O-N 3.22Å; C111-M114 PolarHBondContact O-N 2.92Å; C111-I115 WeakPolarHBondContact O-CG1 3.32Å; C111-I115 PolarHBondContact O-N 3.48Å
112G98.1Very high97.4Very high0 Ų022.8 Ų22.80%012%0.118CC..Hα-helixtrans-59.1-42.9174.600000113.2I27 C108 I109 I115 Y116I27-G112 VanDerWaalsContact O-CA 3.32Å; I27-G112 WeakPolarHBondContact O-CA 3.4Å; C108-G112 PolarHBondContact O-N 2.86Å; I109-G112 PolarHBondContact O-N 3.23Å; G112-I115 PolarHBondContact O-N 3.35Å; G112-Y116 PolarHBondContact O-N 2.89Å; G112-Y116 VanDerWaalsContact O-N 3.09Å
113Y98.4Very high97.4Very high9 Ų925.5 Ų25.54%0.03513%0.131CC..Hα-helixtrans-59.3-49.7171.5156.6-98.7000112.1S34 L69 S70 H73 I109 S110 C111 I115 Y116 D117S34-Y113 WeakPolarHBondContact OG-CA 3.49Å; L69-Y113 HydrophobicContact CD1-CD2 4.17Å; L69-Y113 HydrophobicContact CD2-CD2 3.73Å; L69-Y113 HydrophobicContact CD2-CE2 3.79Å; L69-Y113 HydrophobicContact CG-CD2 3.72Å; L69-Y113 HydrophobicContact CG-CE2 3.68Å; S70-Y113 WeakPolarHBondContact CA-OH 3.26Å; S70-Y113 WeakPolarHBondContact CB-OH 3.46Å; H73-Y113 HydrophobicContact CB-CD1 4.05Å; H73-Y113 HydrophobicContact CB-CD2 3.83Å; H73-Y113 HydrophobicContact CB-CE1 4.1Å; H73-Y113 HydrophobicContact CB-CE2 3.91Å; H73-Y113 HydrophobicContact CB-CG 3.9Å; H73-Y113 AromaticContact CD2-CD1 3.21Å; H73-Y113 WeakPolarHBondContact CD2-CD1 3.24Å; H73-Y113 AromaticContact CD2-CE1 3.86Å; H73-Y113 AromaticContact CD2-CG 3.44Å; H73-Y113 VanDerWaalsContact CD2-CG 3.44Å; H73-Y113 AromaticContact CE1-CD1 3.58Å; H73-Y113 AromaticContact CE1-CE1 3.62Å; H73-Y113 AromaticContact CG-CD1 3.32Å; H73-Y113 AromaticContact CG-CE1 3.49Å; H73-Y113 VanDerWaalsContact CG-CE1 3.49Å; H73-Y113 AromaticContact CG-CG 3.6Å; H73-Y113 AromaticContact CG-CZ 3.94Å; H73-Y113 AromaticContact ND1-CD1 3.58Å; H73-Y113 AromaticContact ND1-CE1 3.36Å; H73-Y113 WeakPolarHBondContact ND1-CE1 3.17Å; H73-Y113 AromaticContact ND1-CZ 3.95Å; H73-Y113 AromaticContact NE2-CD1 3.36Å; H73-Y113 WeakPolarHBondContact NE2-CD1 3.46Å; H73-Y113 AromaticContact NE2-CE1 3.91Å; I109-Y113 PolarHBondContact O-N 2.97Å; S110-Y113 WeakPolarHBondContact O-CB 3.23Å; S110-Y113 PolarHBondContact O-N 3.48Å; C111-Y113 VanDerWaalsContact C-N 3.35Å; C111-Y113 PolarHBondContact O-N 3.22Å; Y113-I115 VanDerWaalsContact C-N 3.26Å; Y113-I115 PolarHBondContact O-N 3.19Å; Y113-Y116 PolarHBondContact O-N 3.35Å; Y113-Y116 VanDerWaalsContact O-N 3.13Å; Y113-D117 HydrophobicContact CE2-CB 4.06Å; Y113-D117 PolarHBondContact O-N 2.97Å
114M97.9Very high97.5Very high4 Ų426.4 Ų26.42%0.0214%0.135CC..Hα-helixtrans-60.7-37-177.4-70.9-68.917400111.9S110 C111 S118 H137 V140 I141S110-M114 VanDerWaalsContact O-CG 3.26Å; S110-M114 WeakPolarHBondContact O-CG 3.33Å; S110-M114 PolarHBondContact O-N 3.31Å; C111-M114 PolarHBondContact O-N 2.92Å; M114-S118 WeakPolarHBondContact O-CB 3.21Å; M114-S118 PolarHBondContact O-N 3.28Å; M114-S118 PolarHBondContact O-OG 3.35Å; M114-H137 PolarHBondContact O-ND1 3.04Å; M114-V140 HydrophobicContact CE-CG1 4.08Å; M114-V140 HydrophobicContact CG-CG1 4.05Å; M114-V140 HydrophobicContact SD-CG1 4.29Å; M114-I141 HydrophobicContact CB-CD1 3.99Å; M114-I141 HydrophobicContact CB-CG1 3.57Å
115I98.1Very high97.5Very high58 Ų5826.9 Ų26.930%0.29714%0.137SC..Hα-helixtrans-65.8-50174.7-65.2164.1000110.3I27 F31 C111 G112 Y113 D117 S118 L119 I141I27-I115 HydrophobicContact CG2-CD1 3.97Å; F31-I115 HydrophobicContact CD2-CB 4.29Å; F31-I115 HydrophobicContact CD2-CG2 3.94Å; F31-I115 HydrophobicContact CE2-CG2 3.99Å; C111-I115 WeakPolarHBondContact O-CG1 3.32Å; C111-I115 PolarHBondContact O-N 3.48Å; G112-I115 PolarHBondContact O-N 3.35Å; Y113-I115 VanDerWaalsContact C-N 3.26Å; Y113-I115 PolarHBondContact O-N 3.19Å; I115-D117 PolarHBondContact O-N 3.36Å; I115-S118 WeakPolarHBondContact O-CB 3.48Å; I115-S118 PolarHBondContact O-N 3.5Å; I115-L119 WeakPolarHBondContact O-CG 3.42Å; I115-L119 PolarHBondContact O-N 3.2Å; I115-I141 HydrophobicContact CG1-CD1 3.88Å; I115-I141 HydrophobicContact CG1-CG1 4.25Å; I115-I141 HydrophobicContact CG1-CG2 4.38Å
116Y98.5Very high97.5Very high11 Ų1133 Ų334%0.04316%0.164CC..Hα-helixtrans-57.7-50.4178.5179.4-91.9000111.5F31 F35 T38 E39 L69 G112 Y113 S118 L119 T120F31-Y116 HydrophobicContact CD2-CD2 4.36Å; F31-Y116 HydrophobicContact CE1-CD2 4.18Å; F31-Y116 AromaticContact CE2-CD2 3.96Å; F31-Y116 HydrophobicContact CE2-CD2 3.96Å; F31-Y116 HydrophobicContact CE2-CG 4.37Å; F31-Y116 AromaticContact CZ-CD2 3.85Å; F31-Y116 HydrophobicContact CZ-CD2 3.85Å; F35-Y116 HydrophobicContact CB-CD2 4.16Å; F35-Y116 HydrophobicContact CB-CE2 3.66Å; F35-Y116 HydrophobicContact CD2-CE2 4.08Å; F35-Y116 HydrophobicContact CG-CE2 4.39Å; T38-Y116 VanDerWaalsContact CB-OH 3.27Å; T38-Y116 WeakPolarHBondContact CB-OH 3.33Å; T38-Y116 HydrophobicContact CG2-CE1 4.07Å; T38-Y116 WeakPolarHBondContact CG2-OH 3.36Å; T38-Y116 VanDerWaalsContact OG1-CE1 3.32Å; T38-Y116 WeakPolarHBondContact OG1-CE1 3.35Å; E39-Y116 PolarHBondContact OE1-OH 3.47Å; L69-Y116 HydrophobicContact CD2-CD1 3.45Å; L69-Y116 VanDerWaalsContact CD2-CD1 3.45Å; L69-Y116 HydrophobicContact CD2-CE1 3.69Å; G112-Y116 PolarHBondContact O-N 2.89Å; G112-Y116 VanDerWaalsContact O-N 3.09Å; Y113-Y116 PolarHBondContact O-N 3.35Å; Y113-Y116 VanDerWaalsContact O-N 3.13Å; Y116-S118 VanDerWaalsContact C-N 3.25Å; Y116-S118 PolarHBondContact O-N 3.03Å; Y116-L119 PolarHBondContact O-N 2.85Å; Y116-T120 HydrophobicContact CD1-CG2 4.3Å; Y116-T120 HydrophobicContact CE1-CG2 3.74Å; Y116-T120 HydrophobicContact CE2-CG2 4.15Å; Y116-T120 PolarHBondContact O-N 3.28Å; Y116-T120 VanDerWaalsContact O-N 3.08Å; Y116-T120 PolarHBondContact O-OG1 3.29Å
117D98Very high97.5Very high11 Ų1135.1 Ų35.16%0.05919%0.185CC..Hα-helixtrans-63.8-33.2-178.5-162.151.4000111.9Y113 I115 L119 T120 M121 H137Y113-D117 HydrophobicContact CE2-CB 4.06Å; Y113-D117 PolarHBondContact O-N 2.97Å; I115-D117 PolarHBondContact O-N 3.36Å; D117-L119 VanDerWaalsContact C-N 3.33Å; D117-L119 PolarHBondContact O-N 2.91Å; D117-T120 WeakPolarHBondContact CA-OG1 3.29Å; D117-T120 PolarHBondContact O-N 3.13Å; D117-T120 PolarHBondContact O-OG1 3.27Å; D117-M121 VanDerWaalsContact O-CB 3.25Å; D117-M121 WeakPolarHBondContact O-CB 3.06Å; D117-M121 WeakPolarHBondContact O-CG 3.23Å; D117-M121 PolarHBondContact O-N 3.09Å; D117-H137 IonicContact OD2-CE1 3.04Å; D117-H137 PolarHBondContact OD2-CE1 3.44Å; D117-H137 IonicContact OD2-ND1 3.89Å; D117-H137 IonicContact OD2-NE2 3.79Å
118S97.6Very high97.4Very high26 Ų2640.6 Ų40.618%0.18221%0.214CC..Hα-helixtrans-62.3-37.9173.4-60.20000113.4M114 I115 Y116 M121 H137M114-S118 WeakPolarHBondContact O-CB 3.21Å; M114-S118 PolarHBondContact O-N 3.28Å; M114-S118 PolarHBondContact O-OG 3.35Å; I115-S118 WeakPolarHBondContact O-CB 3.48Å; I115-S118 PolarHBondContact O-N 3.5Å; Y116-S118 VanDerWaalsContact C-N 3.25Å; Y116-S118 PolarHBondContact O-N 3.03Å; S118-M121 WeakPolarHBondContact O-CG 3.23Å; S118-H137 VanDerWaalsContact OG-CB 3.22Å; S118-H137 WeakPolarHBondContact OG-CB 3.46Å; S118-H137 PolarHBondContact OG-ND1 3.48Å
119L97.4Very high97.2Very high104 Ų10443.1 Ų43.155%0.54523%0.232SC..Hα-helixtrans-75.7-34.2178.7-64.3178.5000111.9F31 I115 Y116 D117 I122F31-L119 HydrophobicContact CE2-CD1 3.89Å; F31-L119 HydrophobicContact CZ-CD1 4.12Å; I115-L119 WeakPolarHBondContact O-CG 3.42Å; I115-L119 PolarHBondContact O-N 3.2Å; Y116-L119 PolarHBondContact O-N 2.85Å; D117-L119 VanDerWaalsContact C-N 3.33Å; D117-L119 PolarHBondContact O-N 2.91Å; L119-I122 WeakPolarHBondContact O-CG1 3.3Å
120T97.2Very high97.2Very high20 Ų2043.4 Ų43.412%0.12323%0.233CC..Hα-helixtrans-82.6-31.1-178.951.20000112.8Y116 D117 I122 M123 Y124Y116-T120 HydrophobicContact CD1-CG2 4.3Å; Y116-T120 HydrophobicContact CE1-CG2 3.74Å; Y116-T120 HydrophobicContact CE2-CG2 4.15Å; Y116-T120 PolarHBondContact O-N 3.28Å; Y116-T120 VanDerWaalsContact O-N 3.08Å; Y116-T120 PolarHBondContact O-OG1 3.29Å; D117-T120 WeakPolarHBondContact CA-OG1 3.29Å; D117-T120 PolarHBondContact O-N 3.13Å; D117-T120 PolarHBondContact O-OG1 3.27Å; T120-I122 PolarHBondContact O-N 3.44Å; T120-M123 VanDerWaalsContact O-CB 3.29Å; T120-M123 WeakPolarHBondContact O-CB 3.43Å; T120-M123 WeakPolarHBondContact O-CG 3.31Å; T120-M123 PolarHBondContact O-N 3.05Å; T120-Y124 WeakPolarHBondContact O-CD1 3.42Å; T120-Y124 WeakPolarHBondContact O-CE1 3.08Å
121M96.8Very high97.1Very high1 Ų151.3 Ų51.31%0.00526%0.263CS..Hα-helixtrans-61.5-29.9-175.473.2164.591.100113.7D117 S118 M123 Y124 L125 L130 F133 V134 H137D117-M121 VanDerWaalsContact O-CB 3.25Å; D117-M121 WeakPolarHBondContact O-CB 3.06Å; D117-M121 WeakPolarHBondContact O-CG 3.23Å; D117-M121 PolarHBondContact O-N 3.09Å; S118-M121 WeakPolarHBondContact O-CG 3.23Å; M121-M123 PolarHBondContact O-N 3.48Å; M121-M123 VanDerWaalsContact O-N 3.17Å; M121-Y124 VanDerWaalsContact CA-CE1 3.48Å; M121-Y124 HydrophobicContact CB-CE1 4.35Å; M121-Y124 PolarHBondContact O-N 3.4Å; M121-L125 HydrophobicContact CB-CD1 4.06Å; M121-L125 WeakPolarHBondContact O-CB 3.41Å; M121-L125 PolarHBondContact O-N 2.65Å; M121-L125 HydrophobicContact SD-CD1 4.39Å; M121-L130 HydrophobicContact CG-CD1 3.92Å; M121-L130 HydrophobicContact SD-CD1 3.98Å; M121-F133 HydrophobicContact CE-CB 4.05Å; M121-F133 HydrophobicContact SD-CB 3.58Å; M121-F133 VanDerWaalsContact SD-CB 3.58Å; M121-V134 HydrophobicContact SD-CG2 3.94Å; M121-H137 HydrophobicContact CE-CB 4.09Å; M121-H137 VanDerWaalsContact CE-CG 3.43Å; M121-H137 WeakPolarHBondContact CE-ND1 3.33Å
122I97.1Very high97.1Very high104 Ų10451.9 Ų51.953%0.53327%0.267SS..THydrogen-bonded Turntrans-63.3-21.4177.473.1-172.5000112.3L119 T120 L130L119-I122 WeakPolarHBondContact O-CG1 3.3Å; T120-I122 PolarHBondContact O-N 3.44Å; I122-L130 HydrophobicContact CG2-CD1 4.08Å
123M96.9Very high97Very high108 Ų10855.4 Ų55.453%0.53228%0.282SS..THydrogen-bonded Turntrans-78.9-21.3-178-57.1177.460.300112.8L62 T120 M121L62-M123 HydrophobicContact CD1-CB 3.93Å; L62-M123 HydrophobicContact CD1-CE 3.97Å; L62-M123 HydrophobicContact CD2-CE 4.08Å; T120-M123 VanDerWaalsContact O-CB 3.29Å; T120-M123 WeakPolarHBondContact O-CB 3.43Å; T120-M123 WeakPolarHBondContact O-CG 3.31Å; T120-M123 PolarHBondContact O-N 3.05Å; M121-M123 PolarHBondContact O-N 3.48Å; M121-M123 VanDerWaalsContact O-N 3.17Å
124Y96.3Very high97Very high19 Ų1956.9 Ų56.98%0.07529%0.292CS..THydrogen-bonded Turntrans-130.4-18.3-177.463.1-94.7000114.8K59 L62 E63 A66 T120 M121K59-Y124 WeakPolarHBondContact CE-O 3.33Å; L62-Y124 HydrophobicContact CB-CD1 3.98Å; L62-Y124 HydrophobicContact CB-CG 4.4Å; E63-Y124 HydrophobicContact CB-CD2 3.61Å; E63-Y124 HydrophobicContact CB-CE2 4.06Å; E63-Y124 HydrophobicContact CB-CG 3.97Å; E63-Y124 HydrophobicContact CG-CD2 3.73Å; E63-Y124 HydrophobicContact CG-CE2 3.81Å; A66-Y124 HydrophobicContact CB-CE1 3.71Å; A66-Y124 VanDerWaalsContact CB-OH 3.25Å; A66-Y124 WeakPolarHBondContact CB-OH 3.29Å; T120-Y124 WeakPolarHBondContact O-CD1 3.42Å; T120-Y124 WeakPolarHBondContact O-CE1 3.08Å; M121-Y124 VanDerWaalsContact CA-CE1 3.48Å; M121-Y124 HydrophobicContact CB-CE1 4.35Å; M121-Y124 PolarHBondContact O-N 3.4Å
125L96.9Very high97Very high20 Ų2060.4 Ų60.411%0.10531%0.31CS..  trans-93.6150.5172.8-60.9-178.5000111.5M121 L130 F133M121-L125 HydrophobicContact CB-CD1 4.06Å; M121-L125 WeakPolarHBondContact O-CB 3.41Å; M121-L125 PolarHBondContact O-N 2.65Å; M121-L125 HydrophobicContact SD-CD1 4.39Å; L125-L130 HydrophobicContact CB-CB 3.84Å; L125-L130 HydrophobicContact CB-CD1 4.01Å; L125-L130 HydrophobicContact CB-CG 4.5Å; L125-F133 HydrophobicContact CD1-CB 4.32Å; L125-F133 HydrophobicContact CD1-CD2 3.98Å; L125-F133 HydrophobicContact CD1-CG 4.32Å
126K96.3Very high96.9Very high174 Ų17458.4 Ų58.476%0.75730%0.299SS*.  trans-142.5160.5173.7-65.2-168.5178.5-172.40110.8
127G96.9Very high96.9Very high44 Ų4458.2 Ų58.245%0.45430%0.299SS..Hα-helixtrans60.6-141.9173.100000113S129 L130 W131G127-S129 VanDerWaalsContact C-N 3.26Å; G127-S129 PolarHBondContact O-N 3.36Å; G127-L130 PolarHBondContact O-N 3.43Å; G127-L130 VanDerWaalsContact O-N 3.11Å; G127-W131 VanDerWaalsContact O-CD1 3.23Å; G127-W131 PolarHBondContact O-N 3.05Å
128L95.6Very high96.8Very high115 Ų11560.7 Ų60.760%0.60232%0.317SS*.Hα-helixtrans-58.9-35.9-175.2-17562.8000113.3L130 W131 T132 F250L128-L130 VanDerWaalsContact C-N 3.35Å; L128-L130 PolarHBondContact O-N 2.83Å; L128-W131 PolarHBondContact O-N 3.19Å; L128-T132 HydrophobicContact CD1-CG2 4.08Å; L128-T132 HydrophobicContact CG-CG2 4.28Å; L128-T132 WeakPolarHBondContact O-CB 3.36Å; L128-T132 WeakPolarHBondContact O-CG2 3.47Å; L128-T132 PolarHBondContact O-N 2.87Å; L128-T132 PolarHBondContact O-OG1 3.09Å; L128-F250 HydrophobicContact CD2-CE1 4.47Å; L128-F250 HydrophobicContact CD2-CZ 3.92Å
129S94.5Very high96.8Very high53 Ų5360 Ų6037%0.37131%0.312SS..Hα-helixtrans-61.9-44.7177.3-169.10000110.9G127 T132 F133G127-S129 VanDerWaalsContact C-N 3.26Å; G127-S129 PolarHBondContact O-N 3.36Å; S129-T132 PolarHBondContact O-OG1 2.96Å; S129-F133 VanDerWaalsContact O-CD2 3.3Å; S129-F133 WeakPolarHBondContact O-CD2 3.36Å; S129-F133 PolarHBondContact O-N 2.91Å
130L96.9Very high96.8Very high30 Ų3056.2 Ų56.216%0.15729%0.293CS..Hα-helixtrans-62.5-50178.8176.160.4000110.9M121 I122 L125 G127 L128 T132 F133 V134M121-L130 HydrophobicContact CG-CD1 3.92Å; M121-L130 HydrophobicContact SD-CD1 3.98Å; I122-L130 HydrophobicContact CG2-CD1 4.08Å; L125-L130 HydrophobicContact CB-CB 3.84Å; L125-L130 HydrophobicContact CB-CD1 4.01Å; L125-L130 HydrophobicContact CB-CG 4.5Å; G127-L130 PolarHBondContact O-N 3.43Å; G127-L130 VanDerWaalsContact O-N 3.11Å; L128-L130 VanDerWaalsContact C-N 3.35Å; L128-L130 PolarHBondContact O-N 2.83Å; L130-T132 VanDerWaalsContact C-N 3.33Å; L130-T132 PolarHBondContact O-N 2.96Å; L130-F133 PolarHBondContact O-N 2.74Å; L130-V134 HydrophobicContact CD1-CG2 3.77Å; L130-V134 HydrophobicContact CG-CG2 4.14Å; L130-V134 WeakPolarHBondContact O-CG2 3.36Å; L130-V134 PolarHBondContact O-N 2.74Å
131W97.3Very high96.7Very high166 Ų16657 Ų5763%0.62930%0.296SS*.Hα-helixtrans-62.3-39.8-176.2-72.7116.9000113.3G127 L128 V134 I135G127-W131 VanDerWaalsContact O-CD1 3.23Å; G127-W131 PolarHBondContact O-N 3.05Å; L128-W131 PolarHBondContact O-N 3.19Å; W131-V134 PolarHBondContact O-N 3.4Å; W131-I135 VanDerWaalsContact O-CG1 3.29Å; W131-I135 WeakPolarHBondContact O-CG1 3.48Å; W131-I135 PolarHBondContact O-N 2.85Å
132T96.9Very high96.6Very high13 Ų1364.5 Ų64.58%0.0832%0.324CS..Hα-helixtrans-63.1-42.4177.149.30000112.2L128 S129 L130 H136 L247 F250L128-T132 HydrophobicContact CD1-CG2 4.08Å; L128-T132 HydrophobicContact CG-CG2 4.28Å; L128-T132 WeakPolarHBondContact O-CB 3.36Å; L128-T132 WeakPolarHBondContact O-CG2 3.47Å; L128-T132 PolarHBondContact O-N 2.87Å; L128-T132 PolarHBondContact O-OG1 3.09Å; S129-T132 PolarHBondContact O-OG1 2.96Å; L130-T132 VanDerWaalsContact C-N 3.33Å; L130-T132 PolarHBondContact O-N 2.96Å; T132-H136 WeakPolarHBondContact O-CB 3.26Å; T132-H136 PolarHBondContact O-N 3.08Å; T132-H136 VanDerWaalsContact O-N 3.09Å; T132-L247 HydrophobicContact CG2-CD1 3.7Å; T132-L247 WeakPolarHBondContact O-CD2 3.49Å; T132-F250 HydrophobicContact CG2-CE1 4.41Å
133F96.1Very high96.5Very high73 Ų7360.1 Ų60.132%0.3230%0.304SS..Hα-helixtrans-72.2-37.9176-82.4-81000113.4M121 L125 S129 L130 I135 H136 H137M121-F133 HydrophobicContact CE-CB 4.05Å; M121-F133 HydrophobicContact SD-CB 3.58Å; M121-F133 VanDerWaalsContact SD-CB 3.58Å; L125-F133 HydrophobicContact CD1-CB 4.32Å; L125-F133 HydrophobicContact CD1-CD2 3.98Å; L125-F133 HydrophobicContact CD1-CG 4.32Å; S129-F133 VanDerWaalsContact O-CD2 3.3Å; S129-F133 WeakPolarHBondContact O-CD2 3.36Å; S129-F133 PolarHBondContact O-N 2.91Å; L130-F133 PolarHBondContact O-N 2.74Å; F133-I135 VanDerWaalsContact C-N 3.33Å; F133-I135 PolarHBondContact O-N 3.49Å; F133-H136 WeakPolarHBondContact O-CB 3.32Å; F133-H136 PolarHBondContact O-N 3.43Å; F133-H137 PolarHBondContact O-CD2 2.66Å; F133-H137 PolarHBondContact O-N 3.41Å
134V97.6Very high96.4Very high40 Ų4055.4 Ų55.424%0.24228%0.282CS..Hα-helixtrans-59.7-44.8175.1167.90000111M121 L130 W131 S138M121-V134 HydrophobicContact SD-CG2 3.94Å; L130-V134 HydrophobicContact CD1-CG2 3.77Å; L130-V134 HydrophobicContact CG-CG2 4.14Å; L130-V134 WeakPolarHBondContact O-CG2 3.36Å; L130-V134 PolarHBondContact O-N 2.74Å; W131-V134 PolarHBondContact O-N 3.4Å; V134-S138 VanDerWaalsContact O-CB 3.25Å; V134-S138 WeakPolarHBondContact O-CB 3.43Å; V134-S138 PolarHBondContact O-N 3Å; V134-S138 PolarHBondContact O-OG 2.92Å
135I97.4Very high96.1Very high78 Ų7856.5 Ų56.540%0.429%0.292SS..Hα-helixtrans-62.1-47.8175.7-68.3166.2000110.2W131 F133 H137 S138 V139 I243W131-I135 VanDerWaalsContact O-CG1 3.29Å; W131-I135 WeakPolarHBondContact O-CG1 3.48Å; W131-I135 PolarHBondContact O-N 2.85Å; F133-I135 VanDerWaalsContact C-N 3.33Å; F133-I135 PolarHBondContact O-N 3.49Å; I135-H137 PolarHBondContact O-N 2.91Å; I135-S138 PolarHBondContact O-N 3.45Å; I135-V139 HydrophobicContact CG2-CG2 4.47Å; I135-V139 WeakPolarHBondContact O-CG2 3.21Å; I135-V139 PolarHBondContact O-N 2.95Å; I135-I243 HydrophobicContact CG2-CG2 3.72Å
136H97.4Very high95.9Very high16 Ų1656.5 Ų56.57%0.07430%0.295CS..Hα-helixtrans-54.1-53.3177.9-177.477.7000111.9T132 F133 V139 V140 L244 L247 W251T132-H136 WeakPolarHBondContact O-CB 3.26Å; T132-H136 PolarHBondContact O-N 3.08Å; T132-H136 VanDerWaalsContact O-N 3.09Å; F133-H136 WeakPolarHBondContact O-CB 3.32Å; F133-H136 PolarHBondContact O-N 3.43Å; H136-V139 PolarHBondContact O-N 3.44Å; H136-V140 VanDerWaalsContact O-CG2 3.31Å; H136-V140 WeakPolarHBondContact O-CG2 3.25Å; H136-V140 PolarHBondContact O-N 3.36Å; H136-L244 WeakPolarHBondContact ND1-CD2 3.46Å; H136-L247 HydrophobicContact CB-CD2 3.81Å; H136-W251 HydrophobicContact CB-CH2 4.08Å
137H97.8Very high95.8Very high7 Ų749 Ų493%0.03226%0.263CS..Hα-helixtrans-67-41.5-176.5-75.6-132000111.4M114 D117 S118 M121 F133 I135 V139 V140 I141M114-H137 PolarHBondContact O-ND1 3.04Å; D117-H137 IonicContact OD2-CE1 3.04Å; D117-H137 PolarHBondContact OD2-CE1 3.44Å; D117-H137 IonicContact OD2-ND1 3.89Å; D117-H137 IonicContact OD2-NE2 3.79Å; S118-H137 VanDerWaalsContact OG-CB 3.22Å; S118-H137 WeakPolarHBondContact OG-CB 3.46Å; S118-H137 PolarHBondContact OG-ND1 3.48Å; M121-H137 HydrophobicContact CE-CB 4.09Å; M121-H137 VanDerWaalsContact CE-CG 3.43Å; M121-H137 WeakPolarHBondContact CE-ND1 3.33Å; F133-H137 PolarHBondContact O-CD2 2.66Å; F133-H137 PolarHBondContact O-N 3.41Å; I135-H137 PolarHBondContact O-N 2.91Å; H137-V139 VanDerWaalsContact C-N 3.32Å; H137-V139 PolarHBondContact O-N 3.13Å; H137-V140 PolarHBondContact O-N 3.32Å; H137-I141 WeakPolarHBondContact O-CB 3.39Å; H137-I141 WeakPolarHBondContact O-CD1 3.45Å; H137-I141 VanDerWaalsContact O-CG1 3.22Å; H137-I141 WeakPolarHBondContact O-CG1 3.28Å; H137-I141 PolarHBondContact O-N 3.19Å
138S97.2Very high95.6Very high63 Ų6347 Ų4744%0.44124%0.243SC..Hα-helixtrans-60.5-43.4178.9-58.80000111.6V134 I135 W142V134-S138 VanDerWaalsContact O-CB 3.25Å; V134-S138 WeakPolarHBondContact O-CB 3.43Å; V134-S138 PolarHBondContact O-N 3Å; V134-S138 PolarHBondContact O-OG 2.92Å; I135-S138 PolarHBondContact O-N 3.45Å; S138-W142 WeakPolarHBondContact O-CB 3.43Å; S138-W142 PolarHBondContact O-N 3.45Å
139V96.7Very high95.3Very high13 Ų1346.2 Ų46.28%0.07925%0.246CC..Hα-helixtrans-65.7-42.4177.2173.70000111.3I135 H136 H137 G143 L240 I243 L244I135-V139 HydrophobicContact CG2-CG2 4.47Å; I135-V139 WeakPolarHBondContact O-CG2 3.21Å; I135-V139 PolarHBondContact O-N 2.95Å; H136-V139 PolarHBondContact O-N 3.44Å; H137-V139 VanDerWaalsContact C-N 3.32Å; H137-V139 PolarHBondContact O-N 3.13Å; V139-G143 PolarHBondContact O-N 3.33Å; V139-L240 HydrophobicContact CG1-CB 3.74Å; V139-L240 HydrophobicContact CG1-CD2 4.06Å; V139-L240 HydrophobicContact CG1-CG 4.34Å; V139-L240 HydrophobicContact CG2-CD2 4.29Å; V139-I243 HydrophobicContact CG2-CB 4.49Å; V139-I243 HydrophobicContact CG2-CG2 4.02Å; V139-L244 HydrophobicContact CB-CD2 4.1Å; V139-L244 HydrophobicContact CB-CG 4.22Å; V139-L244 HydrophobicContact CG1-CD1 3.75Å; V139-L244 HydrophobicContact CG1-CD2 4.07Å; V139-L244 HydrophobicContact CG1-CG 3.63Å
140V96.5Very high95Very high23 Ų2346.7 Ų46.714%0.13925%0.245CC..Hα-helixtrans-65.3-45.6178.3174.80000111.3M114 H136 H137 W142 G143 C144M114-V140 HydrophobicContact CE-CG1 4.08Å; M114-V140 HydrophobicContact CG-CG1 4.05Å; M114-V140 HydrophobicContact SD-CG1 4.29Å; H136-V140 VanDerWaalsContact O-CG2 3.31Å; H136-V140 WeakPolarHBondContact O-CG2 3.25Å; H136-V140 PolarHBondContact O-N 3.36Å; H137-V140 PolarHBondContact O-N 3.32Å; V140-W142 PolarHBondContact O-N 3.03Å; V140-G143 PolarHBondContact O-N 3Å; V140-C144 WeakPolarHBondContact O-CB 3.48Å; V140-C144 PolarHBondContact O-N 3.48Å; V140-C144 PolarHBondContact O-SG 3.06Å
141I96.4Very high94.8Very high36 Ų3647 Ų4719%0.18525%0.245CC..Hα-helixtrans-60.7-46.8178.7-69.1163.2000110.5M114 I115 H137 S145M114-I141 HydrophobicContact CB-CD1 3.99Å; M114-I141 HydrophobicContact CB-CG1 3.57Å; I115-I141 HydrophobicContact CG1-CD1 3.88Å; I115-I141 HydrophobicContact CG1-CG1 4.25Å; I115-I141 HydrophobicContact CG1-CG2 4.38Å; H137-I141 WeakPolarHBondContact O-CB 3.39Å; H137-I141 WeakPolarHBondContact O-CD1 3.45Å; H137-I141 VanDerWaalsContact O-CG1 3.22Å; H137-I141 WeakPolarHBondContact O-CG1 3.28Å; H137-I141 PolarHBondContact O-N 3.19Å; I141-S145 VanDerWaalsContact O-CB 3.31Å; I141-S145 WeakPolarHBondContact O-CB 3.46Å; I141-S145 PolarHBondContact O-N 3.45Å; I141-S145 PolarHBondContact O-OG 2.68Å
142W95.1Very high94.6Very high160 Ų16039.1 Ų39.161%0.60622%0.215SC*.Hα-helixtrans-62.5-52.1177.7-173-11.3000110.2S138 V140 C144 S145 A146 L240S138-W142 WeakPolarHBondContact O-CB 3.43Å; S138-W142 PolarHBondContact O-N 3.45Å; V140-W142 PolarHBondContact O-N 3.03Å; W142-C144 VanDerWaalsContact C-N 3.33Å; W142-C144 PolarHBondContact O-N 3.33Å; W142-S145 PolarHBondContact O-N 2.85Å; W142-A146 WeakPolarHBondContact O-CB 3.25Å; W142-A146 PolarHBondContact O-N 3.31Å; W142-L240 HydrophobicContact CE3-CD2 4.32Å; W142-L240 HydrophobicContact CG-CD1 4.29Å
143G94.2Very high94.5Very high11 Ų1138.5 Ų38.511%0.11321%0.212CC..Hα-helixtrans-55.2-47.8179.600000112.3V139 V140 A146 L147 Y237V139-G143 PolarHBondContact O-N 3.33Å; V140-G143 PolarHBondContact O-N 3Å; G143-A146 PolarHBondContact O-N 2.79Å; G143-L147 WeakPolarHBondContact O-CG 3.2Å; G143-L147 PolarHBondContact O-N 3.29Å; G143-Y237 WeakPolarHBondContact O-CE1 3.39Å
144C93.7Very high94.5Very high9 Ų935 Ų356%0.06120%0.196CC..Hα-helixtrans-62.8-45.6178-65.80000112.3M107 V140 W142 A146 L147 L148 Y161M107-C144 HydrophobicContact CE-CB 4.41Å; V140-C144 WeakPolarHBondContact O-CB 3.48Å; V140-C144 PolarHBondContact O-N 3.48Å; V140-C144 PolarHBondContact O-SG 3.06Å; W142-C144 VanDerWaalsContact C-N 3.33Å; W142-C144 PolarHBondContact O-N 3.33Å; C144-A146 VanDerWaalsContact C-N 3.32Å; C144-A146 PolarHBondContact O-N 3.24Å; C144-L147 PolarHBondContact O-N 3Å; C144-L148 WeakPolarHBondContact O-CG 3.29Å; C144-L148 PolarHBondContact O-N 2.89Å; C144-Y161 PolarHBondContact SG-OH 3.43Å
145S91.8Very high94.5Very high42 Ų4234.5 Ų34.529%0.29419%0.19SC..Hα-helixtrans-61.2-43.6179.6-57.50000111.1I141 W142 L147 L148 S149I141-S145 VanDerWaalsContact O-CB 3.31Å; I141-S145 WeakPolarHBondContact O-CB 3.46Å; I141-S145 PolarHBondContact O-N 3.45Å; I141-S145 PolarHBondContact O-OG 2.68Å; W142-S145 PolarHBondContact O-N 2.85Å; S145-L147 PolarHBondContact O-N 3.06Å; S145-L148 PolarHBondContact O-N 3.48Å; S145-S149 WeakPolarHBondContact O-CB 3.32Å; S145-S149 PolarHBondContact O-N 3.03Å; S145-S149 PolarHBondContact O-OG 3.25Å; S145-S149 VanDerWaalsContact O-OG 3.05Å
146A91.2Very high94.5Very high20 Ų2031 Ų3117%0.16517%0.172CC..Hα-helixtrans-67.1-35178.800000112.3W142 G143 C144 N150 Y237W142-A146 WeakPolarHBondContact O-CB 3.25Å; W142-A146 PolarHBondContact O-N 3.31Å; G143-A146 PolarHBondContact O-N 2.79Å; C144-A146 VanDerWaalsContact C-N 3.32Å; C144-A146 PolarHBondContact O-N 3.24Å; A146-N150 WeakPolarHBondContact O-CB 3.41Å; A146-N150 PolarHBondContact O-N 3.27Å; A146-N150 VanDerWaalsContact O-N 3.07Å; A146-N150 PolarHBondContact O-ND2 3.18Å; A146-Y237 WeakPolarHBondContact CA-OH 3.22Å; A146-Y237 HydrophobicContact CB-CE1 4.43Å; A146-Y237 WeakPolarHBondContact CB-OH 3.41Å; A146-Y237 PolarHBondContact O-OH 2.88Å
147L93.8Very high94.4Very high16 Ų1630.8 Ų30.88%0.08417%0.173CC..Hα-helixtrans-73-31.1177.4-71175.4000111.9M107 G143 C144 S145 E151 I152 K154 A157 Y237M107-L147 HydrophobicContact CE-CB 3.72Å; M107-L147 HydrophobicContact CE-CD1 3.94Å; M107-L147 HydrophobicContact CE-CG 4.49Å; G143-L147 WeakPolarHBondContact O-CG 3.2Å; G143-L147 PolarHBondContact O-N 3.29Å; C144-L147 PolarHBondContact O-N 3Å; S145-L147 PolarHBondContact O-N 3.06Å; L147-E151 PolarHBondContact O-N 3.14Å; L147-I152 HydrophobicContact CD2-CG1 4.09Å; L147-I152 WeakPolarHBondContact CD2-O 3.16Å; L147-I152 PolarHBondContact O-N 2.65Å; L147-K154 PolarHBondContact O-NZ 3.16Å; L147-A157 HydrophobicContact CD1-CB 3.83Å; L147-Y237 WeakPolarHBondContact CA-OH 3.18Å; L147-Y237 HydrophobicContact CD1-CE1 4.15Å; L147-Y237 HydrophobicContact CD2-CD1 4.42Å; L147-Y237 HydrophobicContact CD2-CE1 3.64Å; L147-Y237 HydrophobicContact CD2-CE2 4.17Å; L147-Y237 VanDerWaalsContact CD2-CZ 3.45Å; L147-Y237 VanDerWaalsContact CD2-OH 3.3Å; L147-Y237 WeakPolarHBondContact CD2-OH 3.24Å; L147-Y237 HydrophobicContact CG-CE1 3.53Å; L147-Y237 VanDerWaalsContact CG-OH 3.31Å; L147-Y237 WeakPolarHBondContact CG-OH 3.33Å; L147-Y237 PolarHBondContact N-OH 3.18Å
148L93Very high94.4Very high4 Ų430.4 Ų30.42%0.02117%0.171CC..Hα-helixtrans-68.9-50.5170.8-71.7164.3000110.4Y23 N104 M107 C144 S145 N150 E151Y23-L148 HydrophobicContact CD1-CD2 3.92Å; Y23-L148 HydrophobicContact CD2-CB 4.41Å; Y23-L148 HydrophobicContact CE1-CD2 4.06Å; Y23-L148 HydrophobicContact CG-CB 4.49Å; Y23-L148 HydrophobicContact CG-CD2 4.43Å; N104-L148 HydrophobicContact CB-CD2 4.49Å; M107-L148 HydrophobicContact CB-CD1 4.43Å; M107-L148 HydrophobicContact CB-CD2 4.14Å; M107-L148 HydrophobicContact CB-CG 4.45Å; M107-L148 HydrophobicContact CE-CG 4.43Å; C144-L148 WeakPolarHBondContact O-CG 3.29Å; C144-L148 PolarHBondContact O-N 2.89Å; S145-L148 PolarHBondContact O-N 3.48Å; L148-N150 VanDerWaalsContact C-N 3.28Å; L148-N150 PolarHBondContact O-N 2.92Å; L148-E151 PolarHBondContact O-N 3.21Å; L148-E151 VanDerWaalsContact O-N 3.11Å; L148-E151 VanDerWaalsContact O-OE1 3.05Å
149S89.3Confident94.4Very high97 Ų9729.4 Ų29.468%0.67816%0.161SC*.Hα-helixtrans-63.7-29.3-178.4-60.70000114.5S145S145-S149 WeakPolarHBondContact O-CB 3.32Å; S145-S149 PolarHBondContact O-N 3.03Å; S145-S149 PolarHBondContact O-OG 3.25Å; S145-S149 VanDerWaalsContact O-OG 3.05Å
150N89.5Confident94.4Very high63 Ų6330.8 Ų30.834%0.33717%0.166SC..THydrogen-bonded Turntrans-94.9-5.2177.4-70.6-82.8000113.1A146 L148 I152 F229A146-N150 WeakPolarHBondContact O-CB 3.41Å; A146-N150 PolarHBondContact O-N 3.27Å; A146-N150 VanDerWaalsContact O-N 3.07Å; A146-N150 PolarHBondContact O-ND2 3.18Å; L148-N150 VanDerWaalsContact C-N 3.28Å; L148-N150 PolarHBondContact O-N 2.92Å; N150-I152 VanDerWaalsContact C-N 3.26Å; N150-I152 HydrophobicContact CB-CD1 4.05Å; N150-I152 HydrophobicContact CB-CG1 3.82Å; N150-I152 WeakPolarHBondContact O-CG2 3.27Å; N150-I152 PolarHBondContact O-N 3.37Å; N150-F229 HydrophobicContact CB-CZ 4.46Å
151E91.7Very high94.4Very high36 Ų3630.4 Ų30.417%0.16816%0.162CC..THydrogen-bonded Turntrans48.244.7-172.2-76.5-61.5107.900114.1Y23 S99 N104 L147 L148 K154Y23-E151 PolarHBondContact OH-OE1 3.02Å; Y23-E151 PolarHBondContact OH-OE2 3.25Å; S99-E151 WeakPolarHBondContact CB-OE2 3.47Å; S99-E151 PolarHBondContact OG-OE2 2.86Å; N104-E151 PolarHBondContact ND2-OE2 2.94Å; N104-E151 PolarHBondContact OD1-OE1 3.37Å; L147-E151 PolarHBondContact O-N 3.14Å; L148-E151 PolarHBondContact O-N 3.21Å; L148-E151 VanDerWaalsContact O-N 3.11Å; L148-E151 VanDerWaalsContact O-OE1 3.05Å; E151-K154 IonicContact OE1-NZ 3.78Å; E151-K154 PolarHBondContact OE1-NZ 2.79Å; E151-K154 IonicContact OE2-NZ 3.29Å
152I94.3Very high94.5Very high1 Ų130.7 Ų30.71%0.00516%0.164CC..  trans-130.516817965.6176.5000113.6F96 F97 L147 N150 K154 F229 L230 V233 F234F96-I152 CarbonylContact O-C 3.55Å; F96-I152 WeakPolarHBondContact O-CA 3.18Å; F96-I152 VanDerWaalsContact O-CB 3.31Å; F96-I152 WeakPolarHBondContact O-CB 3.49Å; F97-I152 HydrophobicContact CD1-CG2 3.59Å; F97-I152 HydrophobicContact CE1-CG2 3.71Å; L147-I152 HydrophobicContact CD2-CG1 4.09Å; L147-I152 WeakPolarHBondContact CD2-O 3.16Å; L147-I152 PolarHBondContact O-N 2.65Å; N150-I152 VanDerWaalsContact C-N 3.26Å; N150-I152 HydrophobicContact CB-CD1 4.05Å; N150-I152 HydrophobicContact CB-CG1 3.82Å; N150-I152 WeakPolarHBondContact O-CG2 3.27Å; N150-I152 PolarHBondContact O-N 3.37Å; I152-K154 VanDerWaalsContact C-N 3.27Å; I152-K154 PolarHBondContact O-N 3.32Å; I152-F229 HydrophobicContact CD1-CE1 4.11Å; I152-F229 HydrophobicContact CG2-CE1 4.02Å; I152-L230 HydrophobicContact CD1-CD2 4.25Å; I152-V233 HydrophobicContact CD1-CB 4.16Å; I152-V233 HydrophobicContact CD1-CG1 3.56Å; I152-F234 HydrophobicContact CD1-CD2 4.48Å; I152-F234 HydrophobicContact CD1-CE2 4.01Å
153G95Very high94.6Very high0 Ų024 Ų240%014%0.141CC..  trans68.618.1162.700000114.9F96 Y155 Y156 A157F96-G153 PolarHBondContact O-N 3.39Å; G153-Y155 VanDerWaalsContact C-N 3.3Å; G153-Y155 PolarHBondContact O-N 3.35Å; G153-Y156 PolarHBondContact O-N 3.3Å; G153-Y156 VanDerWaalsContact O-N 3.13Å; G153-A157 PolarHBondContact O-N 2.92Å
154K95.6Very high94.8Very high0 Ų024.1 Ų24.10%014%0.138CC..Hα-helixtrans-58.5-42.2-177.2-47.3-58.5-179.5175.60111.3M91 N104 M107 L147 E151 I152 Y156 A157 Y158M91-K154 HydrophobicContact CE-CB 4.34Å; N104-K154 WeakPolarHBondContact OD1-CE 3.35Å; N104-K154 PolarHBondContact OD1-NZ 2.97Å; M107-K154 HydrophobicContact SD-CD 3.63Å; L147-K154 PolarHBondContact O-NZ 3.16Å; E151-K154 IonicContact OE1-NZ 3.78Å; E151-K154 PolarHBondContact OE1-NZ 2.79Å; E151-K154 IonicContact OE2-NZ 3.29Å; I152-K154 VanDerWaalsContact C-N 3.27Å; I152-K154 PolarHBondContact O-N 3.32Å; K154-Y156 VanDerWaalsContact C-N 3.34Å; K154-Y156 PolarHBondContact O-N 3.35Å; K154-A157 WeakPolarHBondContact O-CB 3.37Å; K154-A157 PolarHBondContact O-N 2.91Å; K154-Y158 WeakPolarHBondContact O-CD2 3.19Å; K154-Y158 PolarHBondContact O-N 3.14Å
155Y97.3Very high95Very high29 Ų2926.3 Ų26.311%0.11415%0.149CC..Hα-helixtrans-53.1-49.8175-178.9-96.2000112.2L85 M91 H92 K95 G153 Y158 L159L85-Y155 HydrophobicContact CD2-CD2 3.99Å; L85-Y155 HydrophobicContact CD2-CE2 3.76Å; M91-Y155 HydrophobicContact CG-CD2 4Å; M91-Y155 HydrophobicContact CG-CG 4.45Å; M91-Y155 WeakPolarHBondContact O-CD2 3.22Å; M91-Y155 HydrophobicContact SD-CD2 4.46Å; H92-Y155 AromaticContact CE1-CE2 3.58Å; H92-Y155 AromaticContact ND1-CE2 3.67Å; H92-Y155 AromaticContact NE2-CE2 3.94Å; K95-Y155 HydrophobicContact CB-CD1 4.01Å; K95-Y155 HydrophobicContact CB-CG 4.05Å; K95-Y155 HydrophobicContact CD-CD1 3.97Å; K95-Y155 HydrophobicContact CD-CE1 3.84Å; K95-Y155 HydrophobicContact CD-CG 4.49Å; K95-Y155 HydrophobicContact CG-CD1 4.15Å; K95-Y155 HydrophobicContact CG-CE1 4.42Å; K95-Y155 HydrophobicContact CG-CG 4.21Å; K95-Y155 VanDerWaalsContact O-CB 3.29Å; K95-Y155 WeakPolarHBondContact O-CB 3.37Å; G153-Y155 VanDerWaalsContact C-N 3.3Å; G153-Y155 PolarHBondContact O-N 3.35Å; Y155-Y158 PolarHBondContact O-N 2.96Å; Y155-L159 HydrophobicContact CD1-CD1 3.9Å; Y155-L159 HydrophobicContact CE1-CD1 3.33Å; Y155-L159 HydrophobicContact CE1-CG 4.11Å; Y155-L159 PolarHBondContact O-N 3.17Å
156Y96.5Very high95.3Very high5 Ų524.4 Ų24.42%0.0214%0.136CC..Hα-helixtrans-72.7-32.3-179.5-62.7-70.5000112.8K95 F96 G153 K154 Y158 L159 K160 F210 V214 N217 F234K95-Y156 HydrophobicContact CB-CE2 3.99Å; F96-Y156 HydrophobicContact CD1-CD2 4.24Å; F96-Y156 AromaticContact CD1-CE2 3.85Å; F96-Y156 HydrophobicContact CD1-CE2 3.85Å; F96-Y156 HydrophobicContact CD2-CE2 4.49Å; F96-Y156 AromaticContact CE1-CD2 3.92Å; F96-Y156 HydrophobicContact CE1-CD2 3.92Å; F96-Y156 AromaticContact CE1-CE2 3.39Å; F96-Y156 HydrophobicContact CE1-CE2 3.39Å; F96-Y156 HydrophobicContact CE2-CE2 4.1Å; F96-Y156 HydrophobicContact CG-CE2 4.38Å; F96-Y156 HydrophobicContact CZ-CD2 4.45Å; F96-Y156 AromaticContact CZ-CE2 3.51Å; F96-Y156 HydrophobicContact CZ-CE2 3.51Å; G153-Y156 PolarHBondContact O-N 3.3Å; G153-Y156 VanDerWaalsContact O-N 3.13Å; K154-Y156 VanDerWaalsContact C-N 3.34Å; K154-Y156 PolarHBondContact O-N 3.35Å; Y156-Y158 VanDerWaalsContact C-N 3.34Å; Y156-L159 HydrophobicContact CD1-CD1 4.06Å; Y156-L159 HydrophobicContact CE1-CD1 4.48Å; Y156-L159 PolarHBondContact O-N 3.42Å; Y156-K160 PolarHBondContact O-N 2.95Å; Y156-F210 HydrophobicContact CD1-CE2 4.33Å; Y156-F210 WeakPolarHBondContact O-CE2 3.39Å; Y156-V214 HydrophobicContact CD1-CB 4.46Å; Y156-V214 HydrophobicContact CD1-CG2 3.34Å; Y156-V214 HydrophobicContact CD2-CG2 4.43Å; Y156-V214 HydrophobicContact CE1-CB 4.36Å; Y156-V214 HydrophobicContact CE1-CG2 3.65Å; Y156-V214 HydrophobicContact CG-CG2 3.77Å; Y156-N217 WeakPolarHBondContact OH-CB 3.35Å; Y156-N217 PolarHBondContact OH-ND2 3.41Å; Y156-F234 HydrophobicContact CD2-CZ 4.48Å
157A96.5Very high95.6Very high11 Ų1124.3 Ų24.39%0.09113%0.133CC..Hα-helixtrans-58.8-48.4171.400000110.7M107 L147 G153 K154 L159 K160 Y161M107-A157 HydrophobicContact CE-CB 3.98Å; M107-A157 HydrophobicContact SD-CB 3.96Å; L147-A157 HydrophobicContact CD1-CB 3.83Å; G153-A157 PolarHBondContact O-N 2.92Å; K154-A157 WeakPolarHBondContact O-CB 3.37Å; K154-A157 PolarHBondContact O-N 2.91Å; A157-L159 PolarHBondContact O-N 2.87Å; A157-K160 CarbonylContact O-C 3.34Å; A157-K160 PolarHBondContact O-N 3.48Å; A157-Y161 HydrophobicContact CB-CE2 4.38Å; A157-Y161 VanDerWaalsContact O-CD2 3.23Å; A157-Y161 WeakPolarHBondContact O-CD2 3.45Å; A157-Y161 PolarHBondContact O-N 3.12Å
158Y97.6Very high95.8Very high0 Ų024.8 Ų24.80%014%0.137CC..Hα-helixtrans-68.5-31.8178.2-78-69.2000113.5I77 I80 S81 C84 S103 G106 M107 K154 Y155 Y156 Y161 L162I77-Y158 HydrophobicContact CD1-CE1 4Å; I80-Y158 HydrophobicContact CB-CE1 4.05Å; I80-Y158 HydrophobicContact CG2-CD1 4.25Å; I80-Y158 HydrophobicContact CG2-CE1 3.37Å; S81-Y158 WeakPolarHBondContact OG-CD1 3.43Å; C84-Y158 HydrophobicContact CB-CD2 4.29Å; C84-Y158 HydrophobicContact CB-CG 4.17Å; S103-Y158 WeakPolarHBondContact CA-OH 3.5Å; S103-Y158 WeakPolarHBondContact O-CE2 3.49Å; S103-Y158 PolarHBondContact O-OH 2.99Å; G106-Y158 WeakPolarHBondContact CA-OH 3.04Å; M107-Y158 HydrophobicContact CG-CE2 4.22Å; M107-Y158 PolarHBondContact N-OH 2.86Å; M107-Y158 HydrophobicContact SD-CE2 4.49Å; K154-Y158 WeakPolarHBondContact O-CD2 3.19Å; K154-Y158 PolarHBondContact O-N 3.14Å; Y155-Y158 PolarHBondContact O-N 2.96Å; Y156-Y158 VanDerWaalsContact C-N 3.34Å; Y158-Y161 AromaticContact CD1-CD2 3.84Å; Y158-Y161 HydrophobicContact CD1-CD2 3.84Å; Y158-Y161 HydrophobicContact CE1-CD2 4.07Å; Y158-Y161 HydrophobicContact CE1-CE2 4.44Å; Y158-Y161 HydrophobicContact CG-CD2 4.38Å; Y158-Y161 PolarHBondContact O-N 3.47Å; Y158-L162 PolarHBondContact O-N 3.34Å
159L96.9Very high96.1Very high41 Ų4127 Ų2722%0.21515%0.147CC..Hα-helixtrans-61.3-43166-81175.6000112.1L85 Y155 Y156 A157 L162 F210L85-L159 HydrophobicContact CD1-CD2 3.86Å; L85-L159 HydrophobicContact CD1-CG 4.31Å; L85-L159 HydrophobicContact CD2-CD2 3.94Å; L85-L159 HydrophobicContact CD2-CG 3.8Å; Y155-L159 HydrophobicContact CD1-CD1 3.9Å; Y155-L159 HydrophobicContact CE1-CD1 3.33Å; Y155-L159 HydrophobicContact CE1-CG 4.11Å; Y155-L159 PolarHBondContact O-N 3.17Å; Y156-L159 HydrophobicContact CD1-CD1 4.06Å; Y156-L159 HydrophobicContact CE1-CD1 4.48Å; Y156-L159 PolarHBondContact O-N 3.42Å; A157-L159 PolarHBondContact O-N 2.87Å; L159-L162 HydrophobicContact CD2-CD1 4.33Å; L159-L162 WeakPolarHBondContact O-CB 3.25Å; L159-L162 PolarHBondContact O-N 2.85Å; L159-F210 HydrophobicContact CB-CD2 4.16Å; L159-F210 HydrophobicContact CB-CE2 4.07Å
160K96.1Very high96.5Very high43 Ų4324.3 Ų24.319%0.18712%0.124CC..Hα-helixtrans-70-33179.5-160.168.7162.9-176.90111.7Y156 A157 L162 T163 F210 D245Y156-K160 PolarHBondContact O-N 2.95Å; A157-K160 CarbonylContact O-C 3.34Å; A157-K160 PolarHBondContact O-N 3.48Å; K160-L162 PolarHBondContact O-N 3.44Å; K160-T163 WeakPolarHBondContact O-CB 3.33Å; K160-T163 VanDerWaalsContact O-CG2 3.27Å; K160-T163 WeakPolarHBondContact O-CG2 3.23Å; K160-T163 PolarHBondContact O-N 3.45Å; K160-T163 PolarHBondContact O-OG1 3.23Å; K160-F210 HydrophobicContact CB-CE2 4.27Å; K160-F210 HydrophobicContact CB-CZ 4.37Å; K160-F210 HydrophobicContact CD-CE1 4.24Å; K160-F210 HydrophobicContact CD-CE2 4.38Å; K160-F210 HydrophobicContact CD-CZ 4.14Å; K160-D245 IonicContact NZ-OD1 3.79Å; K160-D245 PolarHBondContact NZ-OD1 3.35Å
161Y97.4Very high96.9Very high15 Ų1521.5 Ų21.56%0.05911%0.109CC..Hα-helixtrans-64.2-19.2174.9-76.9-51.2000114.1I77 S81 M107 S110 C144 A157 Y158 T163 E164I77-Y161 HydrophobicContact CD1-CD1 4.47Å; I77-Y161 HydrophobicContact CD1-CD2 4Å; I77-Y161 HydrophobicContact CD1-CE1 4.48Å; I77-Y161 HydrophobicContact CD1-CE2 4.02Å; I77-Y161 HydrophobicContact CD1-CG 4.24Å; I77-Y161 HydrophobicContact CG1-CD1 3.65Å; I77-Y161 HydrophobicContact CG1-CD2 3.82Å; I77-Y161 HydrophobicContact CG1-CE1 4.04Å; I77-Y161 HydrophobicContact CG1-CE2 4.2Å; I77-Y161 HydrophobicContact CG1-CG 3.54Å; S81-Y161 VanDerWaalsContact OG-CB 3.25Å; S81-Y161 WeakPolarHBondContact OG-CB 3.22Å; M107-Y161 HydrophobicContact CG-CE2 3.92Å; S110-Y161 WeakPolarHBondContact OG-CE1 3.45Å; S110-Y161 PolarHBondContact OG-OH 3.05Å; C144-Y161 PolarHBondContact SG-OH 3.43Å; A157-Y161 HydrophobicContact CB-CE2 4.38Å; A157-Y161 VanDerWaalsContact O-CD2 3.23Å; A157-Y161 WeakPolarHBondContact O-CD2 3.45Å; A157-Y161 PolarHBondContact O-N 3.12Å; Y158-Y161 AromaticContact CD1-CD2 3.84Å; Y158-Y161 HydrophobicContact CD1-CD2 3.84Å; Y158-Y161 HydrophobicContact CE1-CD2 4.07Å; Y158-Y161 HydrophobicContact CE1-CE2 4.44Å; Y158-Y161 HydrophobicContact CG-CD2 4.38Å; Y158-Y161 PolarHBondContact O-N 3.47Å; Y161-T163 PolarHBondContact O-N 3.39Å; Y161-E164 WeakPolarHBondContact O-CB 3.49Å; Y161-E164 PolarHBondContact O-N 3.37Å
162L97.8Very high97.2Very high42 Ų4223.6 Ų23.622%0.2212%0.121CC..G310 helixtrans-59.3-18.4170.1-62.8-179.8000113.1L78 F82 L85 Y158 L159 K160 E164 L165L78-L162 HydrophobicContact CD2-CD2 4.37Å; F82-L162 HydrophobicContact CD1-CD2 4.04Å; F82-L162 HydrophobicContact CE1-CD2 3.71Å; F82-L162 HydrophobicContact CZ-CD2 4.06Å; L85-L162 HydrophobicContact CD1-CD1 3.71Å; L85-L162 HydrophobicContact CD1-CD2 4.17Å; L85-L162 HydrophobicContact CD1-CG 3.96Å; Y158-L162 PolarHBondContact O-N 3.34Å; L159-L162 HydrophobicContact CD2-CD1 4.33Å; L159-L162 WeakPolarHBondContact O-CB 3.25Å; L159-L162 PolarHBondContact O-N 2.85Å; K160-L162 PolarHBondContact O-N 3.44Å; L162-E164 PolarHBondContact O-N 3.29Å; L162-L165 VanDerWaalsContact O-CB 3.24Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.11Å; L162-L165 VanDerWaalsContact O-N 3.13Å
163T97.2Very high97.4Very high20 Ų2026 Ų2612%0.12313%0.13CC..G310 helixtrans-67.6-12.8173.9640000114.1K160 Y161 L165 S166 R203K160-T163 WeakPolarHBondContact O-CB 3.33Å; K160-T163 VanDerWaalsContact O-CG2 3.27Å; K160-T163 WeakPolarHBondContact O-CG2 3.23Å; K160-T163 PolarHBondContact O-N 3.45Å; K160-T163 PolarHBondContact O-OG1 3.23Å; Y161-T163 PolarHBondContact O-N 3.39Å; T163-L165 PolarHBondContact O-N 3.26Å; T163-S166 PolarHBondContact O-OG 2.88Å; T163-R203 HydrophobicContact CG2-CG 3.74Å; T163-R203 PolarHBondContact O-NE 3.21Å; T163-R203 PolarHBondContact O-NH2 3.43Å
164E97.9Very high97.6Very high13 Ų1327.5 Ų27.56%0.06114%0.136CC..G310 helixtrans-73.4-8.4171.2-69.3-54.8133.900113.1I77 L78 Y161 L162 S166 T167 P168 R203I77-E164 HydrophobicContact CG2-CB 4.01Å; I77-E164 HydrophobicContact CG2-CG 3.9Å; L78-E164 HydrophobicContact CD2-CB 4.46Å; L78-E164 HydrophobicContact CG-CB 4.31Å; Y161-E164 WeakPolarHBondContact O-CB 3.49Å; Y161-E164 PolarHBondContact O-N 3.37Å; L162-E164 PolarHBondContact O-N 3.29Å; E164-S166 PolarHBondContact O-N 3.43Å; E164-S166 VanDerWaalsContact O-N 3.09Å; E164-T167 VanDerWaalsContact O-CB 3.31Å; E164-T167 WeakPolarHBondContact O-CB 3.47Å; E164-T167 PolarHBondContact O-N 3.21Å; E164-T167 PolarHBondContact O-OG1 3.36Å; E164-T167 WeakPolarHBondContact OE2-CB 3.39Å; E164-T167 PolarHBondContact OE2-OG1 3.47Å; E164-P168 WeakPolarHBondContact O-CD 3.3Å; E164-R203 IonicContact OE1-NH2 2.91Å
165L98.1Very high97.6Very high55 Ų5529 Ų2929%0.28814%0.142SC..G310 helixtrans-57-29.1177.2-176.460.8000112.9L78 L162 T163 F169 T198 T202L78-L165 HydrophobicContact CD1-CB 4.36Å; L78-L165 HydrophobicContact CD1-CD1 4.17Å; L78-L165 HydrophobicContact CD2-CB 4.09Å; L162-L165 VanDerWaalsContact O-CB 3.24Å; L162-L165 WeakPolarHBondContact O-CB 3.4Å; L162-L165 PolarHBondContact O-N 3.11Å; L162-L165 VanDerWaalsContact O-N 3.13Å; T163-L165 PolarHBondContact O-N 3.26Å; L165-F169 VanDerWaalsContact O-CD2 3.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.38Å; L165-F169 VanDerWaalsContact O-CE2 3.23Å; L165-F169 WeakPolarHBondContact O-CE2 3.41Å; L165-T198 HydrophobicContact CD2-CG2 4.08Å; L165-T198 HydrophobicContact CG-CG2 4.04Å; L165-T202 HydrophobicContact CB-CG2 4.41Å; L165-T202 HydrophobicContact CD2-CG2 4.31Å
166S98.2Very high97.6Very high2 Ų228.8 Ų28.81%0.01414%0.143CC..G310 helixtrans-77-20.9178.565.30000114.1T163 E164 F169 I170 F195 T198T163-S166 PolarHBondContact O-OG 2.88Å; E164-S166 PolarHBondContact O-N 3.43Å; E164-S166 VanDerWaalsContact O-N 3.09Å; S166-F169 PolarHBondContact O-N 3.49Å; S166-I170 PolarHBondContact O-N 3.12Å; S166-F195 WeakPolarHBondContact O-CD2 3.41Å; S166-T198 WeakPolarHBondContact CA-OG1 3.43Å; S166-T198 WeakPolarHBondContact CB-OG1 3.43Å
167T98.4Very high97.6Very high17 Ų1733.5 Ų33.510%0.10416%0.161CC..Hα-helixtrans-65.1-47-170.3-58.40000113.5E164 F169 I170 N171E164-T167 VanDerWaalsContact O-CB 3.31Å; E164-T167 WeakPolarHBondContact O-CB 3.47Å; E164-T167 PolarHBondContact O-N 3.21Å; E164-T167 PolarHBondContact O-OG1 3.36Å; E164-T167 WeakPolarHBondContact OE2-CB 3.39Å; E164-T167 PolarHBondContact OE2-OG1 3.47Å; T167-F169 PolarHBondContact O-N 3.3Å; T167-I170 WeakPolarHBondContact O-CG2 3.44Å; T167-I170 PolarHBondContact O-N 3.01Å; T167-N171 PolarHBondContact O-N 3.34Å; T167-N171 VanDerWaalsContact O-N 3.15Å; T167-N171 PolarHBondContact O-ND2 2.69Å
168P98.5Very high97.6Very high26 Ų2634 Ų3417%0.16916%0.162CC..Hα-helixtrans-57.7-35.4176.3-25.735000113.1T71 S74 I75 E164 L172T71-P168 HydrophobicContact CG2-CB 4.32Å; S74-P168 WeakPolarHBondContact OG-CD 3.46Å; S74-P168 WeakPolarHBondContact OG-CG 3.48Å; I75-P168 HydrophobicContact CG1-CG 4.41Å; E164-P168 WeakPolarHBondContact O-CD 3.3Å; P168-L172 WeakPolarHBondContact O-CB 3.22Å; P168-L172 PolarHBondContact O-N 2.94Å
169F98.5Very high97.5Very high52 Ų5236 Ų3623%0.22818%0.177CC..Hα-helixtrans-76.5-38.1-175.8-57.1-60.2000113L165 S166 T167 N171 L172 R173 L194 F195 T198L165-F169 VanDerWaalsContact O-CD2 3.24Å; L165-F169 WeakPolarHBondContact O-CD2 3.38Å; L165-F169 VanDerWaalsContact O-CE2 3.23Å; L165-F169 WeakPolarHBondContact O-CE2 3.41Å; S166-F169 PolarHBondContact O-N 3.49Å; T167-F169 PolarHBondContact O-N 3.3Å; F169-N171 VanDerWaalsContact C-N 3.3Å; F169-L172 PolarHBondContact O-N 2.93Å; F169-R173 WeakPolarHBondContact O-CB 3.34Å; F169-R173 PolarHBondContact O-N 3.47Å; F169-L194 HydrophobicContact CB-CB 4.22Å; F169-L194 HydrophobicContact CD1-CB 3.7Å; F169-L194 HydrophobicContact CD1-CD1 3.92Å; F169-L194 HydrophobicContact CD1-CG 4.44Å; F169-L194 HydrophobicContact CD2-CB 4.28Å; F169-L194 HydrophobicContact CE1-CB 4.11Å; F169-L194 HydrophobicContact CE1-CD1 3.86Å; F169-L194 HydrophobicContact CG-CB 3.8Å; F169-F195 HydrophobicContact CB-CB 3.7Å; F169-T198 HydrophobicContact CD2-CG2 4.14Å; F169-T198 HydrophobicContact CE2-CG2 3.87Å
170I98Very high97.3Very high39 Ų3937.2 Ų37.220%0.220%0.198CC..Hα-helixtrans-67.6-35.7173.6-174.254.8000111.4S166 T167 R173 W174 F195S166-I170 PolarHBondContact O-N 3.12Å; T167-I170 WeakPolarHBondContact O-CG2 3.44Å; T167-I170 PolarHBondContact O-N 3.01Å; I170-R173 PolarHBondContact O-N 2.94Å; I170-W174 PolarHBondContact O-N 3.34Å; I170-F195 HydrophobicContact CB-CD1 4.24Å; I170-F195 HydrophobicContact CB-CD2 3.55Å; I170-F195 HydrophobicContact CB-CE1 4.32Å; I170-F195 HydrophobicContact CB-CE2 3.65Å; I170-F195 HydrophobicContact CB-CG 3.84Å; I170-F195 HydrophobicContact CB-CZ 4.03Å; I170-F195 HydrophobicContact CD1-CD1 3.82Å; I170-F195 HydrophobicContact CD1-CE1 3.68Å; I170-F195 HydrophobicContact CD1-CG 4.28Å; I170-F195 HydrophobicContact CD1-CZ 4.05Å; I170-F195 HydrophobicContact CG1-CD1 4.45Å; I170-F195 HydrophobicContact CG1-CD2 4.42Å; I170-F195 HydrophobicContact CG1-CE1 4.2Å; I170-F195 HydrophobicContact CG1-CE2 4.18Å; I170-F195 HydrophobicContact CG1-CZ 4.05Å; I170-F195 HydrophobicContact CG2-CD2 4.18Å; I170-F195 HydrophobicContact CG2-CE2 4.08Å
171N98.4Very high97.3Very high4 Ų439.3 Ų39.32%0.02121%0.206CC..Hα-helixtrans-67.2-45.2174.9-72.3-19.7000111.4R67 S70 T71 T167 F169 R173 W174 F175R67-N171 HydrophobicContact CB-CB 4.38Å; R67-N171 WeakPolarHBondContact CG-OD1 3.21Å; R67-N171 PolarHBondContact NH1-OD1 3.25Å; R67-N171 PolarHBondContact O-ND2 3.08Å; R67-N171 VanDerWaalsContact O-ND2 3.1Å; S70-N171 PolarHBondContact OG-ND2 2.98Å; T71-N171 WeakPolarHBondContact OG1-CB 3.34Å; T71-N171 PolarHBondContact OG1-ND2 3.39Å; T167-N171 PolarHBondContact O-N 3.34Å; T167-N171 VanDerWaalsContact O-N 3.15Å; T167-N171 PolarHBondContact O-ND2 2.69Å; F169-N171 VanDerWaalsContact C-N 3.3Å; N171-R173 VanDerWaalsContact C-N 3.33Å; N171-R173 PolarHBondContact O-N 3.42Å; N171-W174 WeakPolarHBondContact O-CB 3.17Å; N171-W174 PolarHBondContact O-N 3.28Å; N171-W174 VanDerWaalsContact O-N 3.08Å; N171-F175 HydrophobicContact CB-CD2 4.46Å; N171-F175 HydrophobicContact CB-CE2 4.11Å; N171-F175 WeakPolarHBondContact O-CD2 3.33Å; N171-F175 WeakPolarHBondContact O-CG 3.23Å; N171-F175 PolarHBondContact O-N 2.96Å
172L98.2Very high97.1Very high81 Ų8139.9 Ų39.942%0.42421%0.212SC..Hα-helixtrans-56.3-46.7173.5178.460.7000111.7P168 F169 W174 F175 L176 A191P168-L172 WeakPolarHBondContact O-CB 3.22Å; P168-L172 PolarHBondContact O-N 2.94Å; F169-L172 PolarHBondContact O-N 2.93Å; L172-W174 VanDerWaalsContact C-N 3.29Å; L172-W174 PolarHBondContact O-N 3.05Å; L172-F175 PolarHBondContact O-N 2.87Å; L172-L176 HydrophobicContact CD1-CD1 4.41Å; L172-L176 HydrophobicContact CD1-CG 4.37Å; L172-L176 HydrophobicContact CG-CD1 4.25Å; L172-L176 WeakPolarHBondContact O-CG 3.42Å; L172-L176 PolarHBondContact O-N 3.2Å; L172-A191 HydrophobicContact CB-CB 4.48Å; L172-A191 HydrophobicContact CD2-CB 4.1Å; L172-A191 HydrophobicContact CG-CB 4.06Å
173R97.9Very high96.8Very high51 Ų5140.5 Ų40.519%0.19222%0.219CC..Hα-helixtrans-56.6-44.9175.2-179.2-169.1176.2-83.6-1.2111.3F169 I170 N171 R177 V188 A191 T192F169-R173 WeakPolarHBondContact O-CB 3.34Å; F169-R173 PolarHBondContact O-N 3.47Å; I170-R173 PolarHBondContact O-N 2.94Å; N171-R173 VanDerWaalsContact C-N 3.33Å; N171-R173 PolarHBondContact O-N 3.42Å; R173-R177 WeakPolarHBondContact O-CG 3.48Å; R173-R177 PolarHBondContact O-N 3.29Å; R173-R177 VanDerWaalsContact O-N 3.13Å; R173-V188 HydrophobicContact CG-CG1 4.31Å; R173-A191 HydrophobicContact CB-CB 3.99Å; R173-T192 WeakPolarHBondContact CD-OG1 3.48Å; R173-T192 PolarHBondContact NE-OG1 2.84Å
174W97.9Very high96.5Very high32 Ų3244.3 Ų44.312%0.12124%0.236CC..Hα-helixtrans-65.6-44.7179.1-173.9100.9000111.7E63 W64 R67 I170 N171 L172 L176 R177 T178E63-W174 HydrophobicContact CB-CH2 4.2Å; E63-W174 HydrophobicContact CB-CZ2 3.84Å; E63-W174 VanDerWaalsContact CD-NE1 3.29Å; E63-W174 HydrophobicContact CG-CH2 4.24Å; E63-W174 HydrophobicContact CG-CZ2 3.62Å; E63-W174 PolarHBondContact OE1-NE1 3.15Å; W64-W174 HydrophobicContact CB-CH2 3.96Å; W64-W174 HydrophobicContact CB-CZ3 3.94Å; W64-W174 HydrophobicContact CD2-CZ3 4.12Å; W64-W174 HydrophobicContact CE3-CH2 4.22Å; W64-W174 AromaticContact CE3-CZ3 3.64Å; W64-W174 HydrophobicContact CE3-CZ3 3.64Å; W64-W174 HydrophobicContact CG-CZ3 4.3Å; W64-W174 HydrophobicContact CZ3-CZ3 4.43Å; R67-W174 VanDerWaalsContact CD-CE3 3.4Å; R67-W174 VanDerWaalsContact CD-CG 3.47Å; R67-W174 VanDerWaalsContact CZ-CD1 3.41Å; R67-W174 VanDerWaalsContact NE-CD2 3.3Å; R67-W174 VanDerWaalsContact NH2-CD1 3.35Å; I170-W174 PolarHBondContact O-N 3.34Å; N171-W174 WeakPolarHBondContact O-CB 3.17Å; N171-W174 PolarHBondContact O-N 3.28Å; N171-W174 VanDerWaalsContact O-N 3.08Å; L172-W174 VanDerWaalsContact C-N 3.29Å; L172-W174 PolarHBondContact O-N 3.05Å; W174-L176 VanDerWaalsContact C-N 3.34Å; W174-L176 PolarHBondContact O-N 2.89Å; W174-R177 PolarHBondContact O-N 3.49Å; W174-R177 VanDerWaalsContact O-N 3.16Å; W174-T178 HydrophobicContact CH2-CG2 3.93Å; W174-T178 WeakPolarHBondContact CH2-OG1 3.35Å; W174-T178 WeakPolarHBondContact CZ2-OG1 3.22Å; W174-T178 HydrophobicContact CZ3-CG2 4.05Å; W174-T178 WeakPolarHBondContact CZ3-OG1 3.34Å; W174-T178 PolarHBondContact O-N 3.13Å; W174-T178 PolarHBondContact O-OG1 3.38Å; W174-T178 VanDerWaalsContact O-OG1 3.11Å
175F97.5Very high96.3Very high32 Ų3245.1 Ų45.114%0.1424%0.239CC..Hα-helixtrans-58.4-45.6177.2-71.3-55.1000111.5W64 R67 W68 N171 L172 R177 T178 C179W64-F175 AromaticContact CD1-CE1 3.86Å; W64-F175 AromaticContact CD2-CD1 3.75Å; W64-F175 HydrophobicContact CD2-CD1 3.75Å; W64-F175 AromaticContact CD2-CE1 3.61Å; W64-F175 HydrophobicContact CD2-CE1 3.61Å; W64-F175 AromaticContact CE2-CD1 3.73Å; W64-F175 AromaticContact CE2-CE1 3.6Å; W64-F175 AromaticContact CE3-CD1 3.88Å; W64-F175 HydrophobicContact CE3-CD1 3.88Å; W64-F175 HydrophobicContact CE3-CE1 4.18Å; W64-F175 HydrophobicContact CG-CD1 4.38Å; W64-F175 AromaticContact CG-CE1 3.77Å; W64-F175 HydrophobicContact CG-CE1 3.77Å; W64-F175 AromaticContact CH2-CD1 3.89Å; W64-F175 HydrophobicContact CH2-CD1 3.89Å; W64-F175 AromaticContact CZ2-CD1 3.82Å; W64-F175 HydrophobicContact CZ2-CD1 3.82Å; W64-F175 HydrophobicContact CZ2-CE1 4.12Å; W64-F175 AromaticContact CZ3-CD1 3.94Å; W64-F175 HydrophobicContact CZ3-CD1 3.94Å; W64-F175 AromaticContact NE1-CE1 3.77Å; R67-F175 HydrophobicContact CB-CE1 4.16Å; R67-F175 HydrophobicContact CB-CE2 4.22Å; R67-F175 HydrophobicContact CB-CZ 3.65Å; W68-F175 AromaticContact CD1-CZ 3.67Å; W68-F175 HydrophobicContact CG-CZ 4.33Å; N171-F175 HydrophobicContact CB-CD2 4.46Å; N171-F175 HydrophobicContact CB-CE2 4.11Å; N171-F175 WeakPolarHBondContact O-CD2 3.33Å; N171-F175 WeakPolarHBondContact O-CG 3.23Å; N171-F175 PolarHBondContact O-N 2.96Å; L172-F175 PolarHBondContact O-N 2.87Å; F175-R177 PolarHBondContact O-N 3.37Å; F175-T178 PolarHBondContact O-N 2.84Å; F175-C179 WeakPolarHBondContact O-CB 3.49Å; F175-C179 PolarHBondContact O-N 3.39Å; F175-C179 PolarHBondContact O-SG 3.06Å; F175-C179 VanDerWaalsContact O-SG 3.4Å
176L96.9Very high96.1Very high24 Ų2446.5 Ų46.513%0.12624%0.243CC..Hα-helixtrans-58.1-46.4175.7-68.9168.5000111.7L172 W174 T178 C179 G180 Y181 Y187 V188 A191L172-L176 HydrophobicContact CD1-CD1 4.41Å; L172-L176 HydrophobicContact CD1-CG 4.37Å; L172-L176 HydrophobicContact CG-CD1 4.25Å; L172-L176 WeakPolarHBondContact O-CG 3.42Å; L172-L176 PolarHBondContact O-N 3.2Å; W174-L176 VanDerWaalsContact C-N 3.34Å; W174-L176 PolarHBondContact O-N 2.89Å; L176-T178 VanDerWaalsContact C-N 3.33Å; L176-T178 PolarHBondContact O-N 2.98Å; L176-C179 PolarHBondContact O-N 3.36Å; L176-G180 PolarHBondContact O-N 3.07Å; L176-Y181 HydrophobicContact CB-CD2 4.23Å; L176-Y181 HydrophobicContact CD2-CD2 3.85Å; L176-Y181 HydrophobicContact CD2-CE2 3.95Å; L176-Y181 HydrophobicContact CD2-CG 4.42Å; L176-Y181 WeakPolarHBondContact O-CB 3.5Å; L176-Y181 VanDerWaalsContact O-CD2 3.29Å; L176-Y181 WeakPolarHBondContact O-CD2 3.4Å; L176-Y181 PolarHBondContact O-N 2.93Å; L176-Y181 VanDerWaalsContact O-N 3.09Å; L176-Y187 WeakPolarHBondContact CD1-O 3.42Å; L176-V188 HydrophobicContact CB-CG2 3.73Å; L176-V188 HydrophobicContact CD1-CG2 4.3Å; L176-A191 HydrophobicContact CD1-CB 4.09Å
177R96.4Very high96Very high103 Ų10351.7 Ų51.739%0.38926%0.263SS..Hα-helixtrans-63-39.6177.7-69.2-69.5-66.4148.5-8.4112.3R173 W174 F175 G180 Y181 S182 V188R173-R177 WeakPolarHBondContact O-CG 3.48Å; R173-R177 PolarHBondContact O-N 3.29Å; R173-R177 VanDerWaalsContact O-N 3.13Å; W174-R177 PolarHBondContact O-N 3.49Å; W174-R177 VanDerWaalsContact O-N 3.16Å; F175-R177 PolarHBondContact O-N 3.37Å; R177-G180 PolarHBondContact O-N 3.41Å; R177-Y181 WeakPolarHBondContact CD-O 3.42Å; R177-Y181 PolarHBondContact NH1-O 3.28Å; R177-S182 VanDerWaalsContact NH1-CA 3.3Å; R177-V188 HydrophobicContact CG-CG1 4.26Å; R177-V188 HydrophobicContact CG-CG2 4.49Å
178T96Very high95.9Very high21 Ų2151 Ų5113%0.12926%0.259CS..Hα-helixtrans-72.4-29.3178.9-59.20000112.3I56 W64 W174 F175 L176 G180I56-T178 HydrophobicContact CG2-CG2 3.64Å; W64-T178 HydrophobicContact CE3-CG2 3.79Å; W64-T178 HydrophobicContact CZ3-CG2 3.78Å; W174-T178 HydrophobicContact CH2-CG2 3.93Å; W174-T178 WeakPolarHBondContact CH2-OG1 3.35Å; W174-T178 WeakPolarHBondContact CZ2-OG1 3.22Å; W174-T178 HydrophobicContact CZ3-CG2 4.05Å; W174-T178 WeakPolarHBondContact CZ3-OG1 3.34Å; W174-T178 PolarHBondContact O-N 3.13Å; W174-T178 PolarHBondContact O-OG1 3.38Å; W174-T178 VanDerWaalsContact O-OG1 3.11Å; F175-T178 PolarHBondContact O-N 2.84Å; L176-T178 VanDerWaalsContact C-N 3.33Å; L176-T178 PolarHBondContact O-N 2.98Å; T178-G180 PolarHBondContact O-N 3.32Å
179C94.8Very high95.9Very high44 Ų4449.8 Ų49.830%0.29725%0.251SS..THydrogen-bonded Turntrans-75.10171.8-74.30000114.2F175 L176 Y181F175-C179 WeakPolarHBondContact O-CB 3.49Å; F175-C179 PolarHBondContact O-N 3.39Å; F175-C179 PolarHBondContact O-SG 3.06Å; F175-C179 VanDerWaalsContact O-SG 3.4Å; L176-C179 PolarHBondContact O-N 3.36Å; C179-Y181 HydrophobicContact CB-CD2 4.11Å; C179-Y181 HydrophobicContact CB-CE2 4.22Å
180G93.8Very high95.8Very high65 Ų6551.2 Ų51.267%0.6726%0.26SS*.THydrogen-bonded Turntrans99.6-0.6175.100000115.2L176 R177 T178 S182L176-G180 PolarHBondContact O-N 3.07Å; R177-G180 PolarHBondContact O-N 3.41Å; T178-G180 PolarHBondContact O-N 3.32Å; G180-S182 PolarHBondContact O-N 2.64Å
181Y94.7Very high95.8Very high88 Ų8849.4 Ų49.435%0.34525%0.251SS..  trans-66.2132.1175.7-67.8-87.7000110.9L176 R177 C179 H185 Y187L176-Y181 HydrophobicContact CB-CD2 4.23Å; L176-Y181 HydrophobicContact CD2-CD2 3.85Å; L176-Y181 HydrophobicContact CD2-CE2 3.95Å; L176-Y181 HydrophobicContact CD2-CG 4.42Å; L176-Y181 WeakPolarHBondContact O-CB 3.5Å; L176-Y181 VanDerWaalsContact O-CD2 3.29Å; L176-Y181 WeakPolarHBondContact O-CD2 3.4Å; L176-Y181 PolarHBondContact O-N 2.93Å; L176-Y181 VanDerWaalsContact O-N 3.09Å; R177-Y181 WeakPolarHBondContact CD-O 3.42Å; R177-Y181 PolarHBondContact NH1-O 3.28Å; C179-Y181 HydrophobicContact CB-CD2 4.11Å; C179-Y181 HydrophobicContact CB-CE2 4.22Å; Y181-H185 HydrophobicContact CD1-CB 4.38Å; Y181-H185 AromaticContact CD1-CD2 3.74Å; Y181-H185 AromaticContact CD1-CE1 3.51Å; Y181-H185 AromaticContact CD1-CG 3.59Å; Y181-H185 AromaticContact CD1-ND1 3.44Å; Y181-H185 WeakPolarHBondContact CD1-ND1 3.27Å; Y181-H185 AromaticContact CD1-NE2 3.69Å; Y181-H185 AromaticContact CE1-CE1 3.62Å; Y181-H185 AromaticContact CE1-NE2 3.83Å; Y181-Y187 HydrophobicContact CE1-CD2 4.11Å
182S94.2Very high95.8Very high27 Ų2749.6 Ų49.619%0.18925%0.252CS..  trans-66.2161.4179.990.20000112.1R177 G180 H184 H185 V188 E275R177-S182 VanDerWaalsContact NH1-CA 3.3Å; G180-S182 PolarHBondContact O-N 2.64Å; S182-H184 PolarHBondContact O-N 3.21Å; S182-H184 PolarHBondContact OG-N 2.89Å; S182-H185 WeakPolarHBondContact O-CB 3.46Å; S182-H185 PolarHBondContact O-N 3.49Å; S182-H185 VanDerWaalsContact O-N 3.13Å; S182-H185 PolarHBondContact OG-N 3.1Å; S182-V188 WeakPolarHBondContact O-CG2 3.27Å; S182-E275 WeakPolarHBondContact CB-OE2 3.37Å; S182-E275 PolarHBondContact OG-OE2 2.92Å
183S91.2Very high95.8Very high54 Ų5446.7 Ų46.738%0.37824%0.239SC..THydrogen-bonded Turntrans-66-18.3177.542.60000112.6
184H90.8Very high95.8Very high101 Ų10147.9 Ų47.947%0.46825%0.249SC..THydrogen-bonded Turntrans-97.20.5178.5-57.1-63.7000112.5S182 V265 S272S182-H184 PolarHBondContact O-N 3.21Å; S182-H184 PolarHBondContact OG-N 2.89Å; H184-V265 HydrophobicContact CB-CG2 4.39Å; H184-V265 WeakPolarHBondContact O-CG1 3.18Å; H184-S272 WeakPolarHBondContact O-CB 3.36Å
185H93.6Very high95.8Very high29 Ų2947.1 Ų47.113%0.13425%0.246CC..SBendtrans-69.8137.2176.5-166.7-88000111.5Y181 S182 Y187 V188 A189Y181-H185 HydrophobicContact CD1-CB 4.38Å; Y181-H185 AromaticContact CD1-CD2 3.74Å; Y181-H185 AromaticContact CD1-CE1 3.51Å; Y181-H185 AromaticContact CD1-CG 3.59Å; Y181-H185 AromaticContact CD1-ND1 3.44Å; Y181-H185 WeakPolarHBondContact CD1-ND1 3.27Å; Y181-H185 AromaticContact CD1-NE2 3.69Å; Y181-H185 AromaticContact CE1-CE1 3.62Å; Y181-H185 AromaticContact CE1-NE2 3.83Å; S182-H185 WeakPolarHBondContact O-CB 3.46Å; S182-H185 PolarHBondContact O-N 3.49Å; S182-H185 VanDerWaalsContact O-N 3.13Å; S182-H185 PolarHBondContact OG-N 3.1Å; H185-Y187 VanDerWaalsContact C-N 3.3Å; H185-Y187 AromaticContact CE1-CD2 3.31Å; H185-Y187 WeakPolarHBondContact CE1-CD2 3.44Å; H185-Y187 AromaticContact CE1-CE2 3.71Å; H185-Y187 AromaticContact CE1-CG 3.69Å; H185-Y187 AromaticContact ND1-CD2 3.77Å; H185-Y187 AromaticContact ND1-CG 3.81Å; H185-Y187 PolarHBondContact ND1-N 2.84Å; H185-Y187 PolarHBondContact O-N 3Å; H185-V188 HydrophobicContact CB-CG2 4.33Å; H185-V188 WeakPolarHBondContact O-CB 3.36Å; H185-V188 PolarHBondContact O-N 2.91Å; H185-A189 PolarHBondContact O-N 3.26Å
186K94.7Very high95.9Very high85 Ų8545.6 Ų45.637%0.3724%0.24SC..Hα-helixtrans-53.2-42-17667.3-175.3177.5-170.70113.8V188 A189 I190K186-V188 PolarHBondContact O-N 3.47Å; K186-A189 PolarHBondContact O-N 3.28Å; K186-I190 WeakPolarHBondContact O-CG1 3.41Å; K186-I190 PolarHBondContact O-N 2.94Å
187Y96Very high95.9Very high111 Ų11148.3 Ų48.344%0.43526%0.257SS..Hα-helixtrans-66.1-38.3179.5-58.4-28.5000112.6L176 Y181 H185 A189 I190 A191L176-Y187 WeakPolarHBondContact CD1-O 3.42Å; Y181-Y187 HydrophobicContact CE1-CD2 4.11Å; H185-Y187 VanDerWaalsContact C-N 3.3Å; H185-Y187 AromaticContact CE1-CD2 3.31Å; H185-Y187 WeakPolarHBondContact CE1-CD2 3.44Å; H185-Y187 AromaticContact CE1-CE2 3.71Å; H185-Y187 AromaticContact CE1-CG 3.69Å; H185-Y187 AromaticContact ND1-CD2 3.77Å; H185-Y187 AromaticContact ND1-CG 3.81Å; H185-Y187 PolarHBondContact ND1-N 2.84Å; H185-Y187 PolarHBondContact O-N 3Å; Y187-A189 VanDerWaalsContact C-N 3.31Å; Y187-I190 PolarHBondContact O-N 3.42Å; Y187-A191 WeakPolarHBondContact O-CB 3.23Å; Y187-A191 PolarHBondContact O-N 2.6Å
188V97Very high96Very high2 Ų244.3 Ų44.31%0.01224%0.244CC..Hα-helixtrans-65.8-40.4175.5174.90000109.8R173 L176 R177 S182 H185 K186 T192R173-V188 HydrophobicContact CG-CG1 4.31Å; L176-V188 HydrophobicContact CB-CG2 3.73Å; L176-V188 HydrophobicContact CD1-CG2 4.3Å; R177-V188 HydrophobicContact CG-CG1 4.26Å; R177-V188 HydrophobicContact CG-CG2 4.49Å; S182-V188 WeakPolarHBondContact O-CG2 3.27Å; H185-V188 HydrophobicContact CB-CG2 4.33Å; H185-V188 WeakPolarHBondContact O-CB 3.36Å; H185-V188 PolarHBondContact O-N 2.91Å; K186-V188 PolarHBondContact O-N 3.47Å; V188-T192 VanDerWaalsContact O-CB 3.26Å; V188-T192 WeakPolarHBondContact O-CB 3.08Å; V188-T192 PolarHBondContact O-N 3.44Å; V188-T192 PolarHBondContact O-OG1 2.97Å
189A96.8Very high96.1Very high1 Ų143.6 Ų43.61%0.00824%0.239CC..Hα-helixtrans-64.3-4417700000112.2H185 K186 Y187 T192 S193 S262 V265 L266H185-A189 PolarHBondContact O-N 3.26Å; K186-A189 PolarHBondContact O-N 3.28Å; Y187-A189 VanDerWaalsContact C-N 3.31Å; A189-T192 PolarHBondContact O-N 3.12Å; A189-S193 WeakPolarHBondContact O-CB 3.36Å; A189-S193 PolarHBondContact O-N 3.11Å; A189-S193 PolarHBondContact O-OG 3.37Å; A189-S262 WeakPolarHBondContact O-CB 3.39Å; A189-V265 HydrophobicContact CB-CB 4.06Å; A189-V265 HydrophobicContact CB-CG1 3.77Å; A189-L266 HydrophobicContact CB-CD1 4.36Å; A189-L266 HydrophobicContact CB-CD2 3.89Å; A189-L266 HydrophobicContact CB-CG 3.84Å
190I97.3Very high96.3Very high81 Ų8143.1 Ų43.142%0.41523%0.233SC..Hα-helixtrans-60.7-51.2175.5-67.1168.4000110.9K186 Y187 T192 S193 L194 L266K186-I190 WeakPolarHBondContact O-CG1 3.41Å; K186-I190 PolarHBondContact O-N 2.94Å; Y187-I190 PolarHBondContact O-N 3.42Å; I190-T192 VanDerWaalsContact C-N 3.28Å; I190-T192 PolarHBondContact O-N 3.25Å; I190-S193 PolarHBondContact O-N 3.33Å; I190-S193 VanDerWaalsContact O-N 3.15Å; I190-L194 HydrophobicContact CG2-CD1 4.01Å; I190-L194 HydrophobicContact CG2-CG 4.44Å; I190-L194 WeakPolarHBondContact O-CG 3.31Å; I190-L194 PolarHBondContact O-N 2.98Å; I190-L266 HydrophobicContact CG1-CD2 3.92Å
191A98.1Very high96.4Very high1 Ų144.1 Ų44.11%0.00822%0.223CC..Hα-helixtrans-60.1-39.817900000111.8L172 R173 L176 Y187 F195L172-A191 HydrophobicContact CB-CB 4.48Å; L172-A191 HydrophobicContact CD2-CB 4.1Å; L172-A191 HydrophobicContact CG-CB 4.06Å; R173-A191 HydrophobicContact CB-CB 3.99Å; L176-A191 HydrophobicContact CD1-CB 4.09Å; Y187-A191 WeakPolarHBondContact O-CB 3.23Å; Y187-A191 PolarHBondContact O-N 2.6Å; A191-F195 WeakPolarHBondContact O-CB 3.22Å; A191-F195 PolarHBondContact O-N 3.25Å
192T97.9Very high96.5Very high8 Ų840.8 Ų40.85%0.04921%0.212CC..Hα-helixtrans-63.1-43.9175.2-57.50000111.6R173 V188 A189 I190 A196 M258R173-T192 WeakPolarHBondContact CD-OG1 3.48Å; R173-T192 PolarHBondContact NE-OG1 2.84Å; V188-T192 VanDerWaalsContact O-CB 3.26Å; V188-T192 WeakPolarHBondContact O-CB 3.08Å; V188-T192 PolarHBondContact O-N 3.44Å; V188-T192 PolarHBondContact O-OG1 2.97Å; A189-T192 PolarHBondContact O-N 3.12Å; I190-T192 VanDerWaalsContact C-N 3.28Å; I190-T192 PolarHBondContact O-N 3.25Å; T192-A196 VanDerWaalsContact O-CB 3.3Å; T192-A196 WeakPolarHBondContact O-CB 3.42Å; T192-A196 PolarHBondContact O-N 3.09Å; T192-M258 HydrophobicContact CG2-CB 3.9Å
193S98Very high96.6Very high20 Ų2040.3 Ų40.314%0.1421%0.206CC..Hα-helixtrans-65.4-45.4178.8-63.50000111.9A189 I190 A196 V197 S262A189-S193 WeakPolarHBondContact O-CB 3.36Å; A189-S193 PolarHBondContact O-N 3.11Å; A189-S193 PolarHBondContact O-OG 3.37Å; I190-S193 PolarHBondContact O-N 3.33Å; I190-S193 VanDerWaalsContact O-N 3.15Å; S193-A196 PolarHBondContact O-N 2.96Å; S193-V197 WeakPolarHBondContact O-CB 3.32Å; S193-V197 VanDerWaalsContact O-CG2 3.29Å; S193-V197 WeakPolarHBondContact O-CG2 3.47Å; S193-V197 PolarHBondContact O-N 3.33Å; S193-S262 WeakPolarHBondContact OG-CB 3.34Å; S193-S262 PolarHBondContact OG-OG 2.89Å
194L98.1Very high96.8Very high76 Ų7639.6 Ų39.640%0.39820%0.198SC..Hα-helixtrans-60.9-46.4176.8-70.9173000111.4F169 I190 T198F169-L194 HydrophobicContact CB-CB 4.22Å; F169-L194 HydrophobicContact CD1-CB 3.7Å; F169-L194 HydrophobicContact CD1-CD1 3.92Å; F169-L194 HydrophobicContact CD1-CG 4.44Å; F169-L194 HydrophobicContact CD2-CB 4.28Å; F169-L194 HydrophobicContact CE1-CB 4.11Å; F169-L194 HydrophobicContact CE1-CD1 3.86Å; F169-L194 HydrophobicContact CG-CB 3.8Å; I190-L194 HydrophobicContact CG2-CD1 4.01Å; I190-L194 HydrophobicContact CG2-CG 4.44Å; I190-L194 WeakPolarHBondContact O-CG 3.31Å; I190-L194 PolarHBondContact O-N 2.98Å; L194-T198 WeakPolarHBondContact O-CB 3.49Å; L194-T198 VanDerWaalsContact O-CG2 3.32Å; L194-T198 WeakPolarHBondContact O-CG2 3.31Å; L194-T198 PolarHBondContact O-N 3.48Å; L194-T198 PolarHBondContact O-OG1 3.36Å
195F98.4Very high97.1Very high16 Ų1639.7 Ų39.77%0.0720%0.201CC..Hα-helixtrans-56.7-52173.9165-122.6000111.7S166 F169 I170 A191 V197 T198 F199 I255S166-F195 WeakPolarHBondContact O-CD2 3.41Å; F169-F195 HydrophobicContact CB-CB 3.7Å; I170-F195 HydrophobicContact CB-CD1 4.24Å; I170-F195 HydrophobicContact CB-CD2 3.55Å; I170-F195 HydrophobicContact CB-CE1 4.32Å; I170-F195 HydrophobicContact CB-CE2 3.65Å; I170-F195 HydrophobicContact CB-CG 3.84Å; I170-F195 HydrophobicContact CB-CZ 4.03Å; I170-F195 HydrophobicContact CD1-CD1 3.82Å; I170-F195 HydrophobicContact CD1-CE1 3.68Å; I170-F195 HydrophobicContact CD1-CG 4.28Å; I170-F195 HydrophobicContact CD1-CZ 4.05Å; I170-F195 HydrophobicContact CG1-CD1 4.45Å; I170-F195 HydrophobicContact CG1-CD2 4.42Å; I170-F195 HydrophobicContact CG1-CE1 4.2Å; I170-F195 HydrophobicContact CG1-CE2 4.18Å; I170-F195 HydrophobicContact CG1-CZ 4.05Å; I170-F195 HydrophobicContact CG2-CD2 4.18Å; I170-F195 HydrophobicContact CG2-CE2 4.08Å; A191-F195 WeakPolarHBondContact O-CB 3.22Å; A191-F195 PolarHBondContact O-N 3.25Å; F195-V197 PolarHBondContact O-N 3.06Å; F195-T198 PolarHBondContact O-N 3.22Å; F195-T198 PolarHBondContact O-OG1 3.1Å; F195-F199 HydrophobicContact CD2-CB 4.42Å; F195-F199 HydrophobicContact CE2-CB 4.11Å; F195-F199 AromaticContact CE2-CD2 3.78Å; F195-F199 HydrophobicContact CE2-CD2 3.78Å; F195-F199 HydrophobicContact CE2-CG 4.31Å; F195-F199 HydrophobicContact CZ-CD2 4.06Å; F195-F199 WeakPolarHBondContact O-CB 3.39Å; F195-F199 PolarHBondContact O-N 3.4Å; F195-I255 HydrophobicContact CE1-CD1 3.84Å; F195-I255 HydrophobicContact CE1-CG1 3.76Å; F195-I255 HydrophobicContact CE1-CG2 4.37Å; F195-I255 HydrophobicContact CE2-CD1 4.4Å; F195-I255 HydrophobicContact CZ-CD1 3.5Å; F195-I255 VanDerWaalsContact CZ-CD1 3.5Å; F195-I255 HydrophobicContact CZ-CG1 3.96Å
196A98.4Very high97.2Very high0 Ų041 Ų410%021%0.212CC..Hα-helixtrans-65.7-43.6-17400000112.4T192 S193 F199 I200 I255 L259T192-A196 VanDerWaalsContact O-CB 3.3Å; T192-A196 WeakPolarHBondContact O-CB 3.42Å; T192-A196 PolarHBondContact O-N 3.09Å; S193-A196 PolarHBondContact O-N 2.96Å; A196-F199 PolarHBondContact O-N 3.38Å; A196-I200 WeakPolarHBondContact O-CB 3.45Å; A196-I200 WeakPolarHBondContact O-CD1 3.46Å; A196-I200 VanDerWaalsContact O-CG1 3.22Å; A196-I200 WeakPolarHBondContact O-CG1 3.43Å; A196-I200 PolarHBondContact O-N 2.87Å; A196-I255 VanDerWaalsContact CA-CG2 3.47Å; A196-I255 HydrophobicContact CB-CG2 3.42Å; A196-I255 VanDerWaalsContact CB-CG2 3.42Å; A196-L259 HydrophobicContact CB-CB 3.71Å; A196-L259 HydrophobicContact CB-CD1 4.12Å; A196-L259 HydrophobicContact CB-CD2 4.23Å; A196-L259 HydrophobicContact CB-CG 4.23Å
197V98.1Very high97.2Very high82 Ų8237.5 Ų37.550%0.49720%0.199SC..Hα-helixtrans-63-48.4178.51700000110.6S193 F195 F199 I200 L201 L259S193-V197 WeakPolarHBondContact O-CB 3.32Å; S193-V197 VanDerWaalsContact O-CG2 3.29Å; S193-V197 WeakPolarHBondContact O-CG2 3.47Å; S193-V197 PolarHBondContact O-N 3.33Å; F195-V197 PolarHBondContact O-N 3.06Å; V197-F199 PolarHBondContact O-N 2.92Å; V197-I200 PolarHBondContact O-N 2.74Å; V197-L201 VanDerWaalsContact O-CB 3.24Å; V197-L201 WeakPolarHBondContact O-CB 3.32Å; V197-L201 PolarHBondContact O-N 3.47Å; V197-L259 HydrophobicContact CG2-CD1 4.43Å
198T98.1Very high97Very high18 Ų1837.4 Ų37.411%0.1121%0.21CC..Hα-helixtrans-65.7-38.4179.852.70000112L165 S166 F169 L194 F195 T202L165-T198 HydrophobicContact CD2-CG2 4.08Å; L165-T198 HydrophobicContact CG-CG2 4.04Å; S166-T198 WeakPolarHBondContact CA-OG1 3.43Å; S166-T198 WeakPolarHBondContact CB-OG1 3.43Å; F169-T198 HydrophobicContact CD2-CG2 4.14Å; F169-T198 HydrophobicContact CE2-CG2 3.87Å; L194-T198 WeakPolarHBondContact O-CB 3.49Å; L194-T198 VanDerWaalsContact O-CG2 3.32Å; L194-T198 WeakPolarHBondContact O-CG2 3.31Å; L194-T198 PolarHBondContact O-N 3.48Å; L194-T198 PolarHBondContact O-OG1 3.36Å; F195-T198 PolarHBondContact O-N 3.22Å; F195-T198 PolarHBondContact O-OG1 3.1Å; T198-T202 WeakPolarHBondContact O-CB 3.24Å; T198-T202 WeakPolarHBondContact O-CG2 3.33Å; T198-T202 PolarHBondContact O-N 3.02Å; T198-T202 PolarHBondContact O-OG1 3.02Å
199F98.4Very high97Very high6 Ų640.2 Ų40.23%0.02623%0.229CC..Hα-helixtrans-62.5-53.1175.1-172.1-77.4000111.3F195 A196 V197 L201 T202 R203 N248 W251 I255F195-F199 HydrophobicContact CD2-CB 4.42Å; F195-F199 HydrophobicContact CE2-CB 4.11Å; F195-F199 AromaticContact CE2-CD2 3.78Å; F195-F199 HydrophobicContact CE2-CD2 3.78Å; F195-F199 HydrophobicContact CE2-CG 4.31Å; F195-F199 HydrophobicContact CZ-CD2 4.06Å; F195-F199 WeakPolarHBondContact O-CB 3.39Å; F195-F199 PolarHBondContact O-N 3.4Å; A196-F199 PolarHBondContact O-N 3.38Å; V197-F199 PolarHBondContact O-N 2.92Å; F199-L201 VanDerWaalsContact C-N 3.35Å; F199-L201 PolarHBondContact O-N 3.05Å; F199-T202 PolarHBondContact O-N 2.93Å; F199-R203 HydrophobicContact CD1-CB 4.4Å; F199-R203 VanDerWaalsContact CD2-CD 3.45Å; F199-R203 HydrophobicContact CE1-CB 4.24Å; F199-R203 HydrophobicContact CZ-CB 4.48Å; F199-R203 VanDerWaalsContact O-CB 3.27Å; F199-R203 WeakPolarHBondContact O-CB 3.25Å; F199-R203 PolarHBondContact O-N 2.83Å; F199-N248 HydrophobicContact CZ-CB 4.45Å; F199-W251 HydrophobicContact CE1-CB 4.31Å; F199-W251 HydrophobicContact CE2-CB 4.42Å; F199-W251 HydrophobicContact CE2-CE3 4.27Å; F199-W251 HydrophobicContact CZ-CB 3.7Å; F199-W251 HydrophobicContact CZ-CE3 4.08Å; F199-I255 HydrophobicContact CB-CD1 4.22Å; F199-I255 HydrophobicContact CD1-CD1 3.43Å; F199-I255 VanDerWaalsContact CD1-CD1 3.43Å; F199-I255 HydrophobicContact CD2-CD1 3.58Å; F199-I255 HydrophobicContact CE1-CD1 3.57Å; F199-I255 HydrophobicContact CE2-CD1 3.69Å; F199-I255 HydrophobicContact CG-CD1 3.45Å; F199-I255 VanDerWaalsContact CG-CD1 3.45Å; F199-I255 HydrophobicContact CZ-CD1 3.7Å
200I97.8Very high97Very high35 Ų3541.6 Ų41.618%0.17923%0.234CC..Iπ-helixtrans-61.6-45.2-177.5-68.6164.9000110.5A196 V197 N204 I205 I255 L259A196-I200 WeakPolarHBondContact O-CB 3.45Å; A196-I200 WeakPolarHBondContact O-CD1 3.46Å; A196-I200 VanDerWaalsContact O-CG1 3.22Å; A196-I200 WeakPolarHBondContact O-CG1 3.43Å; A196-I200 PolarHBondContact O-N 2.87Å; V197-I200 PolarHBondContact O-N 2.74Å; I200-N204 WeakPolarHBondContact O-CA 3.34Å; I200-N204 WeakPolarHBondContact O-CB 3.29Å; I200-N204 PolarHBondContact O-N 3.03Å; I200-I205 HydrophobicContact CG2-CD1 4.13Å; I200-I205 HydrophobicContact CG2-CG1 4.28Å; I200-I205 PolarHBondContact O-N 2.68Å; I200-I255 HydrophobicContact CD1-CG2 4.44Å; I200-I255 HydrophobicContact CG1-CG2 4.46Å; I200-L259 HydrophobicContact CD1-CD2 4.14Å
201L97.3Very high96.8Very high86 Ų8639.6 Ų39.645%0.4522%0.221SC..Iπ-helixtrans-61.4-56.6179.3-178.264.2000111.1V197 F199 I205 C206V197-L201 VanDerWaalsContact O-CB 3.24Å; V197-L201 WeakPolarHBondContact O-CB 3.32Å; V197-L201 PolarHBondContact O-N 3.47Å; F199-L201 VanDerWaalsContact C-N 3.35Å; F199-L201 PolarHBondContact O-N 3.05Å; L201-I205 HydrophobicContact CD1-CD1 4.42Å; L201-C206 WeakPolarHBondContact O-CB 3.36Å; L201-C206 PolarHBondContact O-N 3.18Å; L201-C206 PolarHBondContact O-SG 3.39Å
202T96.8Very high96.7Very high18 Ų1846.6 Ų46.611%0.1125%0.249CC..Iπ-helixtrans-75.7-34.3-171.259.90000113.4L165 T198 F199L165-T202 HydrophobicContact CB-CG2 4.41Å; L165-T202 HydrophobicContact CD2-CG2 4.31Å; T198-T202 WeakPolarHBondContact O-CB 3.24Å; T198-T202 WeakPolarHBondContact O-CG2 3.33Å; T198-T202 PolarHBondContact O-N 3.02Å; T198-T202 PolarHBondContact O-OG1 3.02Å; F199-T202 PolarHBondContact O-N 2.93Å
203R96.6Very high96.6Very high16 Ų1649.7 Ų49.76%0.0626%0.264CS..Iπ-helixtrans-104.2-28.8-172-65.1170.6175.2-131.32.8114.5T163 E164 F199 A207 N248T163-R203 HydrophobicContact CG2-CG 3.74Å; T163-R203 PolarHBondContact O-NE 3.21Å; T163-R203 PolarHBondContact O-NH2 3.43Å; E164-R203 IonicContact OE1-NH2 2.91Å; F199-R203 HydrophobicContact CD1-CB 4.4Å; F199-R203 VanDerWaalsContact CD2-CD 3.45Å; F199-R203 HydrophobicContact CE1-CB 4.24Å; F199-R203 HydrophobicContact CZ-CB 4.48Å; F199-R203 VanDerWaalsContact O-CB 3.27Å; F199-R203 WeakPolarHBondContact O-CB 3.25Å; F199-R203 PolarHBondContact O-N 2.83Å; R203-A207 WeakPolarHBondContact O-CB 3.29Å; R203-N248 HydrophobicContact CB-CB 4.16Å; R203-N248 PolarHBondContact NH1-OD1 3.4Å
204N95Very high96.5Very high39 Ų3948.7 Ų48.721%0.20926%0.258CS..Iπ-helixtrans-103-47.5-179.1-58.7109.9000112I200 N248I200-N204 WeakPolarHBondContact O-CA 3.34Å; I200-N204 WeakPolarHBondContact O-CB 3.29Å; I200-N204 PolarHBondContact O-N 3.03Å; N204-N248 PolarHBondContact ND2-O 3.49Å; N204-N248 VanDerWaalsContact ND2-O 3.13Å
205I95.9Very high96.4Very high104 Ų10447.3 Ų47.353%0.53326%0.255SS..Iπ-helixtrans-77.1-51.6-178.6-61.2175.6000110.5I200 L201 A207 P209I200-I205 HydrophobicContact CG2-CD1 4.13Å; I200-I205 HydrophobicContact CG2-CG1 4.28Å; I200-I205 PolarHBondContact O-N 2.68Å; L201-I205 HydrophobicContact CD1-CD1 4.42Å; I205-A207 PolarHBondContact O-N 2.93Å; I205-P209 WeakPolarHBondContact O-CD 3.38Å
206C96.1Very high96.2Very high55 Ų5551.7 Ų51.737%0.37227%0.271SS..THydrogen-bonded Turntrans-73.2-9-176.7-68.70000114.5L201 P209 F210L201-C206 WeakPolarHBondContact O-CB 3.36Å; L201-C206 PolarHBondContact O-N 3.18Å; L201-C206 PolarHBondContact O-SG 3.39Å; C206-P209 WeakPolarHBondContact O-CD 3.22Å; C206-P209 WeakPolarHBondContact O-CG 3.45Å; C206-F210 WeakPolarHBondContact O-CB 3.47Å; C206-F210 PolarHBondContact O-N 3.47Å
207A94.2Very high96.1Very high12 Ų1253.2 Ų53.210%0.09928%0.279CS..Hα-helixtrans-63.9-41.4177.600000112.7R203 I205 F210 W211R203-A207 WeakPolarHBondContact O-CB 3.29Å; I205-A207 PolarHBondContact O-N 2.93Å; A207-F210 WeakPolarHBondContact O-CB 3.36Å; A207-F210 PolarHBondContact O-N 3.23Å; A207-W211 PolarHBondContact O-N 3.04Å
208V93.5Very high95.9Very high110 Ų11050.2 Ų50.267%0.66726%0.26SS*.Hα-helixtrans-64.1-54.7178.6179.80000112.4F210 W211 Y212V208-F210 PolarHBondContact O-N 2.97Å; V208-W211 PolarHBondContact O-N 2.91Å; V208-Y212 PolarHBondContact O-N 3.46Å
209P95.9Very high95.7Very high61 Ų6155.4 Ų55.440%0.39628%0.283SS..Hα-helixtrans-63.5-31.3177.924.6-33.4000112.1I205 C206 Y212 L213I205-P209 WeakPolarHBondContact O-CD 3.38Å; C206-P209 WeakPolarHBondContact O-CD 3.22Å; C206-P209 WeakPolarHBondContact O-CG 3.45Å; P209-Y212 PolarHBondContact O-N 3.12Å; P209-L213 WeakPolarHBondContact O-CB 3.29Å; P209-L213 WeakPolarHBondContact O-CG 3.28Å; P209-L213 PolarHBondContact O-N 3.45Å
210F96.2Very high95.5Very high29 Ų2960.6 Ų60.613%0.12731%0.307CS..Hα-helixtrans-57.1-52.7173.6172.6-92.6000111.8Y156 L159 K160 C206 A207 V208 Y212 L213 V214Y156-F210 HydrophobicContact CD1-CE2 4.33Å; Y156-F210 WeakPolarHBondContact O-CE2 3.39Å; L159-F210 HydrophobicContact CB-CD2 4.16Å; L159-F210 HydrophobicContact CB-CE2 4.07Å; K160-F210 HydrophobicContact CB-CE2 4.27Å; K160-F210 HydrophobicContact CB-CZ 4.37Å; K160-F210 HydrophobicContact CD-CE1 4.24Å; K160-F210 HydrophobicContact CD-CE2 4.38Å; K160-F210 HydrophobicContact CD-CZ 4.14Å; C206-F210 WeakPolarHBondContact O-CB 3.47Å; C206-F210 PolarHBondContact O-N 3.47Å; A207-F210 WeakPolarHBondContact O-CB 3.36Å; A207-F210 PolarHBondContact O-N 3.23Å; V208-F210 PolarHBondContact O-N 2.97Å; F210-Y212 VanDerWaalsContact C-N 3.35Å; F210-Y212 PolarHBondContact O-N 3.31Å; F210-L213 PolarHBondContact O-N 2.9Å; F210-V214 HydrophobicContact CD1-CG2 4.43Å; F210-V214 HydrophobicContact CE1-CG2 4.01Å; F210-V214 HydrophobicContact CE2-CG2 4.3Å; F210-V214 HydrophobicContact CZ-CG2 3.94Å; F210-V214 WeakPolarHBondContact O-CG2 3.17Å; F210-V214 PolarHBondContact O-N 3.33Å
211W94.8Very high95.4Very high39 Ų3960.3 Ų60.315%0.14831%0.305CS..Hα-helixtrans-69.1-33.5-179.1-71.6120.5000113.5A207 V208 V214 S215 Y237 F238 D245A207-W211 PolarHBondContact O-N 3.04Å; V208-W211 PolarHBondContact O-N 2.91Å; W211-V214 HydrophobicContact CE3-CB 4.46Å; W211-S215 WeakPolarHBondContact O-CB 3.15Å; W211-S215 PolarHBondContact O-N 3.32Å; W211-S215 PolarHBondContact O-OG 2.97Å; W211-Y237 WeakPolarHBondContact CH2-O 3.1Å; W211-F238 HydrophobicContact CB-CE1 4.35Å; W211-F238 HydrophobicContact CD2-CD1 4.04Å; W211-F238 AromaticContact CD2-CE1 3.8Å; W211-F238 HydrophobicContact CD2-CE1 3.8Å; W211-F238 AromaticContact CE3-CD1 3.4Å; W211-F238 HydrophobicContact CE3-CD1 3.4Å; W211-F238 VanDerWaalsContact CE3-CD1 3.4Å; W211-F238 AromaticContact CE3-CE1 3.07Å; W211-F238 HydrophobicContact CE3-CE1 3.07Å; W211-F238 HydrophobicContact CE3-CG 4.29Å; W211-F238 AromaticContact CE3-CZ 3.71Å; W211-F238 HydrophobicContact CE3-CZ 3.71Å; W211-F238 HydrophobicContact CG-CE1 4.35Å; W211-F238 HydrophobicContact CH2-CD1 4.28Å; W211-F238 AromaticContact CZ3-CD1 3.5Å; W211-F238 HydrophobicContact CZ3-CD1 3.5Å; W211-F238 HydrophobicContact CZ3-CD2 4.49Å; W211-F238 AromaticContact CZ3-CE1 3.59Å; W211-F238 HydrophobicContact CZ3-CE1 3.59Å; W211-F238 AromaticContact CZ3-CG 3.98Å; W211-F238 HydrophobicContact CZ3-CG 3.98Å; W211-F238 HydrophobicContact CZ3-CZ 4.08Å; W211-D245 PolarHBondContact NE1-OD2 2.74Å
212Y95.6Very high95.1Very high149 Ų14961.8 Ų61.858%0.58432%0.322SS*.Hα-helixtrans-60-48.4171.1176-97000110.8V208 P209 F210 S215 Y216V208-Y212 PolarHBondContact O-N 3.46Å; P209-Y212 PolarHBondContact O-N 3.12Å; F210-Y212 VanDerWaalsContact C-N 3.35Å; F210-Y212 PolarHBondContact O-N 3.31Å; Y212-S215 PolarHBondContact O-N 2.81Å; Y212-Y216 WeakPolarHBondContact O-CB 3.41Å; Y212-Y216 PolarHBondContact O-N 3.14Å
213L95.8Very high95.1Very high72 Ų7264 Ų6438%0.37733%0.334SS..Hα-helixtrans-63.3-44.8180-72.6170.9000112.2P209 F210 Y216 N217P209-L213 WeakPolarHBondContact O-CB 3.29Å; P209-L213 WeakPolarHBondContact O-CG 3.28Å; P209-L213 PolarHBondContact O-N 3.45Å; F210-L213 PolarHBondContact O-N 2.9Å; L213-Y216 PolarHBondContact O-N 2.79Å; L213-N217 PolarHBondContact O-N 3.02Å; L213-N217 PolarHBondContact O-ND2 2.86Å
214V95.5Very high95Very high0 Ų069.1 Ų69.10%036%0.358CS..Hα-helixtrans-57.4-51.4175.7172.90000110.1Y156 F210 W211 Y216 M218 F234 F238Y156-V214 HydrophobicContact CD1-CB 4.46Å; Y156-V214 HydrophobicContact CD1-CG2 3.34Å; Y156-V214 HydrophobicContact CD2-CG2 4.43Å; Y156-V214 HydrophobicContact CE1-CB 4.36Å; Y156-V214 HydrophobicContact CE1-CG2 3.65Å; Y156-V214 HydrophobicContact CG-CG2 3.77Å; F210-V214 HydrophobicContact CD1-CG2 4.43Å; F210-V214 HydrophobicContact CE1-CG2 4.01Å; F210-V214 HydrophobicContact CE2-CG2 4.3Å; F210-V214 HydrophobicContact CZ-CG2 3.94Å; F210-V214 WeakPolarHBondContact O-CG2 3.17Å; F210-V214 PolarHBondContact O-N 3.33Å; W211-V214 HydrophobicContact CE3-CB 4.46Å; V214-Y216 PolarHBondContact O-N 3.45Å; V214-M218 WeakPolarHBondContact O-CB 3.49Å; V214-M218 PolarHBondContact O-N 3.07Å; V214-F234 HydrophobicContact CG1-CD1 3.58Å; V214-F234 HydrophobicContact CG1-CE1 3.73Å; V214-F238 HydrophobicContact CG1-CE2 4.39Å; V214-F238 HydrophobicContact CG1-CZ 4.19Å
215S95.1Very high95Very high47 Ų4774.7 Ų74.733%0.32938%0.383SS..Hα-helixtrans-61-46.1-179.3-55.70000112.3W211 Y212 M218 H219 F238W211-S215 WeakPolarHBondContact O-CB 3.15Å; W211-S215 PolarHBondContact O-N 3.32Å; W211-S215 PolarHBondContact O-OG 2.97Å; Y212-S215 PolarHBondContact O-N 2.81Å; S215-M218 PolarHBondContact O-N 3.24Å; S215-H219 WeakPolarHBondContact O-CB 3.07Å; S215-H219 PolarHBondContact O-N 3.3Å; S215-F238 VanDerWaalsContact OG-CZ 3.31Å; S215-F238 WeakPolarHBondContact OG-CZ 3.5Å
216Y96Very high94.9Very high108 Ų10873.1 Ų73.142%0.42437%0.373SS..Hα-helixtrans-62.7-53.5-177.4177.5-93.1000111.5Y212 L213 V214 M218 H219 H220Y212-Y216 WeakPolarHBondContact O-CB 3.41Å; Y212-Y216 PolarHBondContact O-N 3.14Å; L213-Y216 PolarHBondContact O-N 2.79Å; V214-Y216 PolarHBondContact O-N 3.45Å; Y216-M218 VanDerWaalsContact C-N 3.29Å; Y216-M218 PolarHBondContact O-N 3.26Å; Y216-H219 PolarHBondContact O-N 3.41Å; Y216-H220 AromaticContact CD2-CE1 3.64Å; Y216-H220 AromaticContact CD2-ND1 3.67Å; Y216-H220 AromaticContact CE2-CE1 3.43Å; Y216-H220 VanDerWaalsContact CE2-CE1 3.43Å; Y216-H220 WeakPolarHBondContact CE2-CE1 3.37Å; Y216-H220 AromaticContact CE2-ND1 3.63Å; Y216-H220 AromaticContact CE2-NE2 3.99Å; Y216-H220 WeakPolarHBondContact O-CB 3.41Å; Y216-H220 PolarHBondContact O-N 3.13Å; Y216-H220 PolarHBondContact O-ND1 3.29Å
217N95.3Very high94.9Very high32 Ų3273.3 Ų73.317%0.17137%0.366CS..Hα-helixtrans-66.1-34.9-178.7-69.6-78.6000111.2K95 F96 Y156 L213 H221K95-N217 PolarHBondContact NZ-OD1 3.49Å; K95-N217 VanDerWaalsContact NZ-OD1 3.17Å; F96-N217 HydrophobicContact CE2-CB 3.68Å; F96-N217 HydrophobicContact CZ-CB 4.07Å; Y156-N217 WeakPolarHBondContact OH-CB 3.35Å; Y156-N217 PolarHBondContact OH-ND2 3.41Å; L213-N217 PolarHBondContact O-N 3.02Å; L213-N217 PolarHBondContact O-ND2 2.86Å; N217-H221 PolarHBondContact O-N 2.71Å
218M94.9Very high94.9Very high18 Ų1877.8 Ų77.89%0.08939%0.387CS..Hα-helixtrans-66.8-46.8177.5-177.5174.26300111.4F96 V214 S215 Y216 H220 H221 R227 L230 I231 F234 F238F96-M218 HydrophobicContact CE1-CB 4.35Å; F96-M218 HydrophobicContact CE2-CB 4.25Å; F96-M218 HydrophobicContact CZ-CB 3.66Å; V214-M218 WeakPolarHBondContact O-CB 3.49Å; V214-M218 PolarHBondContact O-N 3.07Å; S215-M218 PolarHBondContact O-N 3.24Å; Y216-M218 VanDerWaalsContact C-N 3.29Å; Y216-M218 PolarHBondContact O-N 3.26Å; M218-H220 VanDerWaalsContact C-N 3.31Å; M218-H220 PolarHBondContact O-N 3.17Å; M218-H221 WeakPolarHBondContact O-CB 3.47Å; M218-H221 PolarHBondContact O-N 2.73Å; M218-R227 WeakPolarHBondContact O-CG 3.31Å; M218-L230 HydrophobicContact CG-CB 3.8Å; M218-L230 VanDerWaalsContact SD-C 3.56Å; M218-L230 HydrophobicContact SD-CB 4Å; M218-I231 HydrophobicContact CE-CG1 4.02Å; M218-I231 HydrophobicContact CG-CG1 4.05Å; M218-I231 HydrophobicContact SD-CB 4.44Å; M218-I231 HydrophobicContact SD-CG1 3.9Å; M218-F234 HydrophobicContact CE-CB 4.42Å; M218-F234 HydrophobicContact SD-CB 3.74Å; M218-F234 HydrophobicContact SD-CD2 4.43Å; M218-F234 HydrophobicContact SD-CG 4.17Å; M218-F238 HydrophobicContact CE-CE2 4.13Å
219H93.8Very high95Very high127 Ų12776.6 Ų76.659%0.58837%0.373SS*.Hα-helixtrans-68.2-32.2-178.7-168.571.7000112.7S215 Y216 H221 R227S215-H219 WeakPolarHBondContact O-CB 3.07Å; S215-H219 PolarHBondContact O-N 3.3Å; Y216-H219 PolarHBondContact O-N 3.41Å; H219-H221 VanDerWaalsContact C-N 3.31Å; H219-R227 VanDerWaalsContact O-CD 3.24Å; H219-R227 WeakPolarHBondContact O-CD 3.3Å
220H94.2Very high94.9Very high116 Ų11673.7 Ų73.754%0.53735%0.354SS..THydrogen-bonded Turntrans-92.113.6177.4-63.982.4000113.3Y216 M218 S222Y216-H220 AromaticContact CD2-CE1 3.64Å; Y216-H220 AromaticContact CD2-ND1 3.67Å; Y216-H220 AromaticContact CE2-CE1 3.43Å; Y216-H220 VanDerWaalsContact CE2-CE1 3.43Å; Y216-H220 WeakPolarHBondContact CE2-CE1 3.37Å; Y216-H220 AromaticContact CE2-ND1 3.63Å; Y216-H220 AromaticContact CE2-NE2 3.99Å; Y216-H220 WeakPolarHBondContact O-CB 3.41Å; Y216-H220 PolarHBondContact O-N 3.13Å; Y216-H220 PolarHBondContact O-ND1 3.29Å; M218-H220 VanDerWaalsContact C-N 3.31Å; M218-H220 PolarHBondContact O-N 3.17Å; H220-S222 PolarHBondContact O-N 3.27Å
221H94.5Very high94.8Very high28 Ų2874.8 Ų74.813%0.1336%0.361CS..  trans-63.3126.4173.6-159.3-70.4000109.6F96 F97 N217 M218 H219 Q226 R227F96-H221 AromaticContact CD2-CD2 3.89Å; F97-H221 AromaticContact CD2-NE2 3.99Å; F97-H221 AromaticContact CE2-NE2 3.63Å; N217-H221 PolarHBondContact O-N 2.71Å; M218-H221 WeakPolarHBondContact O-CB 3.47Å; M218-H221 PolarHBondContact O-N 2.73Å; H219-H221 VanDerWaalsContact C-N 3.31Å; H221-Q226 PolarHBondContact CE1-OE1 3.4Å; H221-R227 HydrophobicContact CB-CB 4.16Å; H221-R227 PolarHBondContact O-NH1 3.43Å
222S92.1Very high94.6Very high117 Ų11774.9 Ų74.982%0.81837%0.374SS*.SBendtrans-64.8-43.7-169.153.60000112.6H220H220-S222 PolarHBondContact O-N 3.27Å
223N95.5Very high94.3Very high66 Ų6669 Ų6935%0.35335%0.354SS..SBendtrans-78.2122.6175.5-177.4-52000110.8E225 Q226 R227N223-E225 WeakPolarHBondContact OD1-CB 3.45Å; N223-E225 PolarHBondContact OD1-N 3.24Å; N223-Q226 HydrophobicContact CB-CB 4.09Å; N223-Q226 HydrophobicContact CB-CG 4.26Å; N223-Q226 VanDerWaalsContact CB-OE1 3.29Å; N223-Q226 PolarHBondContact OD1-N 3.17Å; N223-R227 WeakPolarHBondContact O-CB 3.28Å; N223-R227 PolarHBondContact O-N 3.22Å
224E94.9Very high94.1Very high123 Ų12366 Ų6658%0.57534%0.338SS*.Hα-helixtrans-67.9-40.8-177.7174.4163.6-153.600113.9R227 I228E224-R227 VanDerWaalsContact CG-NH2 3.35Å; E224-R227 WeakPolarHBondContact O-CB 3.41Å; E224-R227 PolarHBondContact O-N 3.3Å; E224-R227 IonicContact OE1-NH2 3.99Å; E224-I228 HydrophobicContact CG-CD1 3.98Å; E224-I228 WeakPolarHBondContact O-CG1 3.31Å; E224-I228 PolarHBondContact O-N 2.87Å
225E95Very high93.9Very high155 Ų15572.2 Ų72.272%0.72437%0.365SS*.Hα-helixtrans-64.1-47.8179.4-174.5-178-178.500110.6N223 R227 I228 F229N223-E225 WeakPolarHBondContact OD1-CB 3.45Å; N223-E225 PolarHBondContact OD1-N 3.24Å; E225-R227 VanDerWaalsContact C-N 3.3Å; E225-R227 PolarHBondContact O-N 3.28Å; E225-I228 PolarHBondContact O-N 3.45Å; E225-F229 PolarHBondContact O-N 2.88Å
226Q94.8Very high93.6Very high72 Ų7274.3 Ų74.334%0.33637%0.371SS..Hα-helixtrans-60.9-39.7174.1-72.8178.3-31.300111.4F97 H221 N223 F229 L230F97-Q226 HydrophobicContact CE2-CB 3.93Å; F97-Q226 HydrophobicContact CE2-CG 4.11Å; F97-Q226 HydrophobicContact CZ-CB 3.78Å; F97-Q226 HydrophobicContact CZ-CG 3.9Å; H221-Q226 PolarHBondContact CE1-OE1 3.4Å; N223-Q226 HydrophobicContact CB-CB 4.09Å; N223-Q226 HydrophobicContact CB-CG 4.26Å; N223-Q226 VanDerWaalsContact CB-OE1 3.29Å; N223-Q226 PolarHBondContact OD1-N 3.17Å; Q226-F229 PolarHBondContact O-N 2.97Å; Q226-L230 WeakPolarHBondContact O-CB 3.43Å; Q226-L230 WeakPolarHBondContact O-CG 3.34Å; Q226-L230 PolarHBondContact O-N 2.86Å
227R95.3Very high93.4Very high59 Ų5970.3 Ų70.322%0.22336%0.356CS..Hα-helixtrans-60.6-46.2175.6-178.1172.465-119.61.7112M218 H219 H221 N223 E224 E225 L230 I231M218-R227 WeakPolarHBondContact O-CG 3.31Å; H219-R227 VanDerWaalsContact O-CD 3.24Å; H219-R227 WeakPolarHBondContact O-CD 3.3Å; H221-R227 HydrophobicContact CB-CB 4.16Å; H221-R227 PolarHBondContact O-NH1 3.43Å; N223-R227 WeakPolarHBondContact O-CB 3.28Å; N223-R227 PolarHBondContact O-N 3.22Å; E224-R227 VanDerWaalsContact CG-NH2 3.35Å; E224-R227 WeakPolarHBondContact O-CB 3.41Å; E224-R227 PolarHBondContact O-N 3.3Å; E224-R227 IonicContact OE1-NH2 3.99Å; E225-R227 VanDerWaalsContact C-N 3.3Å; E225-R227 PolarHBondContact O-N 3.28Å; R227-L230 PolarHBondContact O-N 3.37Å; R227-I231 HydrophobicContact CG-CD1 3.94Å; R227-I231 WeakPolarHBondContact O-CB 2.99Å; R227-I231 VanDerWaalsContact O-CG1 3.26Å; R227-I231 WeakPolarHBondContact O-CG1 3.47Å; R227-I231 PolarHBondContact O-N 2.85Å
228I95.2Very high93.2Very high105 Ų10571.2 Ų71.254%0.53836%0.358SS..Hα-helixtrans-63.1-44.3178.2-68.9167.3000110.4E224 E225 I231 G232E224-I228 HydrophobicContact CG-CD1 3.98Å; E224-I228 WeakPolarHBondContact O-CG1 3.31Å; E224-I228 PolarHBondContact O-N 2.87Å; E225-I228 PolarHBondContact O-N 3.45Å; I228-I231 PolarHBondContact O-N 3.41Å; I228-G232 PolarHBondContact O-N 3.14Å
229F94Very high93.1Very high85 Ų8575.4 Ų75.437%0.37338%0.38SS..Hα-helixtrans-57.8-51.2174.5171.5-101.8000111.7F97 N150 I152 E225 Q226 I231 G232 V233F97-F229 HydrophobicContact CE1-CD1 4.06Å; F97-F229 HydrophobicContact CE1-CE1 4.09Å; F97-F229 HydrophobicContact CZ-CD1 4.27Å; N150-F229 HydrophobicContact CB-CZ 4.46Å; I152-F229 HydrophobicContact CD1-CE1 4.11Å; I152-F229 HydrophobicContact CG2-CE1 4.02Å; E225-F229 PolarHBondContact O-N 2.88Å; Q226-F229 PolarHBondContact O-N 2.97Å; F229-I231 VanDerWaalsContact C-N 3.34Å; F229-I231 PolarHBondContact O-N 3.33Å; F229-G232 PolarHBondContact O-N 3.2Å; F229-G232 VanDerWaalsContact O-N 3.1Å; F229-V233 HydrophobicContact CD2-CG2 4.09Å; F229-V233 HydrophobicContact CE1-CG2 4.21Å; F229-V233 HydrophobicContact CE2-CG2 3.65Å; F229-V233 HydrophobicContact CZ-CG2 3.73Å; F229-V233 WeakPolarHBondContact O-CG2 3.42Å; F229-V233 PolarHBondContact O-N 3.07Å
230L94.5Very high93.2Very high0 Ų070.1 Ų70.10%036%0.356CS..Hα-helixtrans-58.8-45.1178.7-71.2173.3000111.3F96 F97 I152 M218 Q226 R227 G232 V233 F234F96-L230 HydrophobicContact CB-CD1 3.91Å; F96-L230 HydrophobicContact CB-CD2 3.9Å; F96-L230 HydrophobicContact CD1-CD1 3.94Å; F96-L230 HydrophobicContact CD1-CD2 3.67Å; F96-L230 HydrophobicContact CD1-CG 4.4Å; F96-L230 HydrophobicContact CD2-CD1 3.73Å; F96-L230 HydrophobicContact CE1-CD1 4.4Å; F96-L230 HydrophobicContact CE1-CD2 4.43Å; F96-L230 HydrophobicContact CE2-CD1 4.2Å; F96-L230 HydrophobicContact CG-CD1 3.58Å; F96-L230 HydrophobicContact CG-CD2 3.9Å; F96-L230 HydrophobicContact CG-CG 4.4Å; F97-L230 HydrophobicContact CE1-CD2 4.29Å; F97-L230 HydrophobicContact CE2-CD1 3.8Å; F97-L230 HydrophobicContact CE2-CD2 4.21Å; F97-L230 HydrophobicContact CE2-CG 4.13Å; F97-L230 HydrophobicContact CZ-CD1 3.96Å; F97-L230 HydrophobicContact CZ-CD2 3.77Å; F97-L230 HydrophobicContact CZ-CG 3.75Å; I152-L230 HydrophobicContact CD1-CD2 4.25Å; M218-L230 HydrophobicContact CG-CB 3.8Å; M218-L230 VanDerWaalsContact SD-C 3.56Å; M218-L230 HydrophobicContact SD-CB 4Å; Q226-L230 WeakPolarHBondContact O-CB 3.43Å; Q226-L230 WeakPolarHBondContact O-CG 3.34Å; Q226-L230 PolarHBondContact O-N 2.86Å; R227-L230 PolarHBondContact O-N 3.37Å; L230-G232 VanDerWaalsContact C-N 3.31Å; L230-G232 PolarHBondContact O-N 3.04Å; L230-V233 PolarHBondContact O-N 3.46Å; L230-F234 HydrophobicContact CD2-CD2 4.25Å; L230-F234 HydrophobicContact CD2-CE2 4.03Å; L230-F234 VanDerWaalsContact O-CB 3.27Å; L230-F234 WeakPolarHBondContact O-CB 3.46Å; L230-F234 WeakPolarHBondContact O-CD2 3.49Å; L230-F234 PolarHBondContact O-N 2.8Å
231I93.4Very high93.2Very high53 Ų5364.8 Ų64.827%0.27233%0.332SS..Hα-helixtrans-59.9-42.8176.2-71.1166.9000111M218 R227 I228 F229 K235M218-I231 HydrophobicContact CE-CG1 4.02Å; M218-I231 HydrophobicContact CG-CG1 4.05Å; M218-I231 HydrophobicContact SD-CB 4.44Å; M218-I231 HydrophobicContact SD-CG1 3.9Å; R227-I231 HydrophobicContact CG-CD1 3.94Å; R227-I231 WeakPolarHBondContact O-CB 2.99Å; R227-I231 VanDerWaalsContact O-CG1 3.26Å; R227-I231 WeakPolarHBondContact O-CG1 3.47Å; R227-I231 PolarHBondContact O-N 2.85Å; I228-I231 PolarHBondContact O-N 3.41Å; F229-I231 VanDerWaalsContact C-N 3.34Å; F229-I231 PolarHBondContact O-N 3.33Å; I231-K235 HydrophobicContact CG2-CD 4.49Å; I231-K235 WeakPolarHBondContact O-CD 3.49Å; I231-K235 WeakPolarHBondContact O-CG 3.45Å; I231-K235 PolarHBondContact O-N 3.16Å
232G91.9Very high93.2Very high41 Ų4168 Ų6842%0.42335%0.349SS..Hα-helixtrans-59.8-49.4177.400000112I228 F229 L230I228-G232 PolarHBondContact O-N 3.14Å; F229-G232 PolarHBondContact O-N 3.2Å; F229-G232 VanDerWaalsContact O-N 3.1Å; L230-G232 VanDerWaalsContact C-N 3.31Å; L230-G232 PolarHBondContact O-N 3.04Å
233V89.5Confident93.3Very high25 Ų2565.6 Ų65.615%0.15233%0.327CS..Hα-helixtrans-72.8-49.7-176.5176.60000111.4I152 F229 L230 K235 I236 Y237I152-V233 HydrophobicContact CD1-CB 4.16Å; I152-V233 HydrophobicContact CD1-CG1 3.56Å; F229-V233 HydrophobicContact CD2-CG2 4.09Å; F229-V233 HydrophobicContact CE1-CG2 4.21Å; F229-V233 HydrophobicContact CE2-CG2 3.65Å; F229-V233 HydrophobicContact CZ-CG2 3.73Å; F229-V233 WeakPolarHBondContact O-CG2 3.42Å; F229-V233 PolarHBondContact O-N 3.07Å; L230-V233 PolarHBondContact O-N 3.46Å; V233-K235 VanDerWaalsContact C-N 3.25Å; V233-K235 PolarHBondContact O-N 3.33Å; V233-I236 PolarHBondContact O-N 3.17Å; V233-I236 VanDerWaalsContact O-N 3.15Å; V233-Y237 HydrophobicContact CG1-CD2 4.09Å; V233-Y237 HydrophobicContact CG1-CE2 3.49Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.49Å; V233-Y237 VanDerWaalsContact O-CD2 3.27Å; V233-Y237 WeakPolarHBondContact O-CD2 3.21Å
234F91.3Very high93.4Very high8 Ų863.4 Ų63.44%0.03532%0.315CS..Hα-helixtrans-64.9-21.1-178.1-87.2-98.7000114.2F96 I152 Y156 V214 M218 L230 I236 Y237 F238F96-F234 AromaticContact CD1-CE2 3.79Å; F96-F234 HydrophobicContact CD1-CE2 3.79Å; F96-F234 AromaticContact CD1-CZ 3.93Å; F96-F234 HydrophobicContact CD1-CZ 3.93Å; F96-F234 HydrophobicContact CE1-CD2 4.44Å; F96-F234 HydrophobicContact CE1-CE1 4.36Å; F96-F234 AromaticContact CE1-CE2 3.83Å; F96-F234 HydrophobicContact CE1-CE2 3.83Å; F96-F234 AromaticContact CE1-CZ 3.78Å; F96-F234 HydrophobicContact CE1-CZ 3.78Å; I152-F234 HydrophobicContact CD1-CD2 4.48Å; I152-F234 HydrophobicContact CD1-CE2 4.01Å; Y156-F234 HydrophobicContact CD2-CZ 4.48Å; V214-F234 HydrophobicContact CG1-CD1 3.58Å; V214-F234 HydrophobicContact CG1-CE1 3.73Å; M218-F234 HydrophobicContact CE-CB 4.42Å; M218-F234 HydrophobicContact SD-CB 3.74Å; M218-F234 HydrophobicContact SD-CD2 4.43Å; M218-F234 HydrophobicContact SD-CG 4.17Å; L230-F234 HydrophobicContact CD2-CD2 4.25Å; L230-F234 HydrophobicContact CD2-CE2 4.03Å; L230-F234 VanDerWaalsContact O-CB 3.27Å; L230-F234 WeakPolarHBondContact O-CB 3.46Å; L230-F234 WeakPolarHBondContact O-CD2 3.49Å; L230-F234 PolarHBondContact O-N 2.8Å; F234-I236 PolarHBondContact O-N 2.74Å; F234-Y237 CarbonylContact O-C 3.57Å; F234-Y237 WeakPolarHBondContact O-CA 3.32Å; F234-Y237 WeakPolarHBondContact O-CB 3.42Å; F234-Y237 PolarHBondContact O-N 2.89Å; F234-F238 HydrophobicContact CB-CD2 4.42Å; F234-F238 HydrophobicContact CB-CE2 4.38Å; F234-F238 WeakPolarHBondContact O-CD2 3.44Å; F234-F238 PolarHBondContact O-N 3.32Å
235K90.2Very high93.4Very high132 Ų13258.8 Ų58.857%0.57429%0.294SS*.Hα-helixtrans-52.9-42.8170.1-85.4167.7-178.4-178.50112.4I231 V233 F238 I239I231-K235 HydrophobicContact CG2-CD 4.49Å; I231-K235 WeakPolarHBondContact O-CD 3.49Å; I231-K235 WeakPolarHBondContact O-CG 3.45Å; I231-K235 PolarHBondContact O-N 3.16Å; V233-K235 VanDerWaalsContact C-N 3.25Å; V233-K235 PolarHBondContact O-N 3.33Å; K235-F238 PolarHBondContact O-N 2.9Å; K235-I239 WeakPolarHBondContact O-CG1 3.21Å; K235-I239 PolarHBondContact O-N 2.93Å
236I88.9Confident93.5Very high90 Ų9056.5 Ų56.546%0.46229%0.286SS..Hα-helixtrans-67.9-41.2177.9-60.2174.5000109.9V233 F234 F238 I239 L240V233-I236 PolarHBondContact O-N 3.17Å; V233-I236 VanDerWaalsContact O-N 3.15Å; F234-I236 PolarHBondContact O-N 2.74Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.17Å; I236-I239 WeakPolarHBondContact O-CB 3.31Å; I236-I239 PolarHBondContact O-N 2.96Å; I236-I239 VanDerWaalsContact O-N 3.16Å; I236-L240 HydrophobicContact CG2-CD1 4.36Å; I236-L240 HydrophobicContact CG2-CG 4.49Å; I236-L240 WeakPolarHBondContact O-CG 3.17Å; I236-L240 PolarHBondContact O-N 3.23Å
237Y91.7Very high93.6Very high24 Ų2453.8 Ų53.89%0.09427%0.274CS..Hα-helixtrans-64.8-34.2176.8-69.4-85.6000113.5G143 A146 L147 W211 V233 F234 I239 L240 G241G143-Y237 WeakPolarHBondContact O-CE1 3.39Å; A146-Y237 WeakPolarHBondContact CA-OH 3.22Å; A146-Y237 HydrophobicContact CB-CE1 4.43Å; A146-Y237 WeakPolarHBondContact CB-OH 3.41Å; A146-Y237 PolarHBondContact O-OH 2.88Å; L147-Y237 WeakPolarHBondContact CA-OH 3.18Å; L147-Y237 HydrophobicContact CD1-CE1 4.15Å; L147-Y237 HydrophobicContact CD2-CD1 4.42Å; L147-Y237 HydrophobicContact CD2-CE1 3.64Å; L147-Y237 HydrophobicContact CD2-CE2 4.17Å; L147-Y237 VanDerWaalsContact CD2-CZ 3.45Å; L147-Y237 VanDerWaalsContact CD2-OH 3.3Å; L147-Y237 WeakPolarHBondContact CD2-OH 3.24Å; L147-Y237 HydrophobicContact CG-CE1 3.53Å; L147-Y237 VanDerWaalsContact CG-OH 3.31Å; L147-Y237 WeakPolarHBondContact CG-OH 3.33Å; L147-Y237 PolarHBondContact N-OH 3.18Å; W211-Y237 WeakPolarHBondContact CH2-O 3.1Å; V233-Y237 HydrophobicContact CG1-CD2 4.09Å; V233-Y237 HydrophobicContact CG1-CE2 3.49Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.49Å; V233-Y237 VanDerWaalsContact O-CD2 3.27Å; V233-Y237 WeakPolarHBondContact O-CD2 3.21Å; F234-Y237 CarbonylContact O-C 3.57Å; F234-Y237 WeakPolarHBondContact O-CA 3.32Å; F234-Y237 WeakPolarHBondContact O-CB 3.42Å; F234-Y237 PolarHBondContact O-N 2.89Å; Y237-I239 VanDerWaalsContact C-N 3.33Å; Y237-L240 PolarHBondContact O-N 2.9Å; Y237-G241 WeakPolarHBondContact O-CA 3.49Å; Y237-G241 PolarHBondContact O-N 3.5Å
238F92.4Very high93.6Very high51 Ų5151.3 Ų51.322%0.22426%0.264CS..Hα-helixtrans-61.7-43172.2-87.6-73.9000111.1W211 V214 S215 M218 F234 K235 I236 G241 I242W211-F238 HydrophobicContact CB-CE1 4.35Å; W211-F238 HydrophobicContact CD2-CD1 4.04Å; W211-F238 AromaticContact CD2-CE1 3.8Å; W211-F238 HydrophobicContact CD2-CE1 3.8Å; W211-F238 AromaticContact CE3-CD1 3.4Å; W211-F238 HydrophobicContact CE3-CD1 3.4Å; W211-F238 VanDerWaalsContact CE3-CD1 3.4Å; W211-F238 AromaticContact CE3-CE1 3.07Å; W211-F238 HydrophobicContact CE3-CE1 3.07Å; W211-F238 HydrophobicContact CE3-CG 4.29Å; W211-F238 AromaticContact CE3-CZ 3.71Å; W211-F238 HydrophobicContact CE3-CZ 3.71Å; W211-F238 HydrophobicContact CG-CE1 4.35Å; W211-F238 HydrophobicContact CH2-CD1 4.28Å; W211-F238 AromaticContact CZ3-CD1 3.5Å; W211-F238 HydrophobicContact CZ3-CD1 3.5Å; W211-F238 HydrophobicContact CZ3-CD2 4.49Å; W211-F238 AromaticContact CZ3-CE1 3.59Å; W211-F238 HydrophobicContact CZ3-CE1 3.59Å; W211-F238 AromaticContact CZ3-CG 3.98Å; W211-F238 HydrophobicContact CZ3-CG 3.98Å; W211-F238 HydrophobicContact CZ3-CZ 4.08Å; V214-F238 HydrophobicContact CG1-CE2 4.39Å; V214-F238 HydrophobicContact CG1-CZ 4.19Å; S215-F238 VanDerWaalsContact OG-CZ 3.31Å; S215-F238 WeakPolarHBondContact OG-CZ 3.5Å; M218-F238 HydrophobicContact CE-CE2 4.13Å; F234-F238 HydrophobicContact CB-CD2 4.42Å; F234-F238 HydrophobicContact CB-CE2 4.38Å; F234-F238 WeakPolarHBondContact O-CD2 3.44Å; F234-F238 PolarHBondContact O-N 3.32Å; K235-F238 PolarHBondContact O-N 2.9Å; I236-F238 VanDerWaalsContact C-N 3.33Å; I236-F238 PolarHBondContact O-N 3.17Å; F238-G241 PolarHBondContact O-N 2.75Å; F238-I242 VanDerWaalsContact O-CG1 3.28Å; F238-I242 WeakPolarHBondContact O-CG1 3.21Å; F238-I242 PolarHBondContact O-N 2.82Å
239I93Very high93.7Very high107 Ų10751.6 Ų51.655%0.54927%0.267SS..Hα-helixtrans-63.3-50.6177.4-64.3167.1000110.6K235 I236 Y237 G241 I242 I243K235-I239 WeakPolarHBondContact O-CG1 3.21Å; K235-I239 PolarHBondContact O-N 2.93Å; I236-I239 WeakPolarHBondContact O-CB 3.31Å; I236-I239 PolarHBondContact O-N 2.96Å; I236-I239 VanDerWaalsContact O-N 3.16Å; Y237-I239 VanDerWaalsContact C-N 3.33Å; I239-G241 PolarHBondContact O-N 2.99Å; I239-I242 PolarHBondContact O-N 3.34Å; I239-I243 WeakPolarHBondContact O-CG1 3.27Å; I239-I243 PolarHBondContact O-N 3.06Å
240L94.4Very high93.9Very high16 Ų1651.9 Ų51.98%0.08427%0.268CS..Hα-helixtrans-57.2-40.7175.2-69.9-177.3000111.6V139 W142 I236 Y237 I243 L244V139-L240 HydrophobicContact CG1-CB 3.74Å; V139-L240 HydrophobicContact CG1-CD2 4.06Å; V139-L240 HydrophobicContact CG1-CG 4.34Å; V139-L240 HydrophobicContact CG2-CD2 4.29Å; W142-L240 HydrophobicContact CE3-CD2 4.32Å; W142-L240 HydrophobicContact CG-CD1 4.29Å; I236-L240 HydrophobicContact CG2-CD1 4.36Å; I236-L240 HydrophobicContact CG2-CG 4.49Å; I236-L240 WeakPolarHBondContact O-CG 3.17Å; I236-L240 PolarHBondContact O-N 3.23Å; Y237-L240 PolarHBondContact O-N 2.9Å; L240-I243 WeakPolarHBondContact O-CB 3.48Å; L240-I243 PolarHBondContact O-N 3.04Å; L240-L244 PolarHBondContact O-N 3.46Å; L240-L244 VanDerWaalsContact O-N 3.16Å
241G94.3Very high94Very high4 Ų453.4 Ų53.44%0.04127%0.274CS..Hα-helixtrans-59-48.5175.600000114Y237 F238 I239 I243 L244 D245Y237-G241 WeakPolarHBondContact O-CA 3.49Å; Y237-G241 PolarHBondContact O-N 3.5Å; F238-G241 PolarHBondContact O-N 2.75Å; I239-G241 PolarHBondContact O-N 2.99Å; G241-I243 VanDerWaalsContact C-N 3.29Å; G241-I243 PolarHBondContact O-N 3.23Å; G241-L244 PolarHBondContact O-N 2.9Å; G241-L244 VanDerWaalsContact O-N 3.17Å; G241-D245 VanDerWaalsContact O-CG 3.25Å; G241-D245 PolarHBondContact O-N 3.02Å
242I94.1Very high94.2Very high95 Ų9551.1 Ų51.149%0.48726%0.263SS..Hα-helixtrans-59.8-41.2177-71.8163.8000110.6F238 I239 L244 D245 I246F238-I242 VanDerWaalsContact O-CG1 3.28Å; F238-I242 WeakPolarHBondContact O-CG1 3.21Å; F238-I242 PolarHBondContact O-N 2.82Å; I239-I242 PolarHBondContact O-N 3.34Å; I242-L244 VanDerWaalsContact C-N 3.34Å; I242-L244 PolarHBondContact O-N 3.47Å; I242-D245 PolarHBondContact O-N 3.01Å; I242-I246 HydrophobicContact CG2-CD1 3.78Å; I242-I246 HydrophobicContact CG2-CG1 4.32Å; I242-I246 VanDerWaalsContact O-CG1 3.28Å; I242-I246 WeakPolarHBondContact O-CG1 3.28Å; I242-I246 PolarHBondContact O-N 3.44Å
243I96Very high94.4Very high67 Ų6757.5 Ų57.534%0.34428%0.279SS..Hα-helixtrans-59.3-47176.5-64.6167.6000110.4I135 V139 I239 L240 G241 L247I135-I243 HydrophobicContact CG2-CG2 3.72Å; V139-I243 HydrophobicContact CG2-CB 4.49Å; V139-I243 HydrophobicContact CG2-CG2 4.02Å; I239-I243 WeakPolarHBondContact O-CG1 3.27Å; I239-I243 PolarHBondContact O-N 3.06Å; L240-I243 WeakPolarHBondContact O-CB 3.48Å; L240-I243 PolarHBondContact O-N 3.04Å; G241-I243 VanDerWaalsContact C-N 3.29Å; G241-I243 PolarHBondContact O-N 3.23Å; I243-L247 PolarHBondContact O-N 3.42Å; I243-L247 VanDerWaalsContact O-N 3.14Å
244L96.1Very high94.7Very high19 Ų1960.2 Ų60.210%0.09929%0.292CS..Hα-helixtrans-64.2-39.3176.7-71.3177.3000112.4H136 V139 L240 G241 I242 L247 N248H136-L244 WeakPolarHBondContact ND1-CD2 3.46Å; V139-L244 HydrophobicContact CB-CD2 4.1Å; V139-L244 HydrophobicContact CB-CG 4.22Å; V139-L244 HydrophobicContact CG1-CD1 3.75Å; V139-L244 HydrophobicContact CG1-CD2 4.07Å; V139-L244 HydrophobicContact CG1-CG 3.63Å; L240-L244 PolarHBondContact O-N 3.46Å; L240-L244 VanDerWaalsContact O-N 3.16Å; G241-L244 PolarHBondContact O-N 2.9Å; G241-L244 VanDerWaalsContact O-N 3.17Å; I242-L244 VanDerWaalsContact C-N 3.34Å; I242-L244 PolarHBondContact O-N 3.47Å; L244-L247 WeakPolarHBondContact O-CB 3.49Å; L244-L247 PolarHBondContact O-N 3.27Å; L244-N248 WeakPolarHBondContact O-CB 3.46Å; L244-N248 VanDerWaalsContact O-CG 3.23Å; L244-N248 PolarHBondContact O-N 3.25Å; L244-N248 PolarHBondContact O-ND2 3.21Å; L244-N248 VanDerWaalsContact O-ND2 3.1Å
245D95.3Very high95Very high26 Ų2660.3 Ų60.314%0.13929%0.293CS..Hα-helixtrans-71.6-37.2-178-67-16.9000111.7K160 W211 G241 I242 L247 N248 L249K160-D245 IonicContact NZ-OD1 3.79Å; K160-D245 PolarHBondContact NZ-OD1 3.35Å; W211-D245 PolarHBondContact NE1-OD2 2.74Å; G241-D245 VanDerWaalsContact O-CG 3.25Å; G241-D245 PolarHBondContact O-N 3.02Å; I242-D245 PolarHBondContact O-N 3.01Å; D245-L247 VanDerWaalsContact C-N 3.29Å; D245-L247 PolarHBondContact O-N 3.43Å; D245-N248 PolarHBondContact O-N 3.29Å; D245-L249 WeakPolarHBondContact O-CB 3.49Å; D245-L249 VanDerWaalsContact O-CG 3.28Å; D245-L249 WeakPolarHBondContact O-CG 3.43Å; D245-L249 PolarHBondContact O-N 3.15Å
246I96.5Very high95.3Very high107 Ų10757.2 Ų57.255%0.54929%0.287SS..Hα-helixtrans-58.4-45.2170-70.6167.9000110.1I242 L249 F250I242-I246 HydrophobicContact CG2-CD1 3.78Å; I242-I246 HydrophobicContact CG2-CG1 4.32Å; I242-I246 VanDerWaalsContact O-CG1 3.28Å; I242-I246 WeakPolarHBondContact O-CG1 3.28Å; I242-I246 PolarHBondContact O-N 3.44Å; I246-L249 PolarHBondContact O-N 3Å; I246-F250 PolarHBondContact O-N 2.81Å
247L96.9Very high95.6Very high16 Ų1656 Ų568%0.08429%0.286CS..Hα-helixtrans-64.4-41.9178.3-173.761.7000112T132 H136 I243 L244 D245 L249 F250 W251T132-L247 HydrophobicContact CG2-CD1 3.7Å; T132-L247 WeakPolarHBondContact O-CD2 3.49Å; H136-L247 HydrophobicContact CB-CD2 3.81Å; I243-L247 PolarHBondContact O-N 3.42Å; I243-L247 VanDerWaalsContact O-N 3.14Å; L244-L247 WeakPolarHBondContact O-CB 3.49Å; L244-L247 PolarHBondContact O-N 3.27Å; D245-L247 VanDerWaalsContact C-N 3.29Å; D245-L247 PolarHBondContact O-N 3.43Å; L247-L249 VanDerWaalsContact C-N 3.33Å; L247-L249 PolarHBondContact O-N 3.07Å; L247-F250 HydrophobicContact CD1-CD1 4.49Å; L247-F250 WeakPolarHBondContact O-CB 3.27Å; L247-F250 PolarHBondContact O-N 3.29Å; L247-W251 HydrophobicContact CD1-CD2 4.21Å; L247-W251 HydrophobicContact CD1-CH2 4.31Å; L247-W251 HydrophobicContact CD1-CZ2 3.88Å; L247-W251 HydrophobicContact CD2-CE3 4.34Å; L247-W251 HydrophobicContact CD2-CH2 3.35Å; L247-W251 HydrophobicContact CD2-CZ2 3.73Å; L247-W251 HydrophobicContact CD2-CZ3 3.68Å; L247-W251 HydrophobicContact CG-CD2 3.97Å; L247-W251 HydrophobicContact CG-CE3 3.85Å; L247-W251 HydrophobicContact CG-CH2 3.71Å; L247-W251 HydrophobicContact CG-CZ2 3.8Å; L247-W251 HydrophobicContact CG-CZ3 3.71Å; L247-W251 PolarHBondContact O-N 2.87Å
248N97.1Very high95.8Very high6 Ų657.3 Ų57.33%0.03229%0.294CS..Hα-helixtrans-66.8-31.8176.4-72.9-37.2000112.6F199 R203 N204 L244 D245 G252F199-N248 HydrophobicContact CZ-CB 4.45Å; R203-N248 HydrophobicContact CB-CB 4.16Å; R203-N248 PolarHBondContact NH1-OD1 3.4Å; N204-N248 PolarHBondContact ND2-O 3.49Å; N204-N248 VanDerWaalsContact ND2-O 3.13Å; L244-N248 WeakPolarHBondContact O-CB 3.46Å; L244-N248 VanDerWaalsContact O-CG 3.23Å; L244-N248 PolarHBondContact O-N 3.25Å; L244-N248 PolarHBondContact O-ND2 3.21Å; L244-N248 VanDerWaalsContact O-ND2 3.1Å; D245-N248 PolarHBondContact O-N 3.29Å; N248-G252 WeakPolarHBondContact O-CA 3.45Å; N248-G252 PolarHBondContact O-N 2.75Å
249L97Very high96Very high112 Ų11256.4 Ų56.459%0.58629%0.291SS*.Hα-helixtrans-69.8-42.6172.2-72.4169.5000111.4D245 I246 L247 G252 K253D245-L249 WeakPolarHBondContact O-CB 3.49Å; D245-L249 VanDerWaalsContact O-CG 3.28Å; D245-L249 WeakPolarHBondContact O-CG 3.43Å; D245-L249 PolarHBondContact O-N 3.15Å; I246-L249 PolarHBondContact O-N 3Å; L247-L249 VanDerWaalsContact C-N 3.33Å; L247-L249 PolarHBondContact O-N 3.07Å; L249-G252 PolarHBondContact O-N 2.75Å; L249-K253 PolarHBondContact O-N 3.4Å
250F96.7Very high96.1Very high90 Ų9059 Ų5940%0.39529%0.294SS..Hα-helixtrans-58.8-52.4175.2170.2-102000111.7L128 T132 I246 L247 G252 K253 I254L128-F250 HydrophobicContact CD2-CE1 4.47Å; L128-F250 HydrophobicContact CD2-CZ 3.92Å; T132-F250 HydrophobicContact CG2-CE1 4.41Å; I246-F250 PolarHBondContact O-N 2.81Å; L247-F250 HydrophobicContact CD1-CD1 4.49Å; L247-F250 WeakPolarHBondContact O-CB 3.27Å; L247-F250 PolarHBondContact O-N 3.29Å; F250-G252 VanDerWaalsContact C-N 3.35Å; F250-K253 PolarHBondContact O-N 3.06Å; F250-I254 HydrophobicContact CE1-CD1 4.01Å; F250-I254 HydrophobicContact CZ-CD1 3.91Å
251W97.6Very high96.1Very high33 Ų3364 Ų6413%0.12532%0.317CS..Hα-helixtrans-63.7-40.4175.6-69.2-30.4000112H136 F199 L247 K253 I254 I255H136-W251 HydrophobicContact CB-CH2 4.08Å; F199-W251 HydrophobicContact CE1-CB 4.31Å; F199-W251 HydrophobicContact CE2-CB 4.42Å; F199-W251 HydrophobicContact CE2-CE3 4.27Å; F199-W251 HydrophobicContact CZ-CB 3.7Å; F199-W251 HydrophobicContact CZ-CE3 4.08Å; L247-W251 HydrophobicContact CD1-CD2 4.21Å; L247-W251 HydrophobicContact CD1-CH2 4.31Å; L247-W251 HydrophobicContact CD1-CZ2 3.88Å; L247-W251 HydrophobicContact CD2-CE3 4.34Å; L247-W251 HydrophobicContact CD2-CH2 3.35Å; L247-W251 HydrophobicContact CD2-CZ2 3.73Å; L247-W251 HydrophobicContact CD2-CZ3 3.68Å; L247-W251 HydrophobicContact CG-CD2 3.97Å; L247-W251 HydrophobicContact CG-CE3 3.85Å; L247-W251 HydrophobicContact CG-CH2 3.71Å; L247-W251 HydrophobicContact CG-CZ2 3.8Å; L247-W251 HydrophobicContact CG-CZ3 3.71Å; L247-W251 PolarHBondContact O-N 2.87Å; W251-K253 VanDerWaalsContact C-N 3.28Å; W251-K253 PolarHBondContact O-N 3.16Å; W251-I254 WeakPolarHBondContact O-CB 3.47Å; W251-I254 PolarHBondContact O-N 3.3Å; W251-I255 HydrophobicContact CB-CD1 4.2Å; W251-I255 WeakPolarHBondContact O-CB 3.33Å; W251-I255 VanDerWaalsContact O-CG1 3.23Å; W251-I255 WeakPolarHBondContact O-CG1 3.44Å; W251-I255 PolarHBondContact O-N 3.03Å
252G97.2Very high96.1Very high5 Ų564 Ų645%0.05232%0.317CS..Hα-helixtrans-54.3-41.6177.700000112.8N248 L249 F250 I254 I255 C256N248-G252 WeakPolarHBondContact O-CA 3.45Å; N248-G252 PolarHBondContact O-N 2.75Å; L249-G252 PolarHBondContact O-N 2.75Å; F250-G252 VanDerWaalsContact C-N 3.35Å; G252-I254 VanDerWaalsContact C-N 3.34Å; G252-I254 PolarHBondContact O-N 3.4Å; G252-I255 PolarHBondContact O-N 3.08Å; G252-C256 PolarHBondContact O-N 3.24Å; G252-C256 PolarHBondContact O-SG 3.29Å
253K96.3Very high96.2Very high174 Ų17462.4 Ų62.476%0.75731%0.309SS*.Hα-helixtrans-59.4-42.6175.8-175179.8178.2-179.90112.6L249 F250 W251L249-K253 PolarHBondContact O-N 3.4Å; F250-K253 PolarHBondContact O-N 3.06Å; W251-K253 VanDerWaalsContact C-N 3.28Å; W251-K253 PolarHBondContact O-N 3.16Å
254I96.3Very high96.1Very high83 Ų8364.8 Ų64.843%0.42632%0.317SS..Hα-helixtrans-67.8-42.9177.8-59.2171.5000109.8F250 W251 G252 C256 S257 M258F250-I254 HydrophobicContact CE1-CD1 4.01Å; F250-I254 HydrophobicContact CZ-CD1 3.91Å; W251-I254 WeakPolarHBondContact O-CB 3.47Å; W251-I254 PolarHBondContact O-N 3.3Å; G252-I254 VanDerWaalsContact C-N 3.34Å; G252-I254 PolarHBondContact O-N 3.4Å; I254-C256 PolarHBondContact O-N 3.46Å; I254-S257 WeakPolarHBondContact O-CB 3.31Å; I254-S257 PolarHBondContact O-N 3.18Å; I254-M258 PolarHBondContact O-N 3.26Å; I254-M258 VanDerWaalsContact O-N 3.14Å
255I97.1Very high95.9Very high9 Ų965 Ų655%0.04632%0.318CS..Hα-helixtrans-66-37.6-177.3-69.2167.7000111.8F195 A196 F199 I200 W251 G252 S257 M258 L259F195-I255 HydrophobicContact CE1-CD1 3.84Å; F195-I255 HydrophobicContact CE1-CG1 3.76Å; F195-I255 HydrophobicContact CE1-CG2 4.37Å; F195-I255 HydrophobicContact CE2-CD1 4.4Å; F195-I255 HydrophobicContact CZ-CD1 3.5Å; F195-I255 VanDerWaalsContact CZ-CD1 3.5Å; F195-I255 HydrophobicContact CZ-CG1 3.96Å; A196-I255 VanDerWaalsContact CA-CG2 3.47Å; A196-I255 HydrophobicContact CB-CG2 3.42Å; A196-I255 VanDerWaalsContact CB-CG2 3.42Å; F199-I255 HydrophobicContact CB-CD1 4.22Å; F199-I255 HydrophobicContact CD1-CD1 3.43Å; F199-I255 VanDerWaalsContact CD1-CD1 3.43Å; F199-I255 HydrophobicContact CD2-CD1 3.58Å; F199-I255 HydrophobicContact CE1-CD1 3.57Å; F199-I255 HydrophobicContact CE2-CD1 3.69Å; F199-I255 HydrophobicContact CG-CD1 3.45Å; F199-I255 VanDerWaalsContact CG-CD1 3.45Å; F199-I255 HydrophobicContact CZ-CD1 3.7Å; I200-I255 HydrophobicContact CD1-CG2 4.44Å; I200-I255 HydrophobicContact CG1-CG2 4.46Å; W251-I255 HydrophobicContact CB-CD1 4.2Å; W251-I255 WeakPolarHBondContact O-CB 3.33Å; W251-I255 VanDerWaalsContact O-CG1 3.23Å; W251-I255 WeakPolarHBondContact O-CG1 3.44Å; W251-I255 PolarHBondContact O-N 3.03Å; G252-I255 PolarHBondContact O-N 3.08Å; I255-S257 VanDerWaalsContact C-N 3.28Å; I255-S257 PolarHBondContact O-N 3.38Å; I255-M258 WeakPolarHBondContact O-CB 3.32Å; I255-M258 PolarHBondContact O-N 3.17Å; I255-M258 VanDerWaalsContact O-N 3.13Å; I255-L259 PolarHBondContact O-N 2.87Å
256C96.9Very high95.8Very high67 Ų6767.3 Ų67.345%0.45333%0.33SS..Hα-helixtrans-58.7-39.9173.6-72.70000112.2G252 I254 L259 W260G252-C256 PolarHBondContact O-N 3.24Å; G252-C256 PolarHBondContact O-SG 3.29Å; I254-C256 PolarHBondContact O-N 3.46Å; C256-L259 PolarHBondContact O-N 3.06Å; C256-W260 PolarHBondContact O-N 3.08Å
257S95.4Very high95.6Very high64 Ų6469.7 Ų69.745%0.44834%0.337SS..Hα-helixtrans-65.5-42.4174.8-175.30000111.7I254 I255 L259 W260 Q261I254-S257 WeakPolarHBondContact O-CB 3.31Å; I254-S257 PolarHBondContact O-N 3.18Å; I255-S257 VanDerWaalsContact C-N 3.28Å; I255-S257 PolarHBondContact O-N 3.38Å; S257-L259 PolarHBondContact O-N 3.44Å; S257-W260 PolarHBondContact O-N 2.98Å; S257-Q261 WeakPolarHBondContact O-CG 3.4Å; S257-Q261 PolarHBondContact O-N 2.93Å; S257-Q261 VanDerWaalsContact O-N 3.11Å
258M95Very high95.1Very high52 Ų5274.2 Ų74.226%0.25636%0.361SS..Hα-helixtrans-61-42.6175.3-69.2-175.3154.800112.4T192 I254 I255 Q261 S262T192-M258 HydrophobicContact CG2-CB 3.9Å; I254-M258 PolarHBondContact O-N 3.26Å; I254-M258 VanDerWaalsContact O-N 3.14Å; I255-M258 WeakPolarHBondContact O-CB 3.32Å; I255-M258 PolarHBondContact O-N 3.17Å; I255-M258 VanDerWaalsContact O-N 3.13Å; M258-Q261 PolarHBondContact O-N 3.46Å; M258-S262 PolarHBondContact O-N 3.01Å
259L96.9Very high93.7Very high32 Ų3277.3 Ų77.317%0.16838%0.382CS..Hα-helixtrans-63.5-42.6177.1178.158000111.8A196 V197 I200 I255 C256 S257 Q261 S262 I263A196-L259 HydrophobicContact CB-CB 3.71Å; A196-L259 HydrophobicContact CB-CD1 4.12Å; A196-L259 HydrophobicContact CB-CD2 4.23Å; A196-L259 HydrophobicContact CB-CG 4.23Å; V197-L259 HydrophobicContact CG2-CD1 4.43Å; I200-L259 HydrophobicContact CD1-CD2 4.14Å; I255-L259 PolarHBondContact O-N 2.87Å; C256-L259 PolarHBondContact O-N 3.06Å; S257-L259 PolarHBondContact O-N 3.44Å; L259-Q261 VanDerWaalsContact C-N 3.29Å; L259-Q261 PolarHBondContact O-N 3.39Å; L259-S262 WeakPolarHBondContact CA-OG 3.26Å; L259-S262 PolarHBondContact O-N 3.41Å; L259-S262 PolarHBondContact O-OG 3.47Å; L259-I263 HydrophobicContact CD1-CD1 3.93Å; L259-I263 HydrophobicContact CD1-CG1 4.12Å; L259-I263 HydrophobicContact CG-CD1 3.91Å; L259-I263 VanDerWaalsContact O-CG1 3.27Å; L259-I263 WeakPolarHBondContact O-CG1 3.49Å; L259-I263 PolarHBondContact O-N 3.4Å
260W95.9Very high92.1Very high161 Ų16180.6 Ų80.661%0.6139%0.394SS*.Hα-helixtrans-60.1-41.8176.6-178.1-109.3000112C256 S257 K264C256-W260 PolarHBondContact O-N 3.08Å; S257-W260 PolarHBondContact O-N 2.98Å; W260-K264 WeakPolarHBondContact O-CG 3.46Å; W260-K264 PolarHBondContact O-N 3.39Å
261Q94Very high90Very high121 Ų12180.8 Ų80.857%0.56541%0.406SS*.Hα-helixtrans-66.9-43176.3-68.31767.300112.1S257 M258 L259 I263 K264 V265S257-Q261 WeakPolarHBondContact O-CG 3.4Å; S257-Q261 PolarHBondContact O-N 2.93Å; S257-Q261 VanDerWaalsContact O-N 3.11Å; M258-Q261 PolarHBondContact O-N 3.46Å; L259-Q261 VanDerWaalsContact C-N 3.29Å; L259-Q261 PolarHBondContact O-N 3.39Å; Q261-I263 VanDerWaalsContact C-N 3.34Å; Q261-I263 PolarHBondContact O-N 2.96Å; Q261-K264 WeakPolarHBondContact O-CB 3.44Å; Q261-K264 PolarHBondContact O-N 2.85Å; Q261-V265 PolarHBondContact O-N 3.37Å; Q261-V265 VanDerWaalsContact O-N 3.14Å
262S94.8Very high87.9Confident5 Ų579.8 Ų79.84%0.03540%0.403CS..Hα-helixtrans-64.6-38.217967.20000112.1A189 S193 M258 L259 K264 V265 L266A189-S262 WeakPolarHBondContact O-CB 3.39Å; S193-S262 WeakPolarHBondContact OG-CB 3.34Å; S193-S262 PolarHBondContact OG-OG 2.89Å; M258-S262 PolarHBondContact O-N 3.01Å; L259-S262 WeakPolarHBondContact CA-OG 3.26Å; L259-S262 PolarHBondContact O-N 3.41Å; L259-S262 PolarHBondContact O-OG 3.47Å; S262-K264 VanDerWaalsContact C-N 3.33Å; S262-K264 PolarHBondContact O-N 3.25Å; S262-V265 PolarHBondContact O-N 2.97Å; S262-L266 VanDerWaalsContact O-CG 3.31Å; S262-L266 WeakPolarHBondContact O-CG 3.49Å; S262-L266 PolarHBondContact O-N 3.24Å
263I95.1Very high85.7Confident62 Ų6287 Ų8732%0.31844%0.436SS..Hα-helixtrans-61.7-41.5174.9-69.4166.9000111.1L259 Q261 V265 L266 K267L259-I263 HydrophobicContact CD1-CD1 3.93Å; L259-I263 HydrophobicContact CD1-CG1 4.12Å; L259-I263 HydrophobicContact CG-CD1 3.91Å; L259-I263 VanDerWaalsContact O-CG1 3.27Å; L259-I263 WeakPolarHBondContact O-CG1 3.49Å; L259-I263 PolarHBondContact O-N 3.4Å; Q261-I263 VanDerWaalsContact C-N 3.34Å; Q261-I263 PolarHBondContact O-N 2.96Å; I263-V265 VanDerWaalsContact C-N 3.35Å; I263-V265 PolarHBondContact O-N 2.93Å; I263-L266 PolarHBondContact O-N 3.39Å; I263-K267 HydrophobicContact CG2-CD 4.16Å; I263-K267 HydrophobicContact CG2-CG 4.44Å; I263-K267 WeakPolarHBondContact O-CG 3.31Å; I263-K267 PolarHBondContact O-N 3.37Å
264K94.3Very high83.2Confident117 Ų11783.5 Ų83.551%0.50943%0.433SS..Hα-helixtrans-61.3-44176.9-75.4179.4171.9-176.40112.1W260 Q261 S262 L266 K267 N268W260-K264 WeakPolarHBondContact O-CG 3.46Å; W260-K264 PolarHBondContact O-N 3.39Å; Q261-K264 WeakPolarHBondContact O-CB 3.44Å; Q261-K264 PolarHBondContact O-N 2.85Å; S262-K264 VanDerWaalsContact C-N 3.33Å; S262-K264 PolarHBondContact O-N 3.25Å; K264-L266 VanDerWaalsContact C-N 3.35Å; K264-K267 PolarHBondContact O-N 3.31Å; K264-N268 PolarHBondContact O-N 2.78Å
265V92Very high80.7Confident22 Ų2287.7 Ų87.713%0.13345%0.451CS..Hα-helixtrans-60.9-45.4176.71710000110.8H184 A189 Q261 S262 I263 K267 N268H184-V265 HydrophobicContact CB-CG2 4.39Å; H184-V265 WeakPolarHBondContact O-CG1 3.18Å; A189-V265 HydrophobicContact CB-CB 4.06Å; A189-V265 HydrophobicContact CB-CG1 3.77Å; Q261-V265 PolarHBondContact O-N 3.37Å; Q261-V265 VanDerWaalsContact O-N 3.14Å; S262-V265 PolarHBondContact O-N 2.97Å; I263-V265 VanDerWaalsContact C-N 3.35Å; I263-V265 PolarHBondContact O-N 2.93Å; V265-K267 VanDerWaalsContact C-N 3.32Å; V265-K267 PolarHBondContact O-N 3.41Å; V265-N268 CarbonylContact O-C 3.55Å; V265-N268 PolarHBondContact O-N 2.94Å
266L93.2Very high79.8Confident75 Ų7591.7 Ų91.739%0.39347%0.471SS..Hα-helixtrans-69.4-27.3-178.7-66.8171.1000113.5A189 I190 S262 I263 K264A189-L266 HydrophobicContact CB-CD1 4.36Å; A189-L266 HydrophobicContact CB-CD2 3.89Å; A189-L266 HydrophobicContact CB-CG 3.84Å; I190-L266 HydrophobicContact CG1-CD2 3.92Å; S262-L266 VanDerWaalsContact O-CG 3.31Å; S262-L266 WeakPolarHBondContact O-CG 3.49Å; S262-L266 PolarHBondContact O-N 3.24Å; I263-L266 PolarHBondContact O-N 3.39Å; K264-L266 VanDerWaalsContact C-N 3.35Å
267K92.3Very high78.9Confident158 Ų15892.9 Ų92.969%0.68747%0.472SS*.Hα-helixtrans-76.9-28.5175.4-76.2-175.6175.8-172.30113.4I263 K264 V265 P269I263-K267 HydrophobicContact CG2-CD 4.16Å; I263-K267 HydrophobicContact CG2-CG 4.44Å; I263-K267 WeakPolarHBondContact O-CG 3.31Å; I263-K267 PolarHBondContact O-N 3.37Å; K264-K267 PolarHBondContact O-N 3.31Å; V265-K267 VanDerWaalsContact C-N 3.32Å; V265-K267 PolarHBondContact O-N 3.41Å; K267-P269 VanDerWaalsContact O-CD 3.26Å; K267-P269 WeakPolarHBondContact O-CD 3.24Å
268N86.2Confident78Confident111 Ų11194.6 Ų94.659%0.59447%0.473SS*.  trans-120.269.2-177.4-66.2-20.6000111K264 V265 Q270 C271K264-N268 PolarHBondContact O-N 2.78Å; V265-N268 CarbonylContact O-C 3.55Å; V265-N268 PolarHBondContact O-N 2.94Å; N268-Q270 PolarHBondContact O-N 3.1Å; N268-Q270 VanDerWaalsContact O-N 3.12Å; N268-C271 PolarHBondContact O-N 2.95Å
269P68Low77Confident71 Ų7197.1 Ų97.146%0.46149%0.486SS..G310 helixtrans-63-21-174.523.5-32.8000113.9K267 C271 S272K267-P269 VanDerWaalsContact O-CD 3.26Å; K267-P269 WeakPolarHBondContact O-CD 3.24Å; P269-C271 PolarHBondContact O-N 3.23Å; P269-C271 VanDerWaalsContact O-N 3.13Å; P269-S272 WeakPolarHBondContact O-CB 3.41Å; P269-S272 PolarHBondContact O-N 3.12Å; P269-S272 PolarHBondContact O-OG 2.97Å
270Q61.9Low75.8Confident180 Ų180101.1 Ų101.184%0.84151%0.506SS*.G310 helixtrans-61-20.6178.8-70.8-168.1-22.700114.2N268N268-Q270 PolarHBondContact O-N 3.1Å; N268-Q270 VanDerWaalsContact O-N 3.12Å
271C53.6Low74.4Confident95 Ų9597.1 Ų97.164%0.64250%0.499SS*.G310 helixtrans-80.7-11.4171.6-86.90000114.1N268 P269N268-C271 PolarHBondContact O-N 2.95Å; P269-C271 PolarHBondContact O-N 3.23Å; P269-C271 VanDerWaalsContact O-N 3.13Å
272S52.6Low73Confident11 Ų1195.4 Ų95.48%0.07750%0.495CS..THydrogen-bonded Turntrans-99.1-11.9-171.471.40000114.8H184 P269H184-S272 WeakPolarHBondContact O-CB 3.36Å; P269-S272 WeakPolarHBondContact O-CB 3.41Å; P269-S272 PolarHBondContact O-N 3.12Å; P269-S272 PolarHBondContact O-OG 2.97Å
273E50.8Low71.4Confident158 Ų158102.4 Ų102.474%0.73853%0.53SS*.SBendtrans-97.60.4-177-65.5-174161.900113.4
274S45.4Very low69.4Low99 Ų99105.8 Ų105.869%0.69255%0.548SS*.  trans-99.29-179.258.40000115
275E42.3Very low67.1Low172 Ų172104.7 Ų104.780%0.80455%0.551SS**  trans-130.90179-69.1-176.5158.800111.3S182S182-E275 WeakPolarHBondContact CB-OE2 3.37Å; S182-E275 PolarHBondContact OG-OE2 2.92Å

Retrieved 275 of 275 residues in 535.5 ms (Link to these results)

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