A0A023UN48_HUMAN Loading...

Ammonium transporter Rh type A

AlphaFold DB , UniProt , Accession A0A023UN48, Species HUMAN (Homo sapiens, Human), Gene RHAG, Length 409 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
1M86.5Confident94.9Very high73 Ų7391.8 Ų91.836%0.3646%0.457SS..  08.60-66.7177.462.700114.9F3 F5 P6 P138 T139 Y402M1-F3 PolarHBondContact O-N 3.4Å; M1-F5 HydrophobicContact CB-CB 4.06Å; M1-F5 HydrophobicContact CE-CB 3.57Å; M1-F5 HydrophobicContact CE-CD2 3.91Å; M1-F5 HydrophobicContact CE-CG 3.94Å; M1-F5 PolarHBondContact O-N 3.37Å; M1-P6 WeakPolarHBondContact O-CD 3.35Å; M1-P138 HydrophobicContact CE-CB 4Å; M1-P138 HydrophobicContact CE-CG 4.07Å; M1-T139 VanDerWaalsContact CE-OG1 3.3Å; M1-T139 WeakPolarHBondContact CE-OG1 3.43Å; M1-Y402 HydrophobicContact SD-CD1 3.53Å; M1-Y402 VanDerWaalsContact SD-CD1 3.53Å; M1-Y402 HydrophobicContact SD-CE1 3.22Å; M1-Y402 WeakPolarHBondContact SD-CE1 2.96Å
2R92.2Very high95.2Very high213 Ų21386.4 Ų86.480%0.80443%0.431SS*.THydrogen-bonded Turntrans-54.2-29.2-174-175175.7-179.8178.9-0115.4P6R2-P6 WeakPolarHBondContact O-CG 3.32Å
3F91.6Very high95.5Very high160 Ų16086.1 Ų86.170%0.70243%0.427SS*.THydrogen-bonded Turntrans-112.5-44.8-179.4-60.9-69000112.8M1 F5 L7M1-F3 PolarHBondContact O-N 3.4Å; F3-F5 PolarHBondContact O-N 3.25Å; F3-L7 WeakPolarHBondContact O-CB 3.43Å; F3-L7 PolarHBondContact O-N 3.06Å
4T91.4Very high95.7Very high75 Ų7586.9 Ų86.946%0.4643%0.432SS..Hα-helixtrans-61.5-42.6-175.851.80000113.1M8T4-M8 WeakPolarHBondContact O-CB 3.49Å; T4-M8 PolarHBondContact O-N 3.3Å
5F96Very high95.9Very high56 Ų5683.6 Ų83.625%0.24642%0.424CS..Hα-helixtrans-72.3-52.5-178.9170.7-97.9000113M1 F3 L7 M8 A9 L85 P138 L142M1-F5 HydrophobicContact CB-CB 4.06Å; M1-F5 HydrophobicContact CE-CB 3.57Å; M1-F5 HydrophobicContact CE-CD2 3.91Å; M1-F5 HydrophobicContact CE-CG 3.94Å; M1-F5 PolarHBondContact O-N 3.37Å; F3-F5 PolarHBondContact O-N 3.25Å; F5-L7 VanDerWaalsContact C-N 3.29Å; F5-L7 PolarHBondContact O-N 3.19Å; F5-M8 PolarHBondContact O-N 3.28Å; F5-A9 PolarHBondContact O-N 2.9Å; F5-L85 HydrophobicContact CE2-CD2 3.69Å; F5-L85 HydrophobicContact CZ-CD1 4.47Å; F5-L85 HydrophobicContact CZ-CD2 3.77Å; F5-P138 HydrophobicContact CD2-CB 3.79Å; F5-P138 HydrophobicContact CE2-CB 3.52Å; F5-P138 HydrophobicContact CZ-CB 4.31Å; F5-L142 HydrophobicContact CD2-CD1 4.16Å; F5-L142 HydrophobicContact CE2-CD1 3.83Å
6P97.8Very high96.1Very high51 Ų5178.6 Ų78.633%0.33140%0.399SS..Hα-helixtrans-59.8-39.5177.9-27.237.7000112.8M1 R2 A9 I10M1-P6 WeakPolarHBondContact O-CD 3.35Å; R2-P6 WeakPolarHBondContact O-CG 3.32Å; P6-A9 PolarHBondContact O-N 3.35Å; P6-I10 WeakPolarHBondContact O-CB 3.36Å; P6-I10 WeakPolarHBondContact O-CD1 3.32Å; P6-I10 WeakPolarHBondContact O-CG1 3.28Å; P6-I10 PolarHBondContact O-N 3.33Å
7L96.6Very high96.2Very high116 Ų11680.1 Ų80.161%0.60741%0.407SS*.Hα-helixtrans-60.4-48.1177.1-177.965.6000111.3F3 F5 V11F3-L7 WeakPolarHBondContact O-CB 3.43Å; F3-L7 PolarHBondContact O-N 3.06Å; F5-L7 VanDerWaalsContact C-N 3.29Å; F5-L7 PolarHBondContact O-N 3.19Å; L7-V11 HydrophobicContact CD1-CG2 4.11Å; L7-V11 HydrophobicContact CG-CG2 4.43Å; L7-V11 WeakPolarHBondContact O-CB 3.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.41Å; L7-V11 PolarHBondContact O-N 2.81Å
8M96.9Very high96.4Very high54 Ų5480.1 Ų80.127%0.26641%0.411SS..Hα-helixtrans-59.6-49.9177.2-177.566.27700111.3T4 F5 I10 V11 L12 L142 I143T4-M8 WeakPolarHBondContact O-CB 3.49Å; T4-M8 PolarHBondContact O-N 3.3Å; F5-M8 PolarHBondContact O-N 3.28Å; M8-I10 PolarHBondContact O-N 3.44Å; M8-V11 PolarHBondContact O-N 3.23Å; M8-L12 HydrophobicContact CG-CD1 3.91Å; M8-L12 HydrophobicContact CG-CG 4.44Å; M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 VanDerWaalsContact O-CG 3.29Å; M8-L12 WeakPolarHBondContact O-CG 3.35Å; M8-L12 PolarHBondContact O-N 3.29Å; M8-L12 HydrophobicContact SD-CD1 4.09Å; M8-L12 HydrophobicContact SD-CG 4.21Å; M8-L142 HydrophobicContact CB-CD1 4.48Å; M8-L142 HydrophobicContact CG-CB 4.48Å; M8-L142 HydrophobicContact CG-CD1 4Å; M8-I143 HydrophobicContact CE-CD1 4.27Å; M8-I143 HydrophobicContact CE-CG1 4.18Å
9A98.3Very high96.5Very high29 Ų2978.3 Ų78.324%0.2440%0.402CS..Hα-helixtrans-61.2-45.5-178.400000112.1F5 P6 L12 E13 L142F5-A9 PolarHBondContact O-N 2.9Å; P6-A9 PolarHBondContact O-N 3.35Å; A9-L12 PolarHBondContact O-N 3.14Å; A9-E13 WeakPolarHBondContact O-CB 3.49Å; A9-E13 PolarHBondContact O-N 3.41Å; A9-L142 HydrophobicContact CB-CD1 4.23Å
10I98.6Very high96.5Very high102 Ų10277 Ų7752%0.52339%0.394SS..Hα-helixtrans-66.4-42.3179.2-68.2166.4000111.1P6 M8 E13 I14P6-I10 WeakPolarHBondContact O-CB 3.36Å; P6-I10 WeakPolarHBondContact O-CD1 3.32Å; P6-I10 WeakPolarHBondContact O-CG1 3.28Å; P6-I10 PolarHBondContact O-N 3.33Å; M8-I10 PolarHBondContact O-N 3.44Å; I10-E13 PolarHBondContact O-N 3.13Å; I10-I14 HydrophobicContact CG2-CD1 3.74Å; I10-I14 HydrophobicContact CG2-CG1 4.37Å; I10-I14 WeakPolarHBondContact O-CB 3.26Å; I10-I14 VanDerWaalsContact O-CG1 3.26Å; I10-I14 WeakPolarHBondContact O-CG1 3.42Å; I10-I14 PolarHBondContact O-N 2.58Å
11V98.5Very high96.6Very high81 Ų8176.4 Ų76.449%0.49141%0.406SS..Hα-helixtrans-63.9-43.3178167.80000111.1L7 M8 I14 A15L7-V11 HydrophobicContact CD1-CG2 4.11Å; L7-V11 HydrophobicContact CG-CG2 4.43Å; L7-V11 WeakPolarHBondContact O-CB 3.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.41Å; L7-V11 PolarHBondContact O-N 2.81Å; M8-V11 PolarHBondContact O-N 3.23Å; V11-I14 PolarHBondContact O-N 3Å; V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 2.94Å
12L98.6Very high97.1Very high27 Ų2777.5 Ų77.514%0.14141%0.413CS..Hα-helixtrans-62.7-45.3175.9-72173.8000111.2M8 A9 I14 A15 M16 L89 L142 I146M8-L12 HydrophobicContact CG-CD1 3.91Å; M8-L12 HydrophobicContact CG-CG 4.44Å; M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 VanDerWaalsContact O-CG 3.29Å; M8-L12 WeakPolarHBondContact O-CG 3.35Å; M8-L12 PolarHBondContact O-N 3.29Å; M8-L12 HydrophobicContact SD-CD1 4.09Å; M8-L12 HydrophobicContact SD-CG 4.21Å; A9-L12 PolarHBondContact O-N 3.14Å; L12-I14 PolarHBondContact O-N 3.11Å; L12-A15 CarbonylContact O-C 3.59Å; L12-A15 WeakPolarHBondContact O-CB 3.5Å; L12-A15 PolarHBondContact O-N 3.09Å; L12-A15 VanDerWaalsContact O-N 3.15Å; L12-M16 WeakPolarHBondContact O-CG 3.4Å; L12-M16 PolarHBondContact O-N 3.25Å; L12-L89 HydrophobicContact CB-CD1 4.46Å; L12-L89 HydrophobicContact CD1-CD2 4.07Å; L12-L142 HydrophobicContact CD1-CB 3.97Å; L12-L142 HydrophobicContact CD1-CD1 4.37Å; L12-I146 HydrophobicContact CD1-CG1 4.45Å; L12-I146 HydrophobicContact CD2-CD1 4.07Å; L12-I146 HydrophobicContact CD2-CG1 3.98Å
13E98.7Very high97.3Very high82 Ų8270 Ų7038%0.38339%0.387SS..Hα-helixtrans-63-43.8178.7-173.662.6-161.900112A9 I10 A15 M16 I17 Q92A9-E13 WeakPolarHBondContact O-CB 3.49Å; A9-E13 PolarHBondContact O-N 3.41Å; I10-E13 PolarHBondContact O-N 3.13Å; E13-A15 VanDerWaalsContact C-N 3.28Å; E13-A15 PolarHBondContact O-N 2.93Å; E13-M16 PolarHBondContact O-N 2.69Å; E13-I17 HydrophobicContact CG-CD1 4.24Å; E13-I17 WeakPolarHBondContact O-CG1 3.33Å; E13-I17 PolarHBondContact O-N 3.35Å; E13-Q92 PolarHBondContact OE2-NE2 3.39Å
14I98.8Very high97.5Very high97 Ų9763.5 Ų63.550%0.49736%0.36SS..Hα-helixtrans-59.2-42.6173.6-69.7167.7000110.4I10 V11 L12 I17 V18I10-I14 HydrophobicContact CG2-CD1 3.74Å; I10-I14 HydrophobicContact CG2-CG1 4.37Å; I10-I14 WeakPolarHBondContact O-CB 3.26Å; I10-I14 VanDerWaalsContact O-CG1 3.26Å; I10-I14 WeakPolarHBondContact O-CG1 3.42Å; I10-I14 PolarHBondContact O-N 2.58Å; V11-I14 PolarHBondContact O-N 3Å; L12-I14 PolarHBondContact O-N 3.11Å; I14-I17 PolarHBondContact O-N 3.01Å; I14-V18 WeakPolarHBondContact O-CG2 3.25Å; I14-V18 PolarHBondContact O-N 2.84Å
15A98.6Very high97.6Very high38 Ų3864.1 Ų64.131%0.31436%0.357SS..Hα-helixtrans-63-42.4176.800000111.7V11 L12 E13 V18 L19V11-A15 WeakPolarHBondContact O-CB 3.29Å; V11-A15 PolarHBondContact O-N 2.94Å; L12-A15 CarbonylContact O-C 3.59Å; L12-A15 WeakPolarHBondContact O-CB 3.5Å; L12-A15 PolarHBondContact O-N 3.09Å; L12-A15 VanDerWaalsContact O-N 3.15Å; E13-A15 VanDerWaalsContact C-N 3.28Å; E13-A15 PolarHBondContact O-N 2.93Å; A15-V18 PolarHBondContact O-N 3.12Å; A15-L19 WeakPolarHBondContact O-CB 3Å; A15-L19 VanDerWaalsContact O-CG 3.22Å; A15-L19 WeakPolarHBondContact O-CG 3.35Å; A15-L19 PolarHBondContact O-N 2.83Å
16M98.6Very high97.3Very high4 Ų470.6 Ų70.62%0.0238%0.382CS..Hα-helixtrans-60.5-48.9175.4-64.4-53.8137.200110.9L12 E13 V18 L19 F20 L89 Q92 W93 I96 I146L12-M16 WeakPolarHBondContact O-CG 3.4Å; L12-M16 PolarHBondContact O-N 3.25Å; E13-M16 PolarHBondContact O-N 2.69Å; M16-V18 VanDerWaalsContact C-N 3.31Å; M16-V18 PolarHBondContact O-N 3.13Å; M16-L19 PolarHBondContact O-N 2.73Å; M16-L19 VanDerWaalsContact O-N 3.14Å; M16-F20 WeakPolarHBondContact O-CB 3.35Å; M16-F20 WeakPolarHBondContact O-CD2 3.21Å; M16-F20 PolarHBondContact O-N 3.41Å; M16-L89 HydrophobicContact CE-CD1 4.12Å; M16-L89 HydrophobicContact CG-CD1 4.44Å; M16-Q92 HydrophobicContact CB-CB 4.35Å; M16-Q92 VanDerWaalsContact CB-OE1 3.26Å; M16-Q92 HydrophobicContact CG-CB 4Å; M16-Q92 HydrophobicContact SD-CB 4.16Å; M16-W93 HydrophobicContact CE-CB 4.09Å; M16-W93 HydrophobicContact CE-CD2 4.07Å; M16-W93 HydrophobicContact CE-CE3 3.66Å; M16-W93 HydrophobicContact CE-CG 4.28Å; M16-W93 HydrophobicContact CE-CZ3 4.45Å; M16-W93 HydrophobicContact SD-CB 4.11Å; M16-W93 HydrophobicContact SD-CE3 3.95Å; M16-I96 HydrophobicContact SD-CD1 3.63Å; M16-I146 HydrophobicContact CE-CD1 3.87Å
17I98.7Very high96.2Very high104 Ų10474.2 Ų74.253%0.53339%0.394SS..Hα-helixtrans-56.9-45.1178.5-68.1166.3000111.3E13 I14 G21E13-I17 HydrophobicContact CG-CD1 4.24Å; E13-I17 WeakPolarHBondContact O-CG1 3.33Å; E13-I17 PolarHBondContact O-N 3.35Å; I14-I17 PolarHBondContact O-N 3.01Å; I17-G21 PolarHBondContact O-N 2.95Å
18V98.5Very high94.8Very high80 Ų8072.5 Ų72.549%0.48539%0.389SS..Hα-helixtrans-63.2-46.6177.4170.50000110.9I14 A15 M16 G21 L22I14-V18 WeakPolarHBondContact O-CG2 3.25Å; I14-V18 PolarHBondContact O-N 2.84Å; A15-V18 PolarHBondContact O-N 3.12Å; M16-V18 VanDerWaalsContact C-N 3.31Å; M16-V18 PolarHBondContact O-N 3.13Å; V18-G21 PolarHBondContact O-N 3.49Å; V18-L22 HydrophobicContact CG1-CD1 3.89Å; V18-L22 HydrophobicContact CG1-CG 4.46Å; V18-L22 VanDerWaalsContact O-CG 3.27Å; V18-L22 WeakPolarHBondContact O-CG 3.27Å; V18-L22 PolarHBondContact O-N 2.87Å
19L98Very high92.7Very high45 Ų4576.6 Ų76.624%0.23641%0.412CS..Hα-helixtrans-65.4-40.6-179.9-70.4170.9000112.2A15 M16 L22 F23 W93 I96A15-L19 WeakPolarHBondContact O-CB 3Å; A15-L19 VanDerWaalsContact O-CG 3.22Å; A15-L19 WeakPolarHBondContact O-CG 3.35Å; A15-L19 PolarHBondContact O-N 2.83Å; M16-L19 PolarHBondContact O-N 2.73Å; M16-L19 VanDerWaalsContact O-N 3.14Å; L19-L22 PolarHBondContact O-N 3.4Å; L19-F23 HydrophobicContact CD2-CD2 4.24Å; L19-F23 HydrophobicContact CD2-CE2 4.08Å; L19-F23 WeakPolarHBondContact O-CD2 3.24Å; L19-F23 PolarHBondContact O-N 3.43Å; L19-W93 HydrophobicContact CD1-CZ3 3.93Å; L19-I96 HydrophobicContact CB-CD1 3.62Å; L19-I96 HydrophobicContact CB-CG1 4.34Å; L19-I96 HydrophobicContact CB-CG2 4.41Å; L19-I96 HydrophobicContact CD1-CD1 4.14Å; L19-I96 HydrophobicContact CD1-CG2 4.42Å
20F98.1Very high90.3Very high53 Ų5382.9 Ų82.923%0.23244%0.436CS..Hα-helixtrans-59.6-47.4172.7-93.9-97.6000111.1M16 L22 F23 V24 Q92 T95 I96 I110M16-F20 WeakPolarHBondContact O-CB 3.35Å; M16-F20 WeakPolarHBondContact O-CD2 3.21Å; M16-F20 PolarHBondContact O-N 3.41Å; F20-L22 PolarHBondContact O-N 3.04Å; F20-F23 PolarHBondContact O-N 3.04Å; F20-V24 HydrophobicContact CB-CG2 4.42Å; F20-V24 HydrophobicContact CD1-CB 3.73Å; F20-V24 HydrophobicContact CD1-CG1 3.86Å; F20-V24 HydrophobicContact CD1-CG2 3.64Å; F20-V24 HydrophobicContact CE1-CB 4.28Å; F20-V24 HydrophobicContact CE1-CG1 4.02Å; F20-V24 HydrophobicContact CE1-CG2 3.99Å; F20-V24 HydrophobicContact CG-CB 4.35Å; F20-V24 HydrophobicContact CG-CG2 4.01Å; F20-V24 WeakPolarHBondContact O-CB 3.38Å; F20-V24 PolarHBondContact O-N 3.1Å; F20-Q92 HydrophobicContact CE2-CB 3.98Å; F20-Q92 HydrophobicContact CE2-CG 4.47Å; F20-Q92 WeakPolarHBondContact CE2-O 3.37Å; F20-T95 HydrophobicContact CE1-CG2 4.23Å; F20-T95 HydrophobicContact CZ-CG2 3.95Å; F20-I96 HydrophobicContact CD2-CD1 3.58Å; F20-I96 HydrophobicContact CD2-CG1 3.9Å; F20-I96 HydrophobicContact CE2-CD1 3.56Å; F20-I96 HydrophobicContact CE2-CG1 3.69Å; F20-I96 HydrophobicContact CZ-CG1 4.42Å; F20-I110 HydrophobicContact CE1-CD1 4.37Å
21G97.6Very high88Confident64 Ų6480.6 Ų80.666%0.6643%0.427SS*.Hα-helixtrans-63.3-23.6177.500000114.4I17 V18I17-G21 PolarHBondContact O-N 2.95Å; V18-G21 PolarHBondContact O-N 3.49Å
22L96.7Very high85.6Confident97 Ų9778.8 Ų78.851%0.50842%0.416SS..Hα-helixtrans-89.6-37178.8-70.3174.4000113.5V18 L19 F20 K107V18-L22 HydrophobicContact CG1-CD1 3.89Å; V18-L22 HydrophobicContact CG1-CG 4.46Å; V18-L22 VanDerWaalsContact O-CG 3.27Å; V18-L22 WeakPolarHBondContact O-CG 3.27Å; V18-L22 PolarHBondContact O-N 2.87Å; L19-L22 PolarHBondContact O-N 3.4Å; F20-L22 PolarHBondContact O-N 3.04Å; L22-K107 WeakPolarHBondContact O-CE 3.4Å
23F96.3Very high83Confident55 Ų5583.9 Ų83.924%0.24144%0.443CS..Hα-helixtrans-119.7-17.4-166.3-68-78000115.5L19 F20 I100 K107 F108L19-F23 HydrophobicContact CD2-CD2 4.24Å; L19-F23 HydrophobicContact CD2-CE2 4.08Å; L19-F23 WeakPolarHBondContact O-CD2 3.24Å; L19-F23 PolarHBondContact O-N 3.43Å; F20-F23 PolarHBondContact O-N 3.04Å; F23-I100 HydrophobicContact CB-CG1 4.46Å; F23-I100 HydrophobicContact CD1-CD1 4.24Å; F23-I100 HydrophobicContact CD1-CG1 4.2Å; F23-I100 HydrophobicContact CD2-CD1 4.04Å; F23-I100 HydrophobicContact CE1-CD1 4.48Å; F23-I100 HydrophobicContact CE2-CD1 4.29Å; F23-I100 HydrophobicContact CG-CD1 4.02Å; F23-I100 HydrophobicContact CG-CG1 4.23Å; F23-K107 CarbonylContact O-C 3.59Å; F23-K107 VanDerWaalsContact O-CA 3.28Å; F23-K107 WeakPolarHBondContact O-CA 3.49Å; F23-F108 HydrophobicContact CB-CE1 4.22Å; F23-F108 WeakPolarHBondContact O-CD1 3.24Å; F23-F108 PolarHBondContact O-N 3.19Å
24V96.2Very high80.5Confident23 Ų2388.5 Ų88.514%0.13946%0.464CS..EExtended strand (participates in β ladder)trans-112.1126.1-170.1-171.90000110.8F20 F108 I110F20-V24 HydrophobicContact CB-CG2 4.42Å; F20-V24 HydrophobicContact CD1-CB 3.73Å; F20-V24 HydrophobicContact CD1-CG1 3.86Å; F20-V24 HydrophobicContact CD1-CG2 3.64Å; F20-V24 HydrophobicContact CE1-CB 4.28Å; F20-V24 HydrophobicContact CE1-CG1 4.02Å; F20-V24 HydrophobicContact CE1-CG2 3.99Å; F20-V24 HydrophobicContact CG-CB 4.35Å; F20-V24 HydrophobicContact CG-CG2 4.01Å; F20-V24 WeakPolarHBondContact O-CB 3.38Å; F20-V24 PolarHBondContact O-N 3.1Å; V24-F108 HydrophobicContact CG1-CE2 4.4Å; V24-F108 HydrophobicContact CG2-CE1 3.98Å; V24-F108 HydrophobicContact CG2-CE2 4.09Å; V24-F108 HydrophobicContact CG2-CZ 3.54Å; V24-I110 HydrophobicContact CG1-CB 3.82Å; V24-I110 HydrophobicContact CG1-CD1 4.42Å; V24-I110 HydrophobicContact CG1-CG2 3.98Å
25E93.8Very high78.1Confident88 Ų8892.2 Ų92.241%0.41148%0.479SS..EExtended strand (participates in β ladder)trans-123156.8175.9-65.7-177165.900110.3K107 F108 N109 I110E25-K107 HydrophobicContact CG-CD 4.31Å; E25-K107 WeakPolarHBondContact OE1-CD 3.24Å; E25-K107 IonicContact OE1-NZ 3.09Å; E25-K107 PolarHBondContact OE1-NZ 3.32Å; E25-F108 PolarHBondContact N-O 3.03Å; E25-N109 CarbonylContact O-C 3.49Å; E25-N109 VanDerWaalsContact O-CA 3.22Å; E25-N109 WeakPolarHBondContact O-CA 3.37Å; E25-I110 WeakPolarHBondContact O-CG2 3.41Å; E25-I110 PolarHBondContact O-N 3.42Å
26Y89.4Confident75.5Confident192 Ų19295.1 Ų95.175%0.75349%0.489SS*.EExtended strand (participates in β ladder)trans-75.2147.9169.2-72.4-66.7000109.6T28 I110Y26-T28 PolarHBondContact O-N 3.11Å; Y26-I110 HydrophobicContact CD1-CG2 3.97Å; Y26-I110 HydrophobicContact CE1-CG2 4.29Å
27E75.1Confident72.9Confident127 Ų127102.7 Ų102.759%0.59353%0.53SS*.  trans-55.7125.2164.7-70.9178.5168.600109.3N109E27-N109 HydrophobicContact CB-CB 4.47Å; E27-N109 HydrophobicContact CG-CB 3.61Å
28T66.5Low70.4Confident81 Ų81104.1 Ų104.150%0.49754%0.537SS..  trans-108.1149.9177590000111.2Y26 Q30 T31Y26-T28 PolarHBondContact O-N 3.11Å; T28-Q30 PolarHBondContact O-N 3.33Å; T28-T31 PolarHBondContact O-N 2.71Å; T28-T31 VanDerWaalsContact O-N 3.12Å; T28-T31 PolarHBondContact O-OG1 3.09Å; T28-T31 PolarHBondContact OG1-OG1 3.12Å
29D53.9Low68Low139 Ų139107 Ų10774%0.74356%0.555SS**Hα-helixtrans-56.4-19.1-179.3-67.3-27.7000114.6V32D29-V32 WeakPolarHBondContact O-CB 3.4Å
30Q46.5Very low65.4Low161 Ų161113.3 Ų113.375%0.75258%0.581SS**Hα-helixtrans-78.4-38.9177.1-94-178.2-40.500113T28 V32 L33 E34T28-Q30 PolarHBondContact O-N 3.33Å; Q30-V32 PolarHBondContact O-N 3.37Å; Q30-L33 PolarHBondContact O-N 3.21Å; Q30-E34 PolarHBondContact O-N 3.48Å
31T51Low63Low55 Ų55115 Ų11534%0.33760%0.597SS.*Hα-helixtrans-62.5-27172.96.20000112.5T28T28-T31 PolarHBondContact O-N 2.71Å; T28-T31 VanDerWaalsContact O-N 3.12Å; T28-T31 PolarHBondContact O-OG1 3.09Å; T28-T31 PolarHBondContact OG1-OG1 3.12Å
32V47.3Very low60.8Low42 Ų42117.4 Ų117.426%0.25560%0.599SS.*Hα-helixtrans-67.4-38175.2167.80000112.2D29 Q30 L36 D43D29-V32 WeakPolarHBondContact O-CB 3.4Å; Q30-V32 PolarHBondContact O-N 3.37Å; V32-L36 HydrophobicContact CG1-CD1 4.42Å; V32-D43 WeakPolarHBondContact CG1-OD2 3.27Å; V32-D43 WeakPolarHBondContact CG2-OD2 3.34Å
33L44.6Very low58.6Low135 Ų135116.1 Ų116.171%0.70759%0.593SS**Hα-helixtrans-77.6-30.6-177.1-83.9155.9000113.3Q30Q30-L33 PolarHBondContact O-N 3.21Å
34E46.5Very low56.5Low179 Ų179119.5 Ų119.584%0.83661%0.611SS**Hα-helixtrans-76.7-20.8179-74.8-174.7158.700113.4Q30Q30-E34 PolarHBondContact O-N 3.48Å
35Q48.2Very low54.6Low174 Ų174119.5 Ų119.581%0.81362%0.615SS**THydrogen-bonded Turntrans-85.9-10.2177.1-89.5-179.1-18.100114.9
36L45.1Very low53Low99 Ų99119.2 Ų119.252%0.51862%0.615SS.*  trans-119.599.2-168.9-70171.6000113.2V32V32-L36 HydrophobicContact CG1-CD1 4.42Å
37N43.5Very low51.6Low163 Ų163114.7 Ų114.787%0.87260%0.6SS**SBendtrans-107.244.5157.9-149.316.7000111.2
38I46.3Very low51Low135 Ų135114.9 Ų114.969%0.69260%0.599SS**SBendtrans-162.4141.7164.7-88.8134000110.9K40I38-K40 PolarHBondContact O-N 2.91Å
39T46.9Very low51.6Low141 Ų141116.7 Ų116.787%0.86560%0.602SS**  trans-60.2104.4165.627.20000113.2
40K44.9Very low53.1Low177 Ų177111.7 Ų111.777%0.7758%0.575SS**  trans-161.1166.8161.9-113.2-176.5-174.1-174.80110.3I38I38-K40 PolarHBondContact O-N 2.91Å
41P46.4Very low55.3Low89 Ų89108.4 Ų108.458%0.57856%0.556SS**  trans-58.2143.8-143.329.4-33.9000112.7
42T52.7Low57.4Low113 Ų113108.7 Ų108.769%0.69356%0.559SS**  trans-50.9144.5177.938.80000111.2M44 G45T42-M44 PolarHBondContact O-N 2.91Å; T42-G45 WeakPolarHBondContact O-CA 3.49Å; T42-G45 PolarHBondContact O-N 3.42Å
43D49.3Very low59.7Low71 Ų71107.6 Ų107.638%0.3855%0.552SS.*Hα-helixtrans-52.9-23.4-178.8-68.9-43.7000114.7V32 G45 I46 F47V32-D43 WeakPolarHBondContact CG1-OD2 3.27Å; V32-D43 WeakPolarHBondContact CG2-OD2 3.34Å; D43-G45 PolarHBondContact O-N 2.87Å; D43-I46 PolarHBondContact O-N 3.17Å; D43-F47 PolarHBondContact O-N 3.36Å
44M52Low62.2Low126 Ų126101.9 Ų101.962%0.62152%0.521SS*.Hα-helixtrans-50.6-40.7165.8-88.6-96.2-91.900112.6T42 F47 F48T42-M44 PolarHBondContact O-N 2.91Å; M44-F47 PolarHBondContact O-N 3.12Å; M44-F48 HydrophobicContact CB-CE2 4.37Å; M44-F48 HydrophobicContact CE-CE2 4Å; M44-F48 WeakPolarHBondContact O-CD2 3.43Å; M44-F48 PolarHBondContact O-N 2.8Å; M44-F48 HydrophobicContact SD-CE2 3.59Å; M44-F48 VanDerWaalsContact SD-CE2 3.59Å; M44-F48 HydrophobicContact SD-CZ 4.13Å
45G57.6Low64.7Low22 Ų2297.6 Ų97.623%0.22750%0.501CS..Hα-helixtrans-63.5-43.517700000113.2T42 D43 F48 E49T42-G45 WeakPolarHBondContact O-CA 3.49Å; T42-G45 PolarHBondContact O-N 3.42Å; D43-G45 PolarHBondContact O-N 2.87Å; G45-F48 PolarHBondContact O-N 3.49Å; G45-E49 WeakPolarHBondContact O-CB 3.2Å; G45-E49 VanDerWaalsContact O-CG 3.3Å; G45-E49 WeakPolarHBondContact O-CG 3.26Å; G45-E49 PolarHBondContact O-N 3.48Å
46I58.8Low67.1Low82 Ų8291.1 Ų91.142%0.42147%0.472SS..Hα-helixtrans-68.5-39.4178-61.6174.5000110.6D43 E49 L50D43-I46 PolarHBondContact O-N 3.17Å; I46-E49 PolarHBondContact O-N 3.27Å; I46-L50 HydrophobicContact CG2-CD1 3.99Å; I46-L50 HydrophobicContact CG2-CG 4.49Å; I46-L50 PolarHBondContact O-N 2.8Å
47F59.7Low69.6Low98 Ų9886.4 Ų86.443%0.4345%0.447SS..Hα-helixtrans-59.1-47.9173.4179.5-89.9000111.8D43 M44 E49 Y51 I112D43-F47 PolarHBondContact O-N 3.36Å; M44-F47 PolarHBondContact O-N 3.12Å; F47-E49 VanDerWaalsContact C-N 3.26Å; F47-E49 PolarHBondContact O-N 3.46Å; F47-Y51 VanDerWaalsContact O-CB 3.31Å; F47-Y51 WeakPolarHBondContact O-CB 3.32Å; F47-Y51 PolarHBondContact O-N 2.9Å; F47-Y51 VanDerWaalsContact O-N 3.14Å; F47-I112 HydrophobicContact CD2-CD1 4.26Å; F47-I112 HydrophobicContact CD2-CG1 3.79Å; F47-I112 HydrophobicContact CE2-CD1 3.78Å; F47-I112 HydrophobicContact CE2-CG1 3.85Å
48F64.1Low72.3Confident130 Ų13081.5 Ų81.557%0.5742%0.419SS*.Hα-helixtrans-67.4-23.8177.5-74-59.7000113.5M44 G45 P52M44-F48 HydrophobicContact CB-CE2 4.37Å; M44-F48 HydrophobicContact CE-CE2 4Å; M44-F48 WeakPolarHBondContact O-CD2 3.43Å; M44-F48 PolarHBondContact O-N 2.8Å; M44-F48 HydrophobicContact SD-CE2 3.59Å; M44-F48 VanDerWaalsContact SD-CE2 3.59Å; M44-F48 HydrophobicContact SD-CZ 4.13Å; G45-F48 PolarHBondContact O-N 3.49Å; F48-P52 VanDerWaalsContact O-CD 3.25Å; F48-P52 WeakPolarHBondContact O-CD 3.19Å
49E77.7Confident74.8Confident119 Ų11977.1 Ų77.156%0.55640%0.398SS*.Hα-helixtrans-81.6-39.9177.7-77.4177-171.700113.4G45 I46 F47G45-E49 WeakPolarHBondContact O-CB 3.2Å; G45-E49 VanDerWaalsContact O-CG 3.3Å; G45-E49 WeakPolarHBondContact O-CG 3.26Å; G45-E49 PolarHBondContact O-N 3.48Å; I46-E49 PolarHBondContact O-N 3.27Å; F47-E49 VanDerWaalsContact C-N 3.26Å; F47-E49 PolarHBondContact O-N 3.46Å
50L86.7Confident77.2Confident34 Ų3470.5 Ų70.518%0.17836%0.358CS..Hα-helixtrans-87-28.4-176.6-70.9176.3000113.9I46 L53 F54 I112I46-L50 HydrophobicContact CG2-CD1 3.99Å; I46-L50 HydrophobicContact CG2-CG 4.49Å; I46-L50 PolarHBondContact O-N 2.8Å; L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.93Å; L50-F54 PolarHBondContact O-N 2.69Å; L50-I112 HydrophobicContact CB-CB 4.37Å; L50-I112 HydrophobicContact CB-CG2 3.85Å
51Y92.3Very high79.8Confident93 Ų9362 Ų6237%0.36532%0.321SS..Hα-helixtrans-59-41.1-177-173.7-105.2000113.9F47 L53 F54 Q55 I112F47-Y51 VanDerWaalsContact O-CB 3.31Å; F47-Y51 WeakPolarHBondContact O-CB 3.32Å; F47-Y51 PolarHBondContact O-N 2.9Å; F47-Y51 VanDerWaalsContact O-N 3.14Å; Y51-L53 PolarHBondContact O-N 3.37Å; Y51-F54 AromaticContact CD2-CD1 3.79Å; Y51-F54 HydrophobicContact CD2-CD1 3.79Å; Y51-F54 HydrophobicContact CD2-CE1 4.39Å; Y51-F54 AromaticContact CE2-CD1 3.72Å; Y51-F54 HydrophobicContact CE2-CD1 3.72Å; Y51-F54 AromaticContact CE2-CE1 3.88Å; Y51-F54 HydrophobicContact CE2-CE1 3.88Å; Y51-F54 WeakPolarHBondContact O-CB 3.36Å; Y51-F54 PolarHBondContact O-N 2.97Å; Y51-Q55 HydrophobicContact CD1-CG 4.16Å; Y51-Q55 HydrophobicContact CE1-CG 3.8Å; Y51-Q55 HydrophobicContact CE2-CG 4.5Å; Y51-Q55 WeakPolarHBondContact O-CG 3.45Å; Y51-Q55 PolarHBondContact O-N 3.09Å; Y51-I112 HydrophobicContact CD2-CD1 4.01Å
52P95.4Very high82.3Confident60 Ų6059.8 Ų59.839%0.3930%0.302SS..Hα-helixtrans-61.3-41.8174.5-24.535.6000113.1F48 F54 Q55 D56F48-P52 VanDerWaalsContact O-CD 3.25Å; F48-P52 WeakPolarHBondContact O-CD 3.19Å; P52-F54 VanDerWaalsContact C-N 3.33Å; P52-F54 PolarHBondContact O-N 2.71Å; P52-Q55 PolarHBondContact O-N 3.28Å; P52-D56 PolarHBondContact O-N 2.66Å
53L95.4Very high84.5Confident20 Ų2056.4 Ų56.411%0.10528%0.281CS..Hα-helixtrans-64.7-40.5176.8-61.3174.2000110.8L50 Y51 D56 V57 A228 Q236L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.93Å; Y51-L53 PolarHBondContact O-N 3.37Å; L53-D56 PolarHBondContact O-N 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.04Å; L53-A228 HydrophobicContact CB-CB 4.33Å; L53-Q236 VanDerWaalsContact CD1-NE2 3.33Å
54F96.9Very high86.8Confident15 Ų1553 Ų537%0.06626%0.263CS..Hα-helixtrans-56.5-48.7170.9159.2-100.9000111.7L50 Y51 P52 D56 V57 H58 I112 M115 I116 D119L50-F54 PolarHBondContact O-N 2.69Å; Y51-F54 AromaticContact CD2-CD1 3.79Å; Y51-F54 HydrophobicContact CD2-CD1 3.79Å; Y51-F54 HydrophobicContact CD2-CE1 4.39Å; Y51-F54 AromaticContact CE2-CD1 3.72Å; Y51-F54 HydrophobicContact CE2-CD1 3.72Å; Y51-F54 AromaticContact CE2-CE1 3.88Å; Y51-F54 HydrophobicContact CE2-CE1 3.88Å; Y51-F54 WeakPolarHBondContact O-CB 3.36Å; Y51-F54 PolarHBondContact O-N 2.97Å; P52-F54 VanDerWaalsContact C-N 3.33Å; P52-F54 PolarHBondContact O-N 2.71Å; F54-D56 VanDerWaalsContact C-N 3.3Å; F54-D56 PolarHBondContact O-N 2.82Å; F54-V57 PolarHBondContact O-N 3.36Å; F54-H58 HydrophobicContact CE2-CB 4.13Å; F54-H58 AromaticContact CE2-ND1 3.79Å; F54-H58 HydrophobicContact CZ-CB 4.14Å; F54-H58 AromaticContact CZ-CG 3.92Å; F54-H58 AromaticContact CZ-ND1 3.85Å; F54-H58 VanDerWaalsContact O-CB 3.25Å; F54-H58 WeakPolarHBondContact O-CB 3.4Å; F54-H58 PolarHBondContact O-N 3.24Å; F54-I112 HydrophobicContact CB-CG2 3.72Å; F54-I112 HydrophobicContact CG-CG2 4.31Å; F54-M115 HydrophobicContact CD2-CB 4Å; F54-M115 HydrophobicContact CD2-CE 4.43Å; F54-M115 HydrophobicContact CE1-CE 3.96Å; F54-M115 HydrophobicContact CE2-CB 3.93Å; F54-M115 HydrophobicContact CE2-CE 3.74Å; F54-M115 HydrophobicContact CZ-CE 3.47Å; F54-M115 VanDerWaalsContact CZ-CE 3.47Å; F54-I116 HydrophobicContact CB-CD1 4.02Å; F54-I116 HydrophobicContact CB-CG1 3.7Å; F54-I116 HydrophobicContact CD2-CG1 4.18Å; F54-I116 HydrophobicContact CG-CG1 4.45Å; F54-D119 VanDerWaalsContact CE2-OD2 3.29Å; F54-D119 WeakPolarHBondContact CE2-OD2 3.49Å
55Q98.4Very high89.1Confident88 Ų8847.4 Ų47.441%0.41124%0.235SC..Hα-helixtrans-58.6-43.2-179.9-70.4-179.1-61.900111.7Y51 P52 H58 V59Y51-Q55 HydrophobicContact CD1-CG 4.16Å; Y51-Q55 HydrophobicContact CE1-CG 3.8Å; Y51-Q55 HydrophobicContact CE2-CG 4.5Å; Y51-Q55 WeakPolarHBondContact O-CG 3.45Å; Y51-Q55 PolarHBondContact O-N 3.09Å; P52-Q55 PolarHBondContact O-N 3.28Å; Q55-H58 PolarHBondContact O-N 2.81Å; Q55-V59 VanDerWaalsContact O-CG2 3.29Å; Q55-V59 WeakPolarHBondContact O-CG2 3.47Å; Q55-V59 PolarHBondContact O-N 2.93Å
56D98.6Very high91Very high38 Ų3846.3 Ų46.320%0.20322%0.224CC..Hα-helixtrans-61-49.9177.3-71.1-11000111.6P52 L53 F54 H58 V59 M60 F221 S224P52-D56 PolarHBondContact O-N 2.66Å; L53-D56 PolarHBondContact O-N 3.23Å; F54-D56 VanDerWaalsContact C-N 3.3Å; F54-D56 PolarHBondContact O-N 2.82Å; D56-H58 VanDerWaalsContact C-N 3.34Å; D56-H58 PolarHBondContact O-N 3.07Å; D56-V59 PolarHBondContact O-N 3.07Å; D56-M60 WeakPolarHBondContact O-CG 3.43Å; D56-M60 PolarHBondContact O-N 3.02Å; D56-F221 HydrophobicContact CB-CB 3.98Å; D56-F221 HydrophobicContact CB-CD1 4.16Å; D56-F221 HydrophobicContact CB-CD2 4.32Å; D56-F221 HydrophobicContact CB-CG 3.92Å; D56-S224 VanDerWaalsContact OD2-CB 3.31Å; D56-S224 WeakPolarHBondContact OD2-CB 3.39Å; D56-S224 PolarHBondContact OD2-OG 2.85Å
57V98.6Very high92.9Very high0 Ų045.3 Ų45.30%022%0.217CC..Hα-helixtrans-60.4-44.7176.3176.90000110.7L53 F54 V59 M60 I61 D119 F120 F225 A228L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.04Å; F54-V57 PolarHBondContact O-N 3.36Å; V57-V59 VanDerWaalsContact C-N 3.32Å; V57-V59 PolarHBondContact O-N 2.85Å; V57-M60 WeakPolarHBondContact O-CA 3.41Å; V57-M60 VanDerWaalsContact O-CB 3.26Å; V57-M60 WeakPolarHBondContact O-CB 3.44Å; V57-M60 PolarHBondContact O-N 2.97Å; V57-I61 WeakPolarHBondContact O-CG1 3.31Å; V57-I61 PolarHBondContact O-N 2.9Å; V57-D119 HydrophobicContact CG1-CB 3.71Å; V57-F120 HydrophobicContact CG1-CD1 4.14Å; V57-F120 HydrophobicContact CG1-CE1 3.92Å; V57-F120 HydrophobicContact CG2-CE1 4.23Å; V57-F225 HydrophobicContact CG1-CD2 4.02Å; V57-F225 HydrophobicContact CG1-CE2 4.31Å; V57-F225 HydrophobicContact CG2-CB 4.33Å; V57-F225 HydrophobicContact CG2-CD2 4.2Å; V57-A228 HydrophobicContact CG2-CB 4.25Å
58H98.8Very high94.7Very high60 Ų6041 Ų4128%0.27820%0.199SC..Hα-helixtrans-61.6-40.6179.7-158.672.7000111.6F54 Q55 D56 M60 I61 F62 D119F54-H58 HydrophobicContact CE2-CB 4.13Å; F54-H58 AromaticContact CE2-ND1 3.79Å; F54-H58 HydrophobicContact CZ-CB 4.14Å; F54-H58 AromaticContact CZ-CG 3.92Å; F54-H58 AromaticContact CZ-ND1 3.85Å; F54-H58 VanDerWaalsContact O-CB 3.25Å; F54-H58 WeakPolarHBondContact O-CB 3.4Å; F54-H58 PolarHBondContact O-N 3.24Å; Q55-H58 PolarHBondContact O-N 2.81Å; D56-H58 VanDerWaalsContact C-N 3.34Å; D56-H58 PolarHBondContact O-N 3.07Å; H58-M60 VanDerWaalsContact C-N 3.31Å; H58-M60 PolarHBondContact O-N 3.17Å; H58-I61 PolarHBondContact O-N 3.06Å; H58-I61 VanDerWaalsContact O-N 3.15Å; H58-F62 AromaticContact CD2-CD2 3.88Å; H58-F62 AromaticContact CE1-CD2 3.86Å; H58-F62 AromaticContact CE1-CE2 3.22Å; H58-F62 WeakPolarHBondContact CE1-CE2 3.29Å; H58-F62 AromaticContact ND1-CE2 3.62Å; H58-F62 AromaticContact NE2-CD2 3.73Å; H58-F62 AromaticContact NE2-CE2 3.47Å; H58-F62 WeakPolarHBondContact NE2-CE2 3.43Å; H58-F62 WeakPolarHBondContact O-CD2 3.33Å; H58-F62 PolarHBondContact O-N 3.4Å; H58-F62 VanDerWaalsContact O-N 3.09Å; H58-D119 IonicContact CE1-OD1 2.89Å; H58-D119 IonicContact CG-OD1 2.72Å; H58-D119 IonicContact ND1-OD1 2.77Å; H58-D119 PolarHBondContact ND1-OD1 3.09Å; H58-D119 IonicContact ND1-OD2 3.93Å; H58-D119 PolarHBondContact ND1-OD2 3.28Å
59V98.9Very high96.4Very high43 Ų4335.1 Ų35.126%0.26117%0.173SC..Hα-helixtrans-63.9-37.4173.9174.70000111.3Q55 D56 V57 I61 V63 G64 F217 F221Q55-V59 VanDerWaalsContact O-CG2 3.29Å; Q55-V59 WeakPolarHBondContact O-CG2 3.47Å; Q55-V59 PolarHBondContact O-N 2.93Å; D56-V59 PolarHBondContact O-N 3.07Å; V57-V59 VanDerWaalsContact C-N 3.32Å; V57-V59 PolarHBondContact O-N 2.85Å; V59-I61 VanDerWaalsContact C-N 3.29Å; V59-I61 PolarHBondContact O-N 3.14Å; V59-V63 HydrophobicContact CG1-CB 3.93Å; V59-V63 HydrophobicContact CG1-CG2 4.07Å; V59-V63 WeakPolarHBondContact O-CA 3.37Å; V59-V63 WeakPolarHBondContact O-CB 3.36Å; V59-V63 PolarHBondContact O-N 3.34Å; V59-G64 PolarHBondContact O-N 3.08Å; V59-F217 HydrophobicContact CG1-CB 4.4Å; V59-F217 HydrophobicContact CG1-CD1 3.43Å; V59-F217 VanDerWaalsContact CG1-CD1 3.43Å; V59-F217 HydrophobicContact CG1-CE1 3.93Å; V59-F217 HydrophobicContact CG1-CG 4.11Å; V59-F221 HydrophobicContact CB-CD2 3.91Å; V59-F221 HydrophobicContact CB-CE2 3.77Å; V59-F221 HydrophobicContact CG1-CD2 3.9Å; V59-F221 HydrophobicContact CG1-CE2 3.61Å; V59-F221 HydrophobicContact CG2-CE2 4.26Å
60M98.8Very high97.3Very high2 Ų230 Ų301%0.0115%0.149CC..Iπ-helixtrans-59.6-39.5173.2-67.5176.466.500112.1D56 V57 H58 G64 F65 L218 F221 W222 F225D56-M60 WeakPolarHBondContact O-CG 3.43Å; D56-M60 PolarHBondContact O-N 3.02Å; V57-M60 WeakPolarHBondContact O-CA 3.41Å; V57-M60 VanDerWaalsContact O-CB 3.26Å; V57-M60 WeakPolarHBondContact O-CB 3.44Å; V57-M60 PolarHBondContact O-N 2.97Å; H58-M60 VanDerWaalsContact C-N 3.31Å; H58-M60 PolarHBondContact O-N 3.17Å; M60-G64 CarbonylContact O-C 3.21Å; M60-G64 WeakPolarHBondContact O-CA 3.47Å; M60-G64 PolarHBondContact O-N 2.94Å; M60-F65 WeakPolarHBondContact O-CD2 3.36Å; M60-F65 PolarHBondContact O-N 3.42Å; M60-L218 HydrophobicContact CB-CD2 3.8Å; M60-L218 HydrophobicContact CE-CD2 3.84Å; M60-L218 HydrophobicContact CG-CD2 4.13Å; M60-F221 HydrophobicContact CG-CB 3.68Å; M60-F221 HydrophobicContact SD-CB 3.73Å; M60-W222 HydrophobicContact CE-CB 4.41Å; M60-W222 HydrophobicContact CE-CD2 3.95Å; M60-W222 HydrophobicContact CE-CE3 4.07Å; M60-W222 HydrophobicContact CE-CG 4.13Å; M60-F225 HydrophobicContact CE-CB 3.91Å; M60-F225 HydrophobicContact CE-CD2 3.84Å; M60-F225 HydrophobicContact CE-CG 4.01Å; M60-F225 HydrophobicContact SD-CB 3.7Å; M60-F225 HydrophobicContact SD-CD2 3.97Å; M60-F225 HydrophobicContact SD-CG 4.23Å
61I98.8Very high97.9Very high0 Ų029.4 Ų29.40%015%0.146CC..Iπ-helixtrans-66.7-51179-57.5-40.5000111.7V57 H58 V59 F65 N83 A87 D119 A122 A123 L126V57-I61 WeakPolarHBondContact O-CG1 3.31Å; V57-I61 PolarHBondContact O-N 2.9Å; H58-I61 PolarHBondContact O-N 3.06Å; H58-I61 VanDerWaalsContact O-N 3.15Å; V59-I61 VanDerWaalsContact C-N 3.29Å; V59-I61 PolarHBondContact O-N 3.14Å; I61-F65 HydrophobicContact CD1-CD2 4.5Å; I61-N83 PolarHBondContact O-ND2 3.33Å; I61-A87 HydrophobicContact CG2-CB 3.59Å; I61-D119 HydrophobicContact CD1-CB 4.5Å; I61-D119 WeakPolarHBondContact CD1-O 3.42Å; I61-D119 HydrophobicContact CG1-CB 3.87Å; I61-D119 VanDerWaalsContact CG1-OD1 3.26Å; I61-D119 WeakPolarHBondContact CG1-OD1 3.49Å; I61-A122 HydrophobicContact CG2-CB 4.29Å; I61-A123 HydrophobicContact CD1-CB 3.57Å; I61-L126 HydrophobicContact CG2-CD1 3.66Å
62F98.8Very high98.2Very high42 Ų4225 Ų2518%0.18413%0.129CC..Iπ-helixtrans-88.3-41.8-170.9-70.8-81.8000113.7H58 L84 A87 L91H58-F62 AromaticContact CD2-CD2 3.88Å; H58-F62 AromaticContact CE1-CD2 3.86Å; H58-F62 AromaticContact CE1-CE2 3.22Å; H58-F62 WeakPolarHBondContact CE1-CE2 3.29Å; H58-F62 AromaticContact ND1-CE2 3.62Å; H58-F62 AromaticContact NE2-CD2 3.73Å; H58-F62 AromaticContact NE2-CE2 3.47Å; H58-F62 WeakPolarHBondContact NE2-CE2 3.43Å; H58-F62 WeakPolarHBondContact O-CD2 3.33Å; H58-F62 PolarHBondContact O-N 3.4Å; H58-F62 VanDerWaalsContact O-N 3.09Å; F62-L84 HydrophobicContact CD1-CD1 3.61Å; F62-L84 HydrophobicContact CE1-CD1 3.58Å; F62-A87 HydrophobicContact CD1-CB 4.17Å; F62-A87 HydrophobicContact CE1-CB 3.45Å; F62-A87 VanDerWaalsContact CE1-CB 3.45Å; F62-A87 HydrophobicContact CE2-CB 4.29Å; F62-A87 HydrophobicContact CZ-CB 3.53Å; F62-L91 HydrophobicContact CE2-CD1 3.99Å; F62-L91 HydrophobicContact CZ-CD1 3.77Å
63V98.8Very high98.2Very high42 Ų4224.7 Ų24.726%0.25512%0.121SC..Iπ-helixtrans-94.8-47.6-178.9-177.80000110.4V59 F67 I213 F217V59-V63 HydrophobicContact CG1-CB 3.93Å; V59-V63 HydrophobicContact CG1-CG2 4.07Å; V59-V63 WeakPolarHBondContact O-CA 3.37Å; V59-V63 WeakPolarHBondContact O-CB 3.36Å; V59-V63 PolarHBondContact O-N 3.34Å; V63-F67 HydrophobicContact CG1-CD2 3.92Å; V63-F67 HydrophobicContact CG1-CE2 4.42Å; V63-F67 VanDerWaalsContact O-CB 3.31Å; V63-F67 WeakPolarHBondContact O-CB 3.44Å; V63-F67 PolarHBondContact O-N 3.05Å; V63-I213 HydrophobicContact CG1-CG2 4.21Å; V63-F217 HydrophobicContact CG1-CB 4.39Å; V63-F217 HydrophobicContact CG1-CD2 3.67Å; V63-F217 HydrophobicContact CG1-CE2 4.08Å; V63-F217 HydrophobicContact CG1-CG 3.99Å
64G98.8Very high98.3Very high0 Ų026.8 Ų26.80%013%0.129CC..Iπ-helixtrans-56.3-72.5-177.300000113V59 M60 G66 L68 G214V59-G64 PolarHBondContact O-N 3.08Å; M60-G64 CarbonylContact O-C 3.21Å; M60-G64 WeakPolarHBondContact O-CA 3.47Å; M60-G64 PolarHBondContact O-N 2.94Å; G64-G66 PolarHBondContact O-N 2.86Å; G64-L68 WeakPolarHBondContact O-CB 3.36Å; G64-L68 PolarHBondContact O-N 2.86Å; G64-G214 WeakPolarHBondContact O-CA 3.38Å
65F98.4Very high98.3Very high7 Ų726.3 Ų26.33%0.03113%0.127CC..Iπ-helixtrans-60.3-44.9176.5-78.8-79.5000112M60 I61 F67 L68 M69 N83 A123 L126 I127 L218 H334M60-F65 WeakPolarHBondContact O-CD2 3.36Å; M60-F65 PolarHBondContact O-N 3.42Å; I61-F65 HydrophobicContact CD1-CD2 4.5Å; F65-F67 PolarHBondContact O-N 2.83Å; F65-L68 PolarHBondContact O-N 3Å; F65-M69 HydrophobicContact CB-CE 4.2Å; F65-M69 VanDerWaalsContact O-CE 3.24Å; F65-M69 WeakPolarHBondContact O-CE 3.32Å; F65-M69 PolarHBondContact O-N 3.07Å; F65-N83 WeakPolarHBondContact CB-OD1 3.08Å; F65-A123 HydrophobicContact CE2-CB 4.28Å; F65-L126 HydrophobicContact CB-CB 4.27Å; F65-L126 HydrophobicContact CB-CD1 3.91Å; F65-L126 HydrophobicContact CD1-CB 4.07Å; F65-L126 HydrophobicContact CD2-CB 4.46Å; F65-L126 HydrophobicContact CD2-CD1 4.2Å; F65-L126 HydrophobicContact CG-CB 4.03Å; F65-L126 HydrophobicContact CG-CD1 4.15Å; F65-I127 HydrophobicContact CE1-CG1 3.72Å; F65-I127 HydrophobicContact CZ-CD1 4.35Å; F65-I127 HydrophobicContact CZ-CG1 3.81Å; F65-L218 HydrophobicContact CD2-CD2 4.1Å; F65-L218 HydrophobicContact CE2-CD2 4.13Å; F65-H334 AromaticContact CE1-NE2 3.95Å
66G98.1Very high98.3Very high0 Ų023.1 Ų23.10%012%0.118CC..Hα-helixtrans-55.2-50-17700000113G64 T70 N83G64-G66 PolarHBondContact O-N 2.86Å; G66-T70 WeakPolarHBondContact O-CG2 3.36Å; G66-N83 VanDerWaalsContact CA-CG 3.46Å; G66-N83 PolarHBondContact N-OD1 2.69Å
67F98.7Very high98.3Very high60 Ų6025.7 Ų25.726%0.26313%0.127SC..Hα-helixtrans-78.8-35177.7-82.2-91000113V63 F65 M69 T70 V80 F210 A211 I213V63-F67 HydrophobicContact CG1-CD2 3.92Å; V63-F67 HydrophobicContact CG1-CE2 4.42Å; V63-F67 VanDerWaalsContact O-CB 3.31Å; V63-F67 WeakPolarHBondContact O-CB 3.44Å; V63-F67 PolarHBondContact O-N 3.05Å; F65-F67 PolarHBondContact O-N 2.83Å; F67-M69 PolarHBondContact O-N 3.39Å; F67-M69 VanDerWaalsContact O-N 3.14Å; F67-T70 HydrophobicContact CD1-CG2 4.44Å; F67-T70 WeakPolarHBondContact O-CB 3.47Å; F67-T70 PolarHBondContact O-N 3.35Å; F67-T70 PolarHBondContact O-OG1 3.15Å; F67-V80 HydrophobicContact CD2-CG2 4.49Å; F67-V80 HydrophobicContact CE2-CG2 4.29Å; F67-F210 HydrophobicContact CD1-CB 4.3Å; F67-F210 HydrophobicContact CD1-CD1 4.14Å; F67-F210 AromaticContact CE1-CD1 3.87Å; F67-F210 HydrophobicContact CE1-CD1 3.87Å; F67-F210 HydrophobicContact CE1-CE1 4.49Å; F67-A211 VanDerWaalsContact O-CA 3.29Å; F67-A211 WeakPolarHBondContact O-CA 3.34Å; F67-I213 HydrophobicContact CB-CB 4.34Å; F67-I213 HydrophobicContact CD1-CB 4.49Å; F67-I213 HydrophobicContact CD1-CD1 4.49Å; F67-I213 HydrophobicContact CG-CB 4.45Å; F67-I213 HydrophobicContact CG-CG2 4.41Å
68L98.6Very high98.3Very high9 Ų925.7 Ų25.75%0.04713%0.127CC..Hα-helixtrans-53.6-39.9178.6177.864.1000111.5G64 F65 T70 T215 L218 Q273 L277G64-L68 WeakPolarHBondContact O-CB 3.36Å; G64-L68 PolarHBondContact O-N 2.86Å; F65-L68 PolarHBondContact O-N 3Å; L68-T70 PolarHBondContact O-N 3.32Å; L68-T215 WeakPolarHBondContact CD1-OG1 3.37Å; L68-L218 HydrophobicContact CB-CD1 4.3Å; L68-L218 HydrophobicContact CD2-CD1 3.71Å; L68-Q273 HydrophobicContact CD1-CB 4.09Å; L68-L277 HydrophobicContact CD2-CD1 4.24Å
69M98.3Very high98.2Very high5 Ų522.8 Ų22.83%0.02511%0.114CC..G310 helixtrans-75.8-4.9179-68.8-174.5-74.100114.3F65 F67 F71 S79 N83 F129 L133F65-M69 HydrophobicContact CB-CE 4.2Å; F65-M69 VanDerWaalsContact O-CE 3.24Å; F65-M69 WeakPolarHBondContact O-CE 3.32Å; F65-M69 PolarHBondContact O-N 3.07Å; F67-M69 PolarHBondContact O-N 3.39Å; F67-M69 VanDerWaalsContact O-N 3.14Å; M69-F71 PolarHBondContact O-N 2.94Å; M69-S79 VanDerWaalsContact O-CB 3.3Å; M69-S79 WeakPolarHBondContact O-CB 3.42Å; M69-S79 PolarHBondContact O-OG 3.42Å; M69-N83 HydrophobicContact CE-CB 4.11Å; M69-N83 VanDerWaalsContact CE-OD1 3.23Å; M69-N83 WeakPolarHBondContact CE-OD1 3.39Å; M69-F129 HydrophobicContact CE-CD1 3.65Å; M69-F129 HydrophobicContact CE-CE1 3.9Å; M69-F129 HydrophobicContact SD-CD1 3.68Å; M69-F129 HydrophobicContact SD-CE1 4.01Å; M69-F129 HydrophobicContact SD-CG 4.33Å; M69-L133 HydrophobicContact CB-CD1 4.46Å; M69-L133 HydrophobicContact CB-CD2 3.78Å; M69-L133 HydrophobicContact CG-CD2 4.07Å; M69-L133 HydrophobicContact SD-CD1 4.2Å; M69-L133 HydrophobicContact SD-CD2 4.33Å
70T98.3Very high98.2Very high11 Ų1123.1 Ų23.17%0.06712%0.116CC..G310 helixtrans-78.82.5179.565.10000113.9G66 F67 L68 L72 V80 S207 F210G66-T70 WeakPolarHBondContact O-CG2 3.36Å; F67-T70 HydrophobicContact CD1-CG2 4.44Å; F67-T70 WeakPolarHBondContact O-CB 3.47Å; F67-T70 PolarHBondContact O-N 3.35Å; F67-T70 PolarHBondContact O-OG1 3.15Å; L68-T70 PolarHBondContact O-N 3.32Å; T70-L72 PolarHBondContact O-N 3.23Å; T70-L72 VanDerWaalsContact O-N 3.15Å; T70-V80 HydrophobicContact CG2-CB 4.34Å; T70-S207 WeakPolarHBondContact O-CB 3.33Å; T70-F210 WeakPolarHBondContact OG1-CB 3.29Å
71F98.3Very high98.2Very high23 Ų2324 Ų2410%0.10113%0.125CC..G310 helixtrans-57.1-29.9177.978.9-85.8000112.6M69 K73 L133 S203 S207 A211 T327M69-F71 PolarHBondContact O-N 2.94Å; F71-K73 PolarHBondContact O-N 3.14Å; F71-L133 HydrophobicContact CE1-CD2 4.37Å; F71-S203 WeakPolarHBondContact O-CA 3.17Å; F71-S203 WeakPolarHBondContact O-CB 3.38Å; F71-S207 WeakPolarHBondContact O-CB 3.33Å; F71-S207 PolarHBondContact O-OG 2.91Å; F71-A211 HydrophobicContact CB-CB 3.8Å; F71-T327 HydrophobicContact CZ-CG2 4.31Å
72L97.9Very high98.2Very high1 Ų124.1 Ų24.11%0.00513%0.126CC..BIsolated β-bridgetrans-65.3113.2176.6-71.1170.7000111.8T70 K74 Y75 L133 E201 T327 Y397T70-L72 PolarHBondContact O-N 3.23Å; T70-L72 VanDerWaalsContact O-N 3.15Å; L72-K74 PolarHBondContact O-N 2.8Å; L72-Y75 HydrophobicContact CD1-CD1 4.02Å; L72-Y75 HydrophobicContact CD1-CG 4.23Å; L72-Y75 PolarHBondContact O-N 3.45Å; L72-Y75 VanDerWaalsContact O-N 3.07Å; L72-L133 HydrophobicContact CD1-CD2 3.65Å; L72-L133 HydrophobicContact CD1-CG 3.95Å; L72-E201 HydrophobicContact CD2-CG 4.32Å; L72-T327 HydrophobicContact CD1-CG2 4.12Å; L72-Y397 HydrophobicContact CD1-CD1 3.83Å; L72-Y397 HydrophobicContact CD2-CD1 4.02Å
73K95.9Very high98.2Very high52 Ų5222.1 Ų22.123%0.22612%0.117CC..THydrogen-bonded Turntrans-55.5-23.8-170.365.3172.1176.2-178.80116.1F71 E199 E202 A204F71-K73 PolarHBondContact O-N 3.14Å; K73-E199 VanDerWaalsContact CE-O 3.26Å; K73-E199 WeakPolarHBondContact CE-O 3.27Å; K73-E199 PolarHBondContact NZ-O 2.96Å; K73-E202 HydrophobicContact CD-CG 3.73Å; K73-E202 WeakPolarHBondContact CE-OE1 3.36Å; K73-E202 HydrophobicContact CG-CG 4.32Å; K73-E202 WeakPolarHBondContact CG-O 3.46Å; K73-E202 PolarHBondContact N-O 3.24Å; K73-E202 VanDerWaalsContact NZ-CD 3.34Å; K73-E202 IonicContact NZ-OE1 2.8Å; K73-E202 PolarHBondContact NZ-OE1 3.12Å; K73-A204 HydrophobicContact CB-CB 3.94Å
74K96.9Very high98.2Very high65 Ų6524.9 Ų24.928%0.28313%0.13SC..THydrogen-bonded Turntrans-124.111.6-177.3-77.8-172.7-171.31670113.8L72 N200 Y397 D398 D399L72-K74 PolarHBondContact O-N 2.8Å; K74-N200 WeakPolarHBondContact CD-OD1 3.45Å; K74-N200 PolarHBondContact NZ-OD1 2.85Å; K74-Y397 CarbonylContact C-O 3.59Å; K74-D398 CarbonylContact O-C 3.5Å; K74-D398 WeakPolarHBondContact O-CA 3.22Å; K74-D399 VanDerWaalsContact O-CG 3.29Å; K74-D399 PolarHBondContact O-N 3Å
75Y98.3Very high98.2Very high4 Ų427.1 Ų27.12%0.01614%0.142CC..  trans-124.914.8-176.5-153.5-108.4000113.1L72 F77 S78 S79 L133 G134 Y397 D399L72-Y75 HydrophobicContact CD1-CD1 4.02Å; L72-Y75 HydrophobicContact CD1-CG 4.23Å; L72-Y75 PolarHBondContact O-N 3.45Å; L72-Y75 VanDerWaalsContact O-N 3.07Å; Y75-F77 PolarHBondContact O-N 2.88Å; Y75-S78 VanDerWaalsContact CE2-CB 3.48Å; Y75-S78 PolarHBondContact O-N 3.39Å; Y75-S79 WeakPolarHBondContact O-CB 3.48Å; Y75-S79 PolarHBondContact O-N 2.92Å; Y75-S79 PolarHBondContact O-OG 3.45Å; Y75-L133 HydrophobicContact CD1-CD1 3.97Å; Y75-L133 HydrophobicContact CD1-CG 4.17Å; Y75-L133 HydrophobicContact CE1-CD1 3.69Å; Y75-L133 HydrophobicContact CE1-CG 4.13Å; Y75-G134 VanDerWaalsContact CZ-CA 3.43Å; Y75-Y397 VanDerWaalsContact CD2-C 3.47Å; Y75-D399 WeakPolarHBondContact CA-OD1 3.48Å; Y75-D399 WeakPolarHBondContact CA-OD2 3.5Å
76G97.6Very high98.2Very high21 Ų2126.8 Ų26.822%0.21614%0.14CC..Hα-helixtrans-61.3-37.8-174.800000114V80 D399G76-V80 WeakPolarHBondContact O-CG1 3.47Å; G76-V80 PolarHBondContact O-N 2.97Å; G76-D399 PolarHBondContact N-OD2 3.28Å
77F98.2Very high98.2Very high92 Ų9226.8 Ų26.840%0.40414%0.14SC..Hα-helixtrans-68.3-43.6178.5-67.4-0.5000110.9Y75 G81 D399 W403 V405Y75-F77 PolarHBondContact O-N 2.88Å; F77-G81 VanDerWaalsContact O-CA 3.27Å; F77-G81 WeakPolarHBondContact O-CA 3.3Å; F77-G81 PolarHBondContact O-N 2.98Å; F77-D399 HydrophobicContact CB-CB 4.34Å; F77-D399 PolarHBondContact N-OD2 3.02Å; F77-W403 HydrophobicContact CB-CD2 3.97Å; F77-W403 HydrophobicContact CB-CG 3.98Å; F77-W403 HydrophobicContact CD2-CB 4.01Å; F77-W403 HydrophobicContact CD2-CD2 4.44Å; F77-W403 HydrophobicContact CD2-CG 4.16Å; F77-V405 HydrophobicContact CD2-CG1 4.38Å; F77-V405 HydrophobicContact CE2-CG1 4.33Å
78S98.5Very high98.2Very high0 Ų026 Ų260%014%0.144CC..Hα-helixtrans-67.4-39.8177.4-58.90000111.4Y75 I82 D399 W403Y75-S78 VanDerWaalsContact CE2-CB 3.48Å; Y75-S78 PolarHBondContact O-N 3.39Å; S78-I82 WeakPolarHBondContact O-CA 3.44Å; S78-I82 WeakPolarHBondContact O-CB 3.24Å; S78-I82 VanDerWaalsContact O-CG1 3.25Å; S78-I82 WeakPolarHBondContact O-CG1 3.39Å; S78-I82 PolarHBondContact O-N 3.27Å; S78-D399 WeakPolarHBondContact CB-OD1 2.94Å; S78-D399 PolarHBondContact N-OD1 3.16Å; S78-D399 PolarHBondContact OG-OD1 3.17Å; S78-W403 VanDerWaalsContact OG-CD1 3.29Å; S78-W403 PolarHBondContact OG-NE1 3.27Å
79S97.9Very high98.3Very high0 Ų026 Ų260%015%0.145CC..Hα-helixtrans-56.2-60.2175.8-66.30000111.5M69 Y75 N83M69-S79 VanDerWaalsContact O-CB 3.3Å; M69-S79 WeakPolarHBondContact O-CB 3.42Å; M69-S79 PolarHBondContact O-OG 3.42Å; Y75-S79 WeakPolarHBondContact O-CB 3.48Å; Y75-S79 PolarHBondContact O-N 2.92Å; Y75-S79 PolarHBondContact O-OG 3.45Å; S79-N83 WeakPolarHBondContact O-CB 3.44Å; S79-N83 PolarHBondContact O-N 3.33Å; S79-N83 VanDerWaalsContact O-N 3.17Å
80V98.4Very high98.3Very high50 Ų5025.8 Ų25.830%0.30314%0.143SC..Hα-helixtrans-76.3-36.8-176.574.30000112.9F67 T70 G76 L84F67-V80 HydrophobicContact CD2-CG2 4.49Å; F67-V80 HydrophobicContact CE2-CG2 4.29Å; T70-V80 HydrophobicContact CG2-CB 4.34Å; G76-V80 WeakPolarHBondContact O-CG1 3.47Å; G76-V80 PolarHBondContact O-N 2.97Å; V80-L84 WeakPolarHBondContact O-CB 3.22Å; V80-L84 PolarHBondContact O-N 2.87Å
81G98.7Very high98.3Very high19 Ų1927 Ų2720%0.19615%0.149CC..Hα-helixtrans-75.4-39.9-175.900000113.4F77 L85F77-G81 VanDerWaalsContact O-CA 3.27Å; F77-G81 WeakPolarHBondContact O-CA 3.3Å; F77-G81 PolarHBondContact O-N 2.98Å; G81-L85 PolarHBondContact O-N 3.48Å; G81-L85 VanDerWaalsContact O-N 3.12Å
82I98.7Very high98.3Very high3 Ų328 Ų282%0.01515%0.154CC..Hα-helixtrans-75-32.8173.7-56.8174.4000110.1S78 L85 V86 F129 P138 M141S78-I82 WeakPolarHBondContact O-CA 3.44Å; S78-I82 WeakPolarHBondContact O-CB 3.24Å; S78-I82 VanDerWaalsContact O-CG1 3.25Å; S78-I82 WeakPolarHBondContact O-CG1 3.39Å; S78-I82 PolarHBondContact O-N 3.27Å; I82-L85 PolarHBondContact O-N 2.95Å; I82-V86 HydrophobicContact CG2-CG2 4.04Å; I82-V86 WeakPolarHBondContact O-CB 3.23Å; I82-V86 WeakPolarHBondContact O-CG2 3.3Å; I82-V86 PolarHBondContact O-N 3.38Å; I82-F129 HydrophobicContact CB-CE1 4.3Å; I82-F129 HydrophobicContact CB-CZ 3.9Å; I82-F129 HydrophobicContact CG2-CE1 4.29Å; I82-F129 HydrophobicContact CG2-CE2 4.28Å; I82-F129 HydrophobicContact CG2-CZ 3.85Å; I82-P138 HydrophobicContact CD1-CG 3.87Å; I82-P138 HydrophobicContact CG1-CG 4.23Å; I82-M141 HydrophobicContact CG2-CB 4.01Å; I82-M141 HydrophobicContact CG2-CG 3.82Å
83N98.8Very high98.4Very high1 Ų129.9 Ų29.91%0.00516%0.161CC..Hα-helixtrans-55.7-51169.4-17898.4000111.3I61 F65 G66 M69 S79 L85 V86 A87 L126 F129I61-N83 PolarHBondContact O-ND2 3.33Å; F65-N83 WeakPolarHBondContact CB-OD1 3.08Å; G66-N83 VanDerWaalsContact CA-CG 3.46Å; G66-N83 PolarHBondContact N-OD1 2.69Å; M69-N83 HydrophobicContact CE-CB 4.11Å; M69-N83 VanDerWaalsContact CE-OD1 3.23Å; M69-N83 WeakPolarHBondContact CE-OD1 3.39Å; S79-N83 WeakPolarHBondContact O-CB 3.44Å; S79-N83 PolarHBondContact O-N 3.33Å; S79-N83 VanDerWaalsContact O-N 3.17Å; N83-L85 VanDerWaalsContact C-N 3.32Å; N83-L85 PolarHBondContact O-N 2.96Å; N83-V86 PolarHBondContact O-N 3.38Å; N83-A87 VanDerWaalsContact O-CB 3.25Å; N83-A87 WeakPolarHBondContact O-CB 3.46Å; N83-A87 PolarHBondContact O-N 2.76Å; N83-L126 HydrophobicContact CB-CD2 4.29Å; N83-L126 WeakPolarHBondContact OD1-CD1 3.47Å; N83-L126 WeakPolarHBondContact OD1-CD2 3.39Å; N83-F129 HydrophobicContact CB-CE1 4.5Å
84L98.8Very high98.5Very high99 Ų9927.4 Ų27.452%0.51815%0.15SC..Hα-helixtrans-55.5-45.8175.5174.362.9000111.9F62 V80 A88F62-L84 HydrophobicContact CD1-CD1 3.61Å; F62-L84 HydrophobicContact CE1-CD1 3.58Å; V80-L84 WeakPolarHBondContact O-CB 3.22Å; V80-L84 PolarHBondContact O-N 2.87Å; L84-A88 VanDerWaalsContact O-CB 3.23Å; L84-A88 WeakPolarHBondContact O-CB 3.33Å; L84-A88 PolarHBondContact O-N 2.8Å
85L98.8Very high98.6Very high48 Ų4824.8 Ų24.825%0.25114%0.14SC..Hα-helixtrans-62.6-48.3178.8178.269.4000112.4F5 G81 I82 N83 A88 L89 P138 L142F5-L85 HydrophobicContact CE2-CD2 3.69Å; F5-L85 HydrophobicContact CZ-CD1 4.47Å; F5-L85 HydrophobicContact CZ-CD2 3.77Å; G81-L85 PolarHBondContact O-N 3.48Å; G81-L85 VanDerWaalsContact O-N 3.12Å; I82-L85 PolarHBondContact O-N 2.95Å; N83-L85 VanDerWaalsContact C-N 3.32Å; N83-L85 PolarHBondContact O-N 2.96Å; L85-A88 PolarHBondContact O-N 2.64Å; L85-L89 PolarHBondContact O-N 2.97Å; L85-L89 VanDerWaalsContact O-N 3.12Å; L85-P138 HydrophobicContact CD2-CB 4.26Å; L85-L142 HydrophobicContact CD1-CD2 4.16Å; L85-L142 HydrophobicContact CD2-CD2 4.06Å; L85-L142 HydrophobicContact CD2-CG 4.35Å; L85-L142 HydrophobicContact CG-CD2 3.93Å
86V98.7Very high98.5Very high0 Ų024.7 Ų24.70%014%0.14CC..Hα-helixtrans-64.2-45.2-179.7164.40000110.6I82 N83 L89 G90 V125 L126 M141I82-V86 HydrophobicContact CG2-CG2 4.04Å; I82-V86 WeakPolarHBondContact O-CB 3.23Å; I82-V86 WeakPolarHBondContact O-CG2 3.3Å; I82-V86 PolarHBondContact O-N 3.38Å; N83-V86 PolarHBondContact O-N 3.38Å; V86-L89 PolarHBondContact O-N 3.32Å; V86-G90 PolarHBondContact O-N 3.42Å; V86-V125 HydrophobicContact CG1-CB 4.1Å; V86-V125 HydrophobicContact CG1-CG1 3.54Å; V86-L126 HydrophobicContact CB-CD2 4.11Å; V86-L126 HydrophobicContact CG1-CD2 3.71Å; V86-L126 HydrophobicContact CG1-CG 4.5Å; V86-M141 HydrophobicContact CG2-CB 3.75Å; V86-M141 HydrophobicContact CG2-CE 3.94Å
87A98.8Very high98.5Very high0 Ų024.6 Ų24.60%014%0.135CC..Hα-helixtrans-63.7-47.1177.400000111I61 F62 N83 L89 G90 L91 L126I61-A87 HydrophobicContact CG2-CB 3.59Å; F62-A87 HydrophobicContact CD1-CB 4.17Å; F62-A87 HydrophobicContact CE1-CB 3.45Å; F62-A87 VanDerWaalsContact CE1-CB 3.45Å; F62-A87 HydrophobicContact CE2-CB 4.29Å; F62-A87 HydrophobicContact CZ-CB 3.53Å; N83-A87 VanDerWaalsContact O-CB 3.25Å; N83-A87 WeakPolarHBondContact O-CB 3.46Å; N83-A87 PolarHBondContact O-N 2.76Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 3.47Å; A87-G90 CarbonylContact O-C 3.58Å; A87-G90 WeakPolarHBondContact O-CA 3.46Å; A87-G90 PolarHBondContact O-N 3.45Å; A87-L91 VanDerWaalsContact O-CG 3.3Å; A87-L91 WeakPolarHBondContact O-CG 3.16Å; A87-L91 PolarHBondContact O-N 3.19Å; A87-L126 HydrophobicContact CB-CD1 4.48Å
88A98.9Very high98.4Very high42 Ų4220.5 Ų20.535%0.34712%0.117SC..Hα-helixtrans-58.6-41.5179.100000113.1L84 L85L84-A88 VanDerWaalsContact O-CB 3.23Å; L84-A88 WeakPolarHBondContact O-CB 3.33Å; L84-A88 PolarHBondContact O-N 2.8Å; L85-A88 PolarHBondContact O-N 2.64Å
89L98.9Very high98.3Very high11 Ų1120.6 Ų20.66%0.05812%0.118CC..Hα-helixtrans-68.2-43.5172176.862.7000111.4L12 M16 L85 V86 A87 L91 Q92 W93 L142 T145 I146L12-L89 HydrophobicContact CB-CD1 4.46Å; L12-L89 HydrophobicContact CD1-CD2 4.07Å; M16-L89 HydrophobicContact CE-CD1 4.12Å; M16-L89 HydrophobicContact CG-CD1 4.44Å; L85-L89 PolarHBondContact O-N 2.97Å; L85-L89 VanDerWaalsContact O-N 3.12Å; V86-L89 PolarHBondContact O-N 3.32Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 3.47Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 2.97Å; L89-Q92 PolarHBondContact O-N 2.87Å; L89-W93 WeakPolarHBondContact O-CB 3.46Å; L89-W93 PolarHBondContact O-N 2.77Å; L89-L142 HydrophobicContact CB-CD2 4.46Å; L89-L142 HydrophobicContact CD2-CB 4.25Å; L89-L142 HydrophobicContact CD2-CD2 3.6Å; L89-T145 HydrophobicContact CB-CG2 4.31Å; L89-T145 HydrophobicContact CD2-CG2 3.89Å; L89-T145 HydrophobicContact CG-CG2 3.94Å; L89-I146 HydrophobicContact CD1-CD1 4.18Å; L89-I146 HydrophobicContact CD2-CD1 4.11Å; L89-I146 HydrophobicContact CD2-CG1 4.25Å; L89-I146 HydrophobicContact CG-CD1 4.36Å
90G98.8Very high98.1Very high0 Ų022.9 Ų22.90%013%0.13CC..Hα-helixtrans-60.5-39.5-177.700000113V86 A87 Q92 G94V86-G90 PolarHBondContact O-N 3.42Å; A87-G90 CarbonylContact O-C 3.58Å; A87-G90 WeakPolarHBondContact O-CA 3.46Å; A87-G90 PolarHBondContact O-N 3.45Å; G90-Q92 PolarHBondContact O-N 2.95Å; G90-G94 WeakPolarHBondContact O-CA 3.45Å; G90-G94 PolarHBondContact O-N 2.74Å
91L98.7Very high97.8Very high37 Ų3723.2 Ų23.219%0.19413%0.13CC..Hα-helixtrans-60.6-46.7176-65.9177.5000111.9F62 A87 L89 T95 A118 D119 A122F62-L91 HydrophobicContact CE2-CD1 3.99Å; F62-L91 HydrophobicContact CZ-CD1 3.77Å; A87-L91 VanDerWaalsContact O-CG 3.3Å; A87-L91 WeakPolarHBondContact O-CG 3.16Å; A87-L91 PolarHBondContact O-N 3.19Å; L89-L91 VanDerWaalsContact C-N 3.33Å; L89-L91 PolarHBondContact O-N 2.97Å; L91-T95 WeakPolarHBondContact O-CB 3.33Å; L91-T95 PolarHBondContact O-N 3.11Å; L91-T95 PolarHBondContact O-OG1 3Å; L91-A118 HydrophobicContact CD2-CB 4.29Å; L91-A118 WeakPolarHBondContact O-CB 3.36Å; L91-D119 HydrophobicContact CD2-CB 4.19Å; L91-D119 WeakPolarHBondContact CD2-OD1 3.39Å; L91-A122 HydrophobicContact CD2-CB 4.47Å
92Q98.8Very high97.4Very high44 Ų4427.2 Ų27.221%0.20614%0.143CC..Hα-helixtrans-67.2-50.4179.7-64.4-174.77000110.9E13 M16 F20 L89 G90 T95 I96E13-Q92 PolarHBondContact OE2-NE2 3.39Å; M16-Q92 HydrophobicContact CB-CB 4.35Å; M16-Q92 VanDerWaalsContact CB-OE1 3.26Å; M16-Q92 HydrophobicContact CG-CB 4Å; M16-Q92 HydrophobicContact SD-CB 4.16Å; F20-Q92 HydrophobicContact CE2-CB 3.98Å; F20-Q92 HydrophobicContact CE2-CG 4.47Å; F20-Q92 WeakPolarHBondContact CE2-O 3.37Å; L89-Q92 PolarHBondContact O-N 2.87Å; G90-Q92 PolarHBondContact O-N 2.95Å; Q92-T95 PolarHBondContact O-N 2.77Å; Q92-I96 WeakPolarHBondContact O-CG1 3.43Å; Q92-I96 PolarHBondContact O-N 3.34Å
93W98.8Very high97Very high39 Ų3928.3 Ų28.315%0.14815%0.151CC..Hα-helixtrans-70.2-41.5-175.2-176.9-130.3000112.6M16 L19 L89 T95 I96 V97 I146 I149 V150M16-W93 HydrophobicContact CE-CB 4.09Å; M16-W93 HydrophobicContact CE-CD2 4.07Å; M16-W93 HydrophobicContact CE-CE3 3.66Å; M16-W93 HydrophobicContact CE-CG 4.28Å; M16-W93 HydrophobicContact CE-CZ3 4.45Å; M16-W93 HydrophobicContact SD-CB 4.11Å; M16-W93 HydrophobicContact SD-CE3 3.95Å; L19-W93 HydrophobicContact CD1-CZ3 3.93Å; L89-W93 WeakPolarHBondContact O-CB 3.46Å; L89-W93 PolarHBondContact O-N 2.77Å; W93-T95 PolarHBondContact O-N 3.09Å; W93-I96 HydrophobicContact CE3-CB 4.25Å; W93-I96 HydrophobicContact CE3-CD1 4.4Å; W93-I96 HydrophobicContact CE3-CG2 4.33Å; W93-I96 HydrophobicContact CZ3-CB 4.45Å; W93-I96 HydrophobicContact CZ3-CG2 4.02Å; W93-I96 PolarHBondContact O-N 3.46Å; W93-V97 HydrophobicContact CD2-CG2 3.51Å; W93-V97 HydrophobicContact CE3-CG2 3.78Å; W93-V97 HydrophobicContact CG-CG2 4.22Å; W93-V97 HydrophobicContact CH2-CG2 3.53Å; W93-V97 HydrophobicContact CZ2-CG2 3.25Å; W93-V97 HydrophobicContact CZ3-CG2 3.77Å; W93-V97 WeakPolarHBondContact O-CG2 3.45Å; W93-V97 PolarHBondContact O-N 3.41Å; W93-I146 HydrophobicContact CB-CD1 4.24Å; W93-I146 HydrophobicContact CD2-CD1 4Å; W93-I146 HydrophobicContact CG-CD1 3.71Å; W93-I146 HydrophobicContact CZ2-CG2 4.38Å; W93-I146 PolarHBondContact NE1-O 3.34Å; W93-I149 HydrophobicContact CB-CD1 4.44Å; W93-I149 HydrophobicContact CG-CG2 4.29Å; W93-V150 HydrophobicContact CZ2-CG2 3.69Å
94G98.3Very high96.5Very high0 Ų036 Ų360%019%0.187CC..Hα-helixtrans-57.8-47.3174.300000112.3G90 I96 V97 Q98 S121G90-G94 WeakPolarHBondContact O-CA 3.45Å; G90-G94 PolarHBondContact O-N 2.74Å; G94-I96 VanDerWaalsContact C-N 3.31Å; G94-I96 PolarHBondContact O-N 3.07Å; G94-V97 PolarHBondContact O-N 3.18Å; G94-Q98 VanDerWaalsContact O-CB 3.32Å; G94-Q98 WeakPolarHBondContact O-CB 3.42Å; G94-Q98 WeakPolarHBondContact O-CG 3.11Å; G94-Q98 PolarHBondContact O-N 3.43Å; G94-Q98 PolarHBondContact O-OE1 3.14Å; G94-S121 WeakPolarHBondContact CA-OG 3.46Å
95T98.4Very high96Very high11 Ų1132.9 Ų32.97%0.06718%0.179CC..Hα-helixtrans-53.3-48.8174.9-60.60000111.3F20 L91 Q92 W93 G99 F108 I110 A118F20-T95 HydrophobicContact CE1-CG2 4.23Å; F20-T95 HydrophobicContact CZ-CG2 3.95Å; L91-T95 WeakPolarHBondContact O-CB 3.33Å; L91-T95 PolarHBondContact O-N 3.11Å; L91-T95 PolarHBondContact O-OG1 3Å; Q92-T95 PolarHBondContact O-N 2.77Å; W93-T95 PolarHBondContact O-N 3.09Å; T95-G99 WeakPolarHBondContact O-CA 3.49Å; T95-G99 PolarHBondContact O-N 3.32Å; T95-F108 HydrophobicContact CG2-CE2 4.02Å; T95-F108 HydrophobicContact CG2-CZ 4.18Å; T95-F108 VanDerWaalsContact O-CZ 3.22Å; T95-F108 WeakPolarHBondContact O-CZ 3.14Å; T95-I110 HydrophobicContact CG2-CD1 3.98Å; T95-I110 HydrophobicContact CG2-CG1 4.48Å; T95-A118 VanDerWaalsContact OG1-CB 3.32Å; T95-A118 WeakPolarHBondContact OG1-CB 3.4Å
96I97.9Very high95.7Very high1 Ų137.1 Ų37.11%0.00520%0.197CC..Hα-helixtrans-65.6-52.7-179.4-68160.3000111.3M16 L19 F20 Q92 W93 G94 G99 I100M16-I96 HydrophobicContact SD-CD1 3.63Å; L19-I96 HydrophobicContact CB-CD1 3.62Å; L19-I96 HydrophobicContact CB-CG1 4.34Å; L19-I96 HydrophobicContact CB-CG2 4.41Å; L19-I96 HydrophobicContact CD1-CD1 4.14Å; L19-I96 HydrophobicContact CD1-CG2 4.42Å; F20-I96 HydrophobicContact CD2-CD1 3.58Å; F20-I96 HydrophobicContact CD2-CG1 3.9Å; F20-I96 HydrophobicContact CE2-CD1 3.56Å; F20-I96 HydrophobicContact CE2-CG1 3.69Å; F20-I96 HydrophobicContact CZ-CG1 4.42Å; Q92-I96 WeakPolarHBondContact O-CG1 3.43Å; Q92-I96 PolarHBondContact O-N 3.34Å; W93-I96 HydrophobicContact CE3-CB 4.25Å; W93-I96 HydrophobicContact CE3-CD1 4.4Å; W93-I96 HydrophobicContact CE3-CG2 4.33Å; W93-I96 HydrophobicContact CZ3-CB 4.45Å; W93-I96 HydrophobicContact CZ3-CG2 4.02Å; W93-I96 PolarHBondContact O-N 3.46Å; G94-I96 VanDerWaalsContact C-N 3.31Å; G94-I96 PolarHBondContact O-N 3.07Å; I96-G99 PolarHBondContact O-N 3.22Å; I96-I100 HydrophobicContact CG2-CD1 3.54Å; I96-I100 HydrophobicContact CG2-CG1 4.27Å; I96-I100 VanDerWaalsContact O-CB 3.26Å; I96-I100 WeakPolarHBondContact O-CB 3.31Å; I96-I100 VanDerWaalsContact O-CG1 3.24Å; I96-I100 WeakPolarHBondContact O-CG1 3.33Å; I96-I100 PolarHBondContact O-N 3.12Å
97V97.8Very high95.5Very high20 Ų2042.4 Ų42.412%0.12122%0.22CC..Hα-helixtrans-66.7-47.2-172.3178.90000111.2W93 G94 L101 I149 V150 A153W93-V97 HydrophobicContact CD2-CG2 3.51Å; W93-V97 HydrophobicContact CE3-CG2 3.78Å; W93-V97 HydrophobicContact CG-CG2 4.22Å; W93-V97 HydrophobicContact CH2-CG2 3.53Å; W93-V97 HydrophobicContact CZ2-CG2 3.25Å; W93-V97 HydrophobicContact CZ3-CG2 3.77Å; W93-V97 WeakPolarHBondContact O-CG2 3.45Å; W93-V97 PolarHBondContact O-N 3.41Å; G94-V97 PolarHBondContact O-N 3.18Å; V97-L101 VanDerWaalsContact O-CB 3.27Å; V97-L101 WeakPolarHBondContact O-CB 3.49Å; V97-L101 PolarHBondContact O-N 3.32Å; V97-I149 HydrophobicContact CB-CG2 4.24Å; V97-I149 HydrophobicContact CG2-CG2 4.24Å; V97-V150 HydrophobicContact CG2-CG2 4.42Å; V97-A153 HydrophobicContact CB-CB 4.39Å; V97-A153 HydrophobicContact CG1-CB 3.44Å; V97-A153 VanDerWaalsContact CG1-CB 3.44Å
98Q95.9Very high95.3Very high5 Ų543.3 Ų43.32%0.02323%0.225CC..Hα-helixtrans-65.8-43.8177.9-66.9174.2-75.100110.5G94 L101 Q102 N117 A153 E156G94-Q98 VanDerWaalsContact O-CB 3.32Å; G94-Q98 WeakPolarHBondContact O-CB 3.42Å; G94-Q98 WeakPolarHBondContact O-CG 3.11Å; G94-Q98 PolarHBondContact O-N 3.43Å; G94-Q98 PolarHBondContact O-OE1 3.14Å; Q98-L101 PolarHBondContact O-N 2.8Å; Q98-Q102 WeakPolarHBondContact O-CB 3.31Å; Q98-Q102 VanDerWaalsContact O-CG 3.25Å; Q98-Q102 WeakPolarHBondContact O-CG 3.46Å; Q98-Q102 PolarHBondContact O-N 2.89Å; Q98-N117 PolarHBondContact OE1-O 3.36Å; Q98-N117 VanDerWaalsContact OE1-O 3.08Å; Q98-A153 HydrophobicContact CG-CB 4.09Å; Q98-E156 PolarHBondContact NE2-OE1 3.15Å; Q98-E156 PolarHBondContact NE2-OE2 2.99Å
99G94.8Very high95Very high2 Ų243.7 Ų43.72%0.02122%0.221CC..Hα-helixtrans-60.2-49.2178.500000112.9T95 I96 L101 Q102 S103T95-G99 WeakPolarHBondContact O-CA 3.49Å; T95-G99 PolarHBondContact O-N 3.32Å; I96-G99 PolarHBondContact O-N 3.22Å; G99-L101 VanDerWaalsContact C-N 3.34Å; G99-L101 PolarHBondContact O-N 2.81Å; G99-Q102 PolarHBondContact O-N 3.31Å; G99-S103 VanDerWaalsContact O-CB 3.24Å; G99-S103 WeakPolarHBondContact O-CB 3.36Å; G99-S103 PolarHBondContact O-N 2.66Å; G99-S103 PolarHBondContact O-OG 3.02Å
100I94Very high94.7Very high48 Ų4845 Ų4525%0.24623%0.227CC..Hα-helixtrans-60.7-41.9176.3-74.2177.6000111.5F23 I96 S103 Q104 G105 F108F23-I100 HydrophobicContact CB-CG1 4.46Å; F23-I100 HydrophobicContact CD1-CD1 4.24Å; F23-I100 HydrophobicContact CD1-CG1 4.2Å; F23-I100 HydrophobicContact CD2-CD1 4.04Å; F23-I100 HydrophobicContact CE1-CD1 4.48Å; F23-I100 HydrophobicContact CE2-CD1 4.29Å; F23-I100 HydrophobicContact CG-CD1 4.02Å; F23-I100 HydrophobicContact CG-CG1 4.23Å; I96-I100 HydrophobicContact CG2-CD1 3.54Å; I96-I100 HydrophobicContact CG2-CG1 4.27Å; I96-I100 VanDerWaalsContact O-CB 3.26Å; I96-I100 WeakPolarHBondContact O-CB 3.31Å; I96-I100 VanDerWaalsContact O-CG1 3.24Å; I96-I100 WeakPolarHBondContact O-CG1 3.33Å; I96-I100 PolarHBondContact O-N 3.12Å; I100-S103 WeakPolarHBondContact CA-OG 3.29Å; I100-S103 PolarHBondContact O-OG 3.15Å; I100-Q104 PolarHBondContact O-N 3.3Å; I100-Q104 VanDerWaalsContact O-N 3.1Å; I100-G105 PolarHBondContact O-N 2.6Å; I100-F108 HydrophobicContact CG1-CE1 4.3Å
101L92.7Very high94.3Very high57 Ų5745.5 Ų45.530%0.29823%0.233SC..Hα-helixtrans-68-41.3-178.5-170.860.7000111.4V97 Q98 G99 Q104 A153 Y157V97-L101 VanDerWaalsContact O-CB 3.27Å; V97-L101 WeakPolarHBondContact O-CB 3.49Å; V97-L101 PolarHBondContact O-N 3.32Å; Q98-L101 PolarHBondContact O-N 2.8Å; G99-L101 VanDerWaalsContact C-N 3.34Å; G99-L101 PolarHBondContact O-N 2.81Å; L101-Q104 PolarHBondContact O-N 2.84Å; L101-A153 HydrophobicContact CD2-CB 4.27Å; L101-A153 VanDerWaalsContact CD2-O 3.23Å; L101-A153 WeakPolarHBondContact CD2-O 3.42Å; L101-Y157 HydrophobicContact CD1-CD2 4.5Å; L101-Y157 HydrophobicContact CD2-CD2 4.22Å; L101-Y157 HydrophobicContact CD2-CG 3.98Å; L101-Y157 HydrophobicContact CG-CD2 3.9Å; L101-Y157 HydrophobicContact CG-CG 4.09Å
102Q89.3Confident94Very high103 Ų10344.8 Ų44.848%0.48123%0.229SC..Hα-helixtrans-71.2-37.1177-70.4172.52.800112.4Q98 G99 Q104Q98-Q102 WeakPolarHBondContact O-CB 3.31Å; Q98-Q102 VanDerWaalsContact O-CG 3.25Å; Q98-Q102 WeakPolarHBondContact O-CG 3.46Å; Q98-Q102 PolarHBondContact O-N 2.89Å; G99-Q102 PolarHBondContact O-N 3.31Å; Q102-Q104 PolarHBondContact O-N 3.38Å
103S90.3Very high93.7Very high27 Ų2748.5 Ų48.519%0.18924%0.244CC..THydrogen-bonded Turntrans-81.82.2177.373.50000113.9G99 I100 G105 Q106G99-S103 VanDerWaalsContact O-CB 3.24Å; G99-S103 WeakPolarHBondContact O-CB 3.36Å; G99-S103 PolarHBondContact O-N 2.66Å; G99-S103 PolarHBondContact O-OG 3.02Å; I100-S103 WeakPolarHBondContact CA-OG 3.29Å; I100-S103 PolarHBondContact O-OG 3.15Å; S103-G105 PolarHBondContact O-N 3.02Å; S103-Q106 WeakPolarHBondContact CB-O 3.37Å; S103-Q106 WeakPolarHBondContact O-CB 3.28Å; S103-Q106 WeakPolarHBondContact O-CG 3.44Å; S103-Q106 PolarHBondContact O-N 2.87Å; S103-Q106 VanDerWaalsContact O-N 3.14Å; S103-Q106 PolarHBondContact OG-N 3.06Å; S103-Q106 PolarHBondContact OG-O 3.18Å
104Q89Confident93.5Very high161 Ų16148 Ų4875%0.75225%0.245SC*.THydrogen-bonded Turntrans53.939.3-175.9-56.3-176.5-18.100113I100 L101 Q102I100-Q104 PolarHBondContact O-N 3.3Å; I100-Q104 VanDerWaalsContact O-N 3.1Å; L101-Q104 PolarHBondContact O-N 2.84Å; Q102-Q104 PolarHBondContact O-N 3.38Å
105G89.1Confident93.4Very high34 Ų3451 Ų5135%0.35126%0.26SS..THydrogen-bonded Turntrans87.21.4178.600000115.2I100 S103I100-G105 PolarHBondContact O-N 2.6Å; S103-G105 PolarHBondContact O-N 3.02Å
106Q92.5Very high93.4Very high137 Ų13750.5 Ų50.564%0.6426%0.256SS*.SBendtrans-86170.1175.8-58.6-55.6-51.700111.9S103S103-Q106 WeakPolarHBondContact CB-O 3.37Å; S103-Q106 WeakPolarHBondContact O-CB 3.28Å; S103-Q106 WeakPolarHBondContact O-CG 3.44Å; S103-Q106 PolarHBondContact O-N 2.87Å; S103-Q106 VanDerWaalsContact O-N 3.14Å; S103-Q106 PolarHBondContact OG-N 3.06Å; S103-Q106 PolarHBondContact OG-O 3.18Å
107K94.2Very high93.4Very high111 Ų11151.2 Ų51.248%0.48326%0.26SS..  trans-61.1150.7167.3-65.1-169.8170.1-174.30110.8L22 F23 E25L22-K107 WeakPolarHBondContact O-CE 3.4Å; F23-K107 CarbonylContact O-C 3.59Å; F23-K107 VanDerWaalsContact O-CA 3.28Å; F23-K107 WeakPolarHBondContact O-CA 3.49Å; E25-K107 HydrophobicContact CG-CD 4.31Å; E25-K107 WeakPolarHBondContact OE1-CD 3.24Å; E25-K107 IonicContact OE1-NZ 3.09Å; E25-K107 PolarHBondContact OE1-NZ 3.32Å
108F93.9Very high93.4Very high20 Ų2050.3 Ų50.39%0.08826%0.255CS..EExtended strand (participates in β ladder)trans-140154.817965.7-87.1000111.7F23 V24 E25 T95 I100F23-F108 HydrophobicContact CB-CE1 4.22Å; F23-F108 WeakPolarHBondContact O-CD1 3.24Å; F23-F108 PolarHBondContact O-N 3.19Å; V24-F108 HydrophobicContact CG1-CE2 4.4Å; V24-F108 HydrophobicContact CG2-CE1 3.98Å; V24-F108 HydrophobicContact CG2-CE2 4.09Å; V24-F108 HydrophobicContact CG2-CZ 3.54Å; E25-F108 PolarHBondContact N-O 3.03Å; T95-F108 HydrophobicContact CG2-CE2 4.02Å; T95-F108 HydrophobicContact CG2-CZ 4.18Å; T95-F108 VanDerWaalsContact O-CZ 3.22Å; T95-F108 WeakPolarHBondContact O-CZ 3.14Å; I100-F108 HydrophobicContact CG1-CE1 4.3Å
109N92.9Very high93.5Very high49 Ų4950.1 Ų50.126%0.26225%0.254SS..EExtended strand (participates in β ladder)trans-88.8137.7178.3-63.5-17.8000110.7E25 E27 N114E25-N109 CarbonylContact O-C 3.49Å; E25-N109 VanDerWaalsContact O-CA 3.22Å; E25-N109 WeakPolarHBondContact O-CA 3.37Å; E27-N109 HydrophobicContact CB-CB 4.47Å; E27-N109 HydrophobicContact CG-CB 3.61Å; N109-N114 PolarHBondContact O-OD1 3.2Å
110I92.8Very high93.7Very high39 Ų3950.2 Ų50.220%0.225%0.254CS..EExtended strand (participates in β ladder)trans-91.1123.6174.7-166.9171.5000110.9F20 V24 E25 Y26 T95 N114F20-I110 HydrophobicContact CE1-CD1 4.37Å; V24-I110 HydrophobicContact CG1-CB 3.82Å; V24-I110 HydrophobicContact CG1-CD1 4.42Å; V24-I110 HydrophobicContact CG1-CG2 3.98Å; E25-I110 WeakPolarHBondContact O-CG2 3.41Å; E25-I110 PolarHBondContact O-N 3.42Å; Y26-I110 HydrophobicContact CD1-CG2 3.97Å; Y26-I110 HydrophobicContact CE1-CG2 4.29Å; T95-I110 HydrophobicContact CG2-CD1 3.98Å; T95-I110 HydrophobicContact CG2-CG1 4.48Å; I110-N114 HydrophobicContact CG1-CB 4.29Å
111G91.1Very high93.9Very high11 Ų1148 Ų4811%0.11324%0.242CC..  trans-130.1179.5169.700000112.5K113 N114 M115G111-K113 PolarHBondContact O-N 2.88Å; G111-N114 PolarHBondContact N-OD1 3Å; G111-N114 WeakPolarHBondContact O-CB 3.44Å; G111-N114 PolarHBondContact O-N 3.34Å; G111-M115 PolarHBondContact O-N 3.4Å; G111-M115 VanDerWaalsContact O-N 3.15Å
112I92.1Very high94.2Very high22 Ų2245.2 Ų45.211%0.11323%0.228CC..Hα-helixtrans-59-35.4-178.6-59.5-55000111.9F47 L50 Y51 F54 N114 M115 I116F47-I112 HydrophobicContact CD2-CD1 4.26Å; F47-I112 HydrophobicContact CD2-CG1 3.79Å; F47-I112 HydrophobicContact CE2-CD1 3.78Å; F47-I112 HydrophobicContact CE2-CG1 3.85Å; L50-I112 HydrophobicContact CB-CB 4.37Å; L50-I112 HydrophobicContact CB-CG2 3.85Å; Y51-I112 HydrophobicContact CD2-CD1 4.01Å; F54-I112 HydrophobicContact CB-CG2 3.72Å; F54-I112 HydrophobicContact CG-CG2 4.31Å; I112-N114 VanDerWaalsContact C-N 3.34Å; I112-N114 PolarHBondContact O-N 2.6Å; I112-M115 HydrophobicContact CD1-SD 3.67Å; I112-M115 WeakPolarHBondContact O-CB 3.4Å; I112-M115 PolarHBondContact O-N 3.04Å; I112-I116 HydrophobicContact CG2-CD1 4.07Å; I112-I116 HydrophobicContact CG2-CG1 4.47Å; I112-I116 WeakPolarHBondContact O-CG1 3.21Å; I112-I116 PolarHBondContact O-N 3.42Å
113K91.6Very high94.7Very high121 Ų12140.4 Ų40.453%0.52621%0.205SC..Hα-helixtrans-62.2-39.8175.4-173.5177.1179.21800112.2G111 M115 I116 N117G111-K113 PolarHBondContact O-N 2.88Å; K113-M115 VanDerWaalsContact C-N 3.31Å; K113-I116 PolarHBondContact O-N 3.35Å; K113-N117 PolarHBondContact O-N 2.81Å; K113-N117 PolarHBondContact O-ND2 2.92Å
114N94.6Very high95.1Very high29 Ų2939.1 Ų39.116%0.15520%0.196CC..Hα-helixtrans-65-38.5175-5588.6000111N109 I110 G111 I112 N117 A118N109-N114 PolarHBondContact O-OD1 3.2Å; I110-N114 HydrophobicContact CG1-CB 4.29Å; G111-N114 PolarHBondContact N-OD1 3Å; G111-N114 WeakPolarHBondContact O-CB 3.44Å; G111-N114 PolarHBondContact O-N 3.34Å; I112-N114 VanDerWaalsContact C-N 3.34Å; I112-N114 PolarHBondContact O-N 2.6Å; N114-N117 PolarHBondContact O-N 3.16Å; N114-A118 WeakPolarHBondContact O-CB 3.46Å; N114-A118 PolarHBondContact O-N 2.79Å
115M96.9Very high95.6Very high64 Ų6431.4 Ų31.432%0.31516%0.16SC..Hα-helixtrans-62.7-45.5175.3-62.6169.16700111.7F54 G111 I112 K113 N117 A118 D119F54-M115 HydrophobicContact CD2-CB 4Å; F54-M115 HydrophobicContact CD2-CE 4.43Å; F54-M115 HydrophobicContact CE1-CE 3.96Å; F54-M115 HydrophobicContact CE2-CB 3.93Å; F54-M115 HydrophobicContact CE2-CE 3.74Å; F54-M115 HydrophobicContact CZ-CE 3.47Å; F54-M115 VanDerWaalsContact CZ-CE 3.47Å; G111-M115 PolarHBondContact O-N 3.4Å; G111-M115 VanDerWaalsContact O-N 3.15Å; I112-M115 HydrophobicContact CD1-SD 3.67Å; I112-M115 WeakPolarHBondContact O-CB 3.4Å; I112-M115 PolarHBondContact O-N 3.04Å; K113-M115 VanDerWaalsContact C-N 3.31Å; M115-N117 VanDerWaalsContact C-N 3.35Å; M115-N117 PolarHBondContact O-N 2.99Å; M115-A118 WeakPolarHBondContact O-CB 3.4Å; M115-A118 PolarHBondContact O-N 2.96Å; M115-A118 VanDerWaalsContact O-N 3.14Å; M115-D119 PolarHBondContact O-N 3.33Å
116I97.5Very high96Very high0 Ų029.9 Ų29.90%014%0.144CC..Hα-helixtrans-58.5-46.3175.1-68.4164.2000111.1F54 I112 K113 A118 D119 F120 A228 I229F54-I116 HydrophobicContact CB-CD1 4.02Å; F54-I116 HydrophobicContact CB-CG1 3.7Å; F54-I116 HydrophobicContact CD2-CG1 4.18Å; F54-I116 HydrophobicContact CG-CG1 4.45Å; I112-I116 HydrophobicContact CG2-CD1 4.07Å; I112-I116 HydrophobicContact CG2-CG1 4.47Å; I112-I116 WeakPolarHBondContact O-CG1 3.21Å; I112-I116 PolarHBondContact O-N 3.42Å; K113-I116 PolarHBondContact O-N 3.35Å; I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 3.38Å; I116-D119 WeakPolarHBondContact O-CB 3.44Å; I116-D119 PolarHBondContact O-N 2.88Å; I116-F120 HydrophobicContact CG2-CD2 4.23Å; I116-F120 HydrophobicContact CG2-CE1 4.28Å; I116-F120 HydrophobicContact CG2-CE2 3.71Å; I116-F120 HydrophobicContact CG2-CZ 3.75Å; I116-F120 WeakPolarHBondContact O-CG 3.39Å; I116-F120 PolarHBondContact O-N 2.84Å; I116-A228 HydrophobicContact CD1-CB 4.36Å; I116-A228 HydrophobicContact CG2-CB 3.81Å; I116-I229 HydrophobicContact CG2-CG2 4.08Å
117N97.6Very high96.3Very high15 Ų1523.4 Ų23.48%0.0811%0.114CC..Hα-helixtrans-63.2-35.9177.4-74.3-23.1000112.1Q98 K113 N114 M115 F120 S121Q98-N117 PolarHBondContact OE1-O 3.36Å; Q98-N117 VanDerWaalsContact OE1-O 3.08Å; K113-N117 PolarHBondContact O-N 2.81Å; K113-N117 PolarHBondContact O-ND2 2.92Å; N114-N117 PolarHBondContact O-N 3.16Å; M115-N117 VanDerWaalsContact C-N 3.35Å; M115-N117 PolarHBondContact O-N 2.99Å; N117-F120 WeakPolarHBondContact O-CB 3.38Å; N117-F120 PolarHBondContact O-N 3.34Å; N117-S121 PolarHBondContact O-N 3.37Å
118A98.4Very high96.6Very high1 Ų118.1 Ų18.11%0.0089%0.091CC..Hα-helixtrans-65.9-40.817400000111.7L91 T95 N114 M115 I116 F120 S121 A122L91-A118 HydrophobicContact CD2-CB 4.29Å; L91-A118 WeakPolarHBondContact O-CB 3.36Å; T95-A118 VanDerWaalsContact OG1-CB 3.32Å; T95-A118 WeakPolarHBondContact OG1-CB 3.4Å; N114-A118 WeakPolarHBondContact O-CB 3.46Å; N114-A118 PolarHBondContact O-N 2.79Å; M115-A118 WeakPolarHBondContact O-CB 3.4Å; M115-A118 PolarHBondContact O-N 2.96Å; M115-A118 VanDerWaalsContact O-N 3.14Å; I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 3.38Å; A118-F120 VanDerWaalsContact C-N 3.31Å; A118-F120 PolarHBondContact O-N 3.03Å; A118-S121 PolarHBondContact O-N 3.11Å; A118-S121 PolarHBondContact O-OG 2.84Å; A118-A122 PolarHBondContact O-N 3.44Å
119D98.8Very high96.8Very high1 Ų117.1 Ų17.11%0.0059%0.087CC..Hα-helixtrans-60.2-39171.1-81.6-75.7000111.7F54 V57 H58 I61 L91 M115 I116 A122 A123F54-D119 VanDerWaalsContact CE2-OD2 3.29Å; F54-D119 WeakPolarHBondContact CE2-OD2 3.49Å; V57-D119 HydrophobicContact CG1-CB 3.71Å; H58-D119 IonicContact CE1-OD1 2.89Å; H58-D119 IonicContact CG-OD1 2.72Å; H58-D119 IonicContact ND1-OD1 2.77Å; H58-D119 PolarHBondContact ND1-OD1 3.09Å; H58-D119 IonicContact ND1-OD2 3.93Å; H58-D119 PolarHBondContact ND1-OD2 3.28Å; I61-D119 HydrophobicContact CD1-CB 4.5Å; I61-D119 WeakPolarHBondContact CD1-O 3.42Å; I61-D119 HydrophobicContact CG1-CB 3.87Å; I61-D119 VanDerWaalsContact CG1-OD1 3.26Å; I61-D119 WeakPolarHBondContact CG1-OD1 3.49Å; L91-D119 HydrophobicContact CD2-CB 4.19Å; L91-D119 WeakPolarHBondContact CD2-OD1 3.39Å; M115-D119 PolarHBondContact O-N 3.33Å; I116-D119 WeakPolarHBondContact O-CB 3.44Å; I116-D119 PolarHBondContact O-N 2.88Å; D119-A122 PolarHBondContact O-N 3.47Å; D119-A123 WeakPolarHBondContact O-CB 3.41Å; D119-A123 PolarHBondContact O-N 2.86Å
120F98.6Very high97.1Very high5 Ų514.9 Ų14.92%0.0228%0.075CC..Hα-helixtrans-63-40.4173.7-71.7-19000113.3V57 I116 N117 A118 A122 A123 T124 I174 F225 A228 I229V57-F120 HydrophobicContact CG1-CD1 4.14Å; V57-F120 HydrophobicContact CG1-CE1 3.92Å; V57-F120 HydrophobicContact CG2-CE1 4.23Å; I116-F120 HydrophobicContact CG2-CD2 4.23Å; I116-F120 HydrophobicContact CG2-CE1 4.28Å; I116-F120 HydrophobicContact CG2-CE2 3.71Å; I116-F120 HydrophobicContact CG2-CZ 3.75Å; I116-F120 WeakPolarHBondContact O-CG 3.39Å; I116-F120 PolarHBondContact O-N 2.84Å; N117-F120 WeakPolarHBondContact O-CB 3.38Å; N117-F120 PolarHBondContact O-N 3.34Å; A118-F120 VanDerWaalsContact C-N 3.31Å; A118-F120 PolarHBondContact O-N 3.03Å; F120-A122 VanDerWaalsContact C-N 3.33Å; F120-A123 WeakPolarHBondContact O-CB 3.2Å; F120-A123 PolarHBondContact O-N 2.82Å; F120-T124 PolarHBondContact O-N 3.38Å; F120-T124 VanDerWaalsContact O-N 3.13Å; F120-T124 PolarHBondContact O-OG1 3.13Å; F120-I174 HydrophobicContact CB-CD1 3.47Å; F120-I174 VanDerWaalsContact CB-CD1 3.47Å; F120-I174 HydrophobicContact CB-CG1 4.42Å; F120-I174 HydrophobicContact CD1-CD1 3.88Å; F120-I174 HydrophobicContact CD2-CD1 4.34Å; F120-I174 HydrophobicContact CG-CD1 3.65Å; F120-F225 HydrophobicContact CD1-CD2 4.11Å; F120-F225 HydrophobicContact CD1-CE1 4.29Å; F120-F225 AromaticContact CD1-CE2 3.45Å; F120-F225 HydrophobicContact CD1-CE2 3.45Å; F120-F225 VanDerWaalsContact CD1-CE2 3.45Å; F120-F225 AromaticContact CD1-CZ 3.55Å; F120-F225 HydrophobicContact CD1-CZ 3.55Å; F120-F225 HydrophobicContact CE1-CD1 4.12Å; F120-F225 AromaticContact CE1-CD2 3.6Å; F120-F225 HydrophobicContact CE1-CD2 3.6Å; F120-F225 AromaticContact CE1-CE1 3.96Å; F120-F225 HydrophobicContact CE1-CE1 3.96Å; F120-F225 AromaticContact CE1-CE2 3.41Å; F120-F225 HydrophobicContact CE1-CE2 3.41Å; F120-F225 VanDerWaalsContact CE1-CE2 3.41Å; F120-F225 AromaticContact CE1-CG 3.95Å; F120-F225 HydrophobicContact CE1-CG 3.95Å; F120-F225 AromaticContact CE1-CZ 3.59Å; F120-F225 HydrophobicContact CE1-CZ 3.59Å; F120-A228 HydrophobicContact CZ-CB 4.15Å; F120-I229 HydrophobicContact CE2-CD1 4.01Å; F120-I229 HydrophobicContact CE2-CG1 4.08Å; F120-I229 HydrophobicContact CE2-CG2 3.94Å
121S98.4Very high97.4Very high0 Ų013 Ų130%07%0.066CC..Hα-helixtrans-63.5-40.8173.1820000111.5G94 N117 A118 T124 V125G94-S121 WeakPolarHBondContact CA-OG 3.46Å; N117-S121 PolarHBondContact O-N 3.37Å; A118-S121 PolarHBondContact O-N 3.11Å; A118-S121 PolarHBondContact O-OG 2.84Å; S121-T124 WeakPolarHBondContact O-CB 3.44Å; S121-T124 PolarHBondContact O-N 3.34Å; S121-V125 PolarHBondContact O-N 2.88Å
122A98.8Very high97.7Very high0 Ų012.6 Ų12.60%06%0.06CC..Hα-helixtrans-65.5-42.9175.900000111.4I61 L91 A118 D119 F120 T124 V125 L126I61-A122 HydrophobicContact CG2-CB 4.29Å; L91-A122 HydrophobicContact CD2-CB 4.47Å; A118-A122 PolarHBondContact O-N 3.44Å; D119-A122 PolarHBondContact O-N 3.47Å; F120-A122 VanDerWaalsContact C-N 3.33Å; A122-T124 PolarHBondContact O-N 3.15Å; A122-V125 PolarHBondContact O-N 2.91Å; A122-V125 VanDerWaalsContact O-N 3.1Å; A122-L126 WeakPolarHBondContact O-CG 3.39Å; A122-L126 PolarHBondContact O-N 2.99Å
123A98.9Very high98Very high1 Ų111.5 Ų11.51%0.0086%0.055CC..Hα-helixtrans-53.7-43.5175.400000111.6I61 F65 D119 F120 V125 L126 I127 I174 F225I61-A123 HydrophobicContact CD1-CB 3.57Å; F65-A123 HydrophobicContact CE2-CB 4.28Å; D119-A123 WeakPolarHBondContact O-CB 3.41Å; D119-A123 PolarHBondContact O-N 2.86Å; F120-A123 WeakPolarHBondContact O-CB 3.2Å; F120-A123 PolarHBondContact O-N 2.82Å; A123-V125 VanDerWaalsContact C-N 3.35Å; A123-V125 PolarHBondContact O-N 2.99Å; A123-L126 PolarHBondContact O-N 3.03Å; A123-L126 VanDerWaalsContact O-N 3.16Å; A123-I127 WeakPolarHBondContact O-CG1 3.45Å; A123-I127 PolarHBondContact O-N 3.21Å; A123-I174 HydrophobicContact CB-CG2 4.28Å; A123-F225 HydrophobicContact CB-CE2 4.44Å
124T98.9Very high98.4Very high0 Ų05.8 Ų5.80%03%0.031CC..Hα-helixtrans-56.8-48.1177.5-57.30000111.5F120 S121 A122 L126 I127 S128 F152 F177F120-T124 PolarHBondContact O-N 3.38Å; F120-T124 VanDerWaalsContact O-N 3.13Å; F120-T124 PolarHBondContact O-OG1 3.13Å; S121-T124 WeakPolarHBondContact O-CB 3.44Å; S121-T124 PolarHBondContact O-N 3.34Å; A122-T124 PolarHBondContact O-N 3.15Å; T124-L126 VanDerWaalsContact C-N 3.34Å; T124-L126 PolarHBondContact O-N 3.09Å; T124-I127 WeakPolarHBondContact O-CB 3.42Å; T124-I127 PolarHBondContact O-N 3.36Å; T124-S128 PolarHBondContact O-N 2.87Å; T124-S128 VanDerWaalsContact O-N 3.12Å; T124-F152 HydrophobicContact CG2-CB 4.44Å; T124-F152 HydrophobicContact CG2-CD2 3.83Å; T124-F152 HydrophobicContact CG2-CG 4.33Å; T124-F152 WeakPolarHBondContact OG1-CD2 3.29Å; T124-F152 WeakPolarHBondContact OG1-CE2 3.26Å; T124-F177 HydrophobicContact CG2-CD1 3.4Å; T124-F177 HydrophobicContact CG2-CE1 3.76Å
125V98.9Very high98.5Very high0 Ų05.2 Ų5.20%03%0.027CC..Hα-helixtrans-66.7-35.6177.7-173.60000111.9V86 S121 A122 A123 I127 S128 F129 M144 T145 E148 I149V86-V125 HydrophobicContact CG1-CB 4.1Å; V86-V125 HydrophobicContact CG1-CG1 3.54Å; S121-V125 PolarHBondContact O-N 2.88Å; A122-V125 PolarHBondContact O-N 2.91Å; A122-V125 VanDerWaalsContact O-N 3.1Å; A123-V125 VanDerWaalsContact C-N 3.35Å; A123-V125 PolarHBondContact O-N 2.99Å; V125-I127 VanDerWaalsContact C-N 3.32Å; V125-S128 CarbonylContact O-C 3.58Å; V125-S128 WeakPolarHBondContact O-CB 3.45Å; V125-S128 PolarHBondContact O-N 3.35Å; V125-F129 WeakPolarHBondContact O-CB 3.2Å; V125-F129 PolarHBondContact O-N 3.31Å; V125-M144 HydrophobicContact CG1-CE 3.99Å; V125-T145 HydrophobicContact CG1-CG2 4.48Å; V125-T145 HydrophobicContact CG2-CG2 4.42Å; V125-E148 HydrophobicContact CG2-CB 4.19Å; V125-E148 HydrophobicContact CG2-CG 4.16Å; V125-I149 HydrophobicContact CG2-CD1 4.12Å; V125-I149 HydrophobicContact CG2-CG1 3.71Å
126L98.9Very high98.6Very high1 Ų12.2 Ų2.21%0.0051%0.012CC..Hα-helixtrans-68.3-31.8177.1-65.8178.6000112.4I61 F65 N83 V86 A87 A122 A123 T124 F129 G130I61-L126 HydrophobicContact CG2-CD1 3.66Å; F65-L126 HydrophobicContact CB-CB 4.27Å; F65-L126 HydrophobicContact CB-CD1 3.91Å; F65-L126 HydrophobicContact CD1-CB 4.07Å; F65-L126 HydrophobicContact CD2-CB 4.46Å; F65-L126 HydrophobicContact CD2-CD1 4.2Å; F65-L126 HydrophobicContact CG-CB 4.03Å; F65-L126 HydrophobicContact CG-CD1 4.15Å; N83-L126 HydrophobicContact CB-CD2 4.29Å; N83-L126 WeakPolarHBondContact OD1-CD1 3.47Å; N83-L126 WeakPolarHBondContact OD1-CD2 3.39Å; V86-L126 HydrophobicContact CB-CD2 4.11Å; V86-L126 HydrophobicContact CG1-CD2 3.71Å; V86-L126 HydrophobicContact CG1-CG 4.5Å; A87-L126 HydrophobicContact CB-CD1 4.48Å; A122-L126 WeakPolarHBondContact O-CG 3.39Å; A122-L126 PolarHBondContact O-N 2.99Å; A123-L126 PolarHBondContact O-N 3.03Å; A123-L126 VanDerWaalsContact O-N 3.16Å; T124-L126 VanDerWaalsContact C-N 3.34Å; T124-L126 PolarHBondContact O-N 3.09Å; L126-F129 HydrophobicContact CD2-CD1 4.36Å; L126-F129 WeakPolarHBondContact O-CB 3.07Å; L126-F129 PolarHBondContact O-N 2.97Å; L126-G130 PolarHBondContact O-N 3.16Å; L126-G130 VanDerWaalsContact O-N 3.16Å
127I98.9Very high98.6Very high1 Ų12.2 Ų2.21%0.0051%0.012CC..Hα-helixtrans-63.9-48.3168.9-66.2167.1000109.7F65 A123 T124 V125 F129 G130 I174 H175 A179 V330 H334F65-I127 HydrophobicContact CE1-CG1 3.72Å; F65-I127 HydrophobicContact CZ-CD1 4.35Å; F65-I127 HydrophobicContact CZ-CG1 3.81Å; A123-I127 WeakPolarHBondContact O-CG1 3.45Å; A123-I127 PolarHBondContact O-N 3.21Å; T124-I127 WeakPolarHBondContact O-CB 3.42Å; T124-I127 PolarHBondContact O-N 3.36Å; V125-I127 VanDerWaalsContact C-N 3.32Å; I127-F129 VanDerWaalsContact C-N 3.27Å; I127-F129 PolarHBondContact O-N 3.39Å; I127-G130 PolarHBondContact O-N 3.16Å; I127-G130 VanDerWaalsContact O-N 3.16Å; I127-I174 HydrophobicContact CD1-CG2 3.73Å; I127-H175 VanDerWaalsContact CD1-ND1 3.33Å; I127-H175 WeakPolarHBondContact CD1-ND1 3.32Å; I127-A179 HydrophobicContact CG2-CB 3.98Å; I127-V330 HydrophobicContact CG2-CB 4.34Å; I127-V330 WeakPolarHBondContact O-CG1 3.43Å; I127-H334 HydrophobicContact CG2-CB 3.79Å
128S98.9Very high98.7Very high0 Ų02.1 Ų2.10%01%0.012CC..Hα-helixtrans-60.2-38.1175.2-77.50000112.9T124 V125 G130 A131 E148 G178 F181 G182T124-S128 PolarHBondContact O-N 2.87Å; T124-S128 VanDerWaalsContact O-N 3.12Å; V125-S128 CarbonylContact O-C 3.58Å; V125-S128 WeakPolarHBondContact O-CB 3.45Å; V125-S128 PolarHBondContact O-N 3.35Å; S128-G130 VanDerWaalsContact C-N 3.27Å; S128-G130 PolarHBondContact O-N 2.86Å; S128-A131 WeakPolarHBondContact O-CB 3.36Å; S128-A131 PolarHBondContact O-N 3.4Å; S128-A131 VanDerWaalsContact O-N 3.09Å; S128-E148 VanDerWaalsContact CB-OE1 3.23Å; S128-E148 WeakPolarHBondContact CB-OE1 3.49Å; S128-E148 WeakPolarHBondContact CB-OE2 3.47Å; S128-E148 PolarHBondContact OG-OE1 3.13Å; S128-E148 PolarHBondContact OG-OE2 3.47Å; S128-G178 PolarHBondContact OG-O 3.48Å; S128-F181 WeakPolarHBondContact OG-CD1 3.44Å; S128-G182 WeakPolarHBondContact OG-CA 3.23Å; S128-G182 PolarHBondContact OG-N 3.13Å; S128-G182 VanDerWaalsContact OG-N 3.12Å
129F98.9Very high98.7Very high0 Ų02.2 Ų2.20%01%0.013CC..Hα-helixtrans-57.7-41.3176.3-179.8-148.5000111.1M69 I82 N83 V125 L126 I127 A131 V132 L133 M141M69-F129 HydrophobicContact CE-CD1 3.65Å; M69-F129 HydrophobicContact CE-CE1 3.9Å; M69-F129 HydrophobicContact SD-CD1 3.68Å; M69-F129 HydrophobicContact SD-CE1 4.01Å; M69-F129 HydrophobicContact SD-CG 4.33Å; I82-F129 HydrophobicContact CB-CE1 4.3Å; I82-F129 HydrophobicContact CB-CZ 3.9Å; I82-F129 HydrophobicContact CG2-CE1 4.29Å; I82-F129 HydrophobicContact CG2-CE2 4.28Å; I82-F129 HydrophobicContact CG2-CZ 3.85Å; N83-F129 HydrophobicContact CB-CE1 4.5Å; V125-F129 WeakPolarHBondContact O-CB 3.2Å; V125-F129 PolarHBondContact O-N 3.31Å; L126-F129 HydrophobicContact CD2-CD1 4.36Å; L126-F129 WeakPolarHBondContact O-CB 3.07Å; L126-F129 PolarHBondContact O-N 2.97Å; I127-F129 VanDerWaalsContact C-N 3.27Å; I127-F129 PolarHBondContact O-N 3.39Å; F129-A131 PolarHBondContact O-N 3.35Å; F129-V132 HydrophobicContact CD2-CG2 4.35Å; F129-V132 CarbonylContact O-C 3.39Å; F129-V132 PolarHBondContact O-N 3.05Å; F129-L133 HydrophobicContact CD1-CD1 4.45Å; F129-L133 HydrophobicContact CD2-CD1 4.25Å; F129-L133 HydrophobicContact CE1-CD1 3.77Å; F129-L133 HydrophobicContact CE2-CD1 3.55Å; F129-L133 HydrophobicContact CZ-CD1 3.26Å; F129-L133 WeakPolarHBondContact O-CA 3.32Å; F129-L133 WeakPolarHBondContact O-CB 3.22Å; F129-L133 PolarHBondContact O-N 3.39Å; F129-M141 HydrophobicContact CB-CE 3.56Å; F129-M141 HydrophobicContact CD1-CE 4.46Å; F129-M141 HydrophobicContact CD2-CE 3.3Å; F129-M141 HydrophobicContact CD2-CG 4.34Å; F129-M141 HydrophobicContact CD2-SD 3.59Å; F129-M141 VanDerWaalsContact CD2-SD 3.59Å; F129-M141 HydrophobicContact CE2-CE 4.1Å; F129-M141 HydrophobicContact CE2-CG 4.26Å; F129-M141 HydrophobicContact CE2-SD 4.03Å; F129-M141 HydrophobicContact CG-CE 3.52Å; F129-M141 HydrophobicContact CG-SD 4.43Å
130G98.9Very high98.7Very high2 Ų22.4 Ų2.42%0.0211%0.013CC..Hα-helixtrans-57.2-32.4176.300000114.1L126 I127 S128 T327 C328L126-G130 PolarHBondContact O-N 3.16Å; L126-G130 VanDerWaalsContact O-N 3.16Å; I127-G130 PolarHBondContact O-N 3.16Å; I127-G130 VanDerWaalsContact O-N 3.16Å; S128-G130 VanDerWaalsContact C-N 3.27Å; S128-G130 PolarHBondContact O-N 2.86Å; G130-T327 WeakPolarHBondContact O-CB 3.38Å; G130-C328 VanDerWaalsContact CA-SG 3.56Å; G130-C328 WeakPolarHBondContact O-CB 3.37Å; G130-C328 PolarHBondContact O-N 2.85Å; G130-C328 PolarHBondContact O-SG 2.77Å; G130-C328 VanDerWaalsContact O-SG 3.39Å
131A98.8Very high98.7Very high0 Ų02.1 Ų2.10%01%0.012CC..Hα-helixtrans-68.1-37.4175.800000112.3S128 F129 K135 G182 A186 T327 V330S128-A131 WeakPolarHBondContact O-CB 3.36Å; S128-A131 PolarHBondContact O-N 3.4Å; S128-A131 VanDerWaalsContact O-N 3.09Å; F129-A131 PolarHBondContact O-N 3.35Å; A131-K135 PolarHBondContact O-NZ 3.36Å; A131-G182 VanDerWaalsContact CB-C 3.47Å; A131-G182 WeakPolarHBondContact CB-O 3.45Å; A131-A186 HydrophobicContact CB-CB 4.28Å; A131-T327 PolarHBondContact O-N 2.98Å; A131-V330 HydrophobicContact CB-CG2 3.79Å
132V98.8Very high98.7Very high1 Ų12.3 Ų2.31%0.0061%0.013CC..Hα-helixtrans-103.4-0.9-173.7-60.60000114.2F129 G134 K135 T136 M141 M144 V185 A186F129-V132 HydrophobicContact CD2-CG2 4.35Å; F129-V132 CarbonylContact O-C 3.39Å; F129-V132 PolarHBondContact O-N 3.05Å; V132-G134 PolarHBondContact O-N 3.05Å; V132-K135 WeakPolarHBondContact O-CB 3.11Å; V132-K135 PolarHBondContact O-N 3.17Å; V132-K135 VanDerWaalsContact O-N 3.09Å; V132-T136 HydrophobicContact CB-CG2 3.8Å; V132-T136 HydrophobicContact CG2-CG2 3.99Å; V132-M141 HydrophobicContact CG2-SD 4Å; V132-M144 HydrophobicContact CG2-SD 4.3Å; V132-V185 HydrophobicContact CG1-CB 4.33Å; V132-V185 HydrophobicContact CG1-CG1 3.82Å; V132-A186 HydrophobicContact CG1-CB 4.09Å
133L98.7Very high98.7Very high0 Ų03.4 Ų3.40%02%0.019CC..THydrogen-bonded Turntrans-49134.9-177.9-175.472.5000111.3M69 F71 L72 Y75 F129 K135 T327 C328 Y397M69-L133 HydrophobicContact CB-CD1 4.46Å; M69-L133 HydrophobicContact CB-CD2 3.78Å; M69-L133 HydrophobicContact CG-CD2 4.07Å; M69-L133 HydrophobicContact SD-CD1 4.2Å; M69-L133 HydrophobicContact SD-CD2 4.33Å; F71-L133 HydrophobicContact CE1-CD2 4.37Å; L72-L133 HydrophobicContact CD1-CD2 3.65Å; L72-L133 HydrophobicContact CD1-CG 3.95Å; Y75-L133 HydrophobicContact CD1-CD1 3.97Å; Y75-L133 HydrophobicContact CD1-CG 4.17Å; Y75-L133 HydrophobicContact CE1-CD1 3.69Å; Y75-L133 HydrophobicContact CE1-CG 4.13Å; F129-L133 HydrophobicContact CD1-CD1 4.45Å; F129-L133 HydrophobicContact CD2-CD1 4.25Å; F129-L133 HydrophobicContact CE1-CD1 3.77Å; F129-L133 HydrophobicContact CE2-CD1 3.55Å; F129-L133 HydrophobicContact CZ-CD1 3.26Å; F129-L133 WeakPolarHBondContact O-CA 3.32Å; F129-L133 WeakPolarHBondContact O-CB 3.22Å; F129-L133 PolarHBondContact O-N 3.39Å; L133-K135 VanDerWaalsContact C-N 3.25Å; L133-K135 PolarHBondContact O-N 3.09Å; L133-T327 HydrophobicContact CB-CG2 3.98Å; L133-T327 HydrophobicContact CD2-CG2 4.26Å; L133-T327 HydrophobicContact CG-CG2 4.39Å; L133-T327 WeakPolarHBondContact O-CB 3.45Å; L133-T327 WeakPolarHBondContact O-CG2 3.33Å; L133-T327 PolarHBondContact O-OG1 2.83Å; L133-C328 WeakPolarHBondContact CD2-SG 3.46Å; L133-Y397 WeakPolarHBondContact O-CE1 3.47Å
134G98.3Very high98.7Very high1 Ų13.3 Ų3.31%0.012%0.018CC..THydrogen-bonded Turntrans83.1-11.4179.400000115.5Y75 V132 C396 Y397Y75-G134 VanDerWaalsContact CZ-CA 3.43Å; V132-G134 PolarHBondContact O-N 3.05Å; G134-C396 WeakPolarHBondContact O-CA 3.15Å; G134-C396 WeakPolarHBondContact O-CB 3.37Å; G134-Y397 PolarHBondContact O-N 3.23Å
135K98.3Very high98.7Very high17 Ų173.3 Ų3.37%0.0742%0.018CC..THydrogen-bonded Turntrans-117.9-12.1-171.7-60.4166.5-62.5-1490113.8A131 V132 L133 R191 L194 H325 T327 P391 Y397A131-K135 PolarHBondContact O-NZ 3.36Å; V132-K135 WeakPolarHBondContact O-CB 3.11Å; V132-K135 PolarHBondContact O-N 3.17Å; V132-K135 VanDerWaalsContact O-N 3.09Å; L133-K135 VanDerWaalsContact C-N 3.25Å; L133-K135 PolarHBondContact O-N 3.09Å; K135-R191 PolarHBondContact O-NH2 3.45Å; K135-L194 HydrophobicContact CD-CD1 4.03Å; K135-L194 HydrophobicContact CG-CD1 4.05Å; K135-H325 PolarHBondContact NZ-O 3.19Å; K135-T327 WeakPolarHBondContact CE-OG1 3.44Å; K135-T327 PolarHBondContact NZ-OG1 3.34Å; K135-P391 WeakPolarHBondContact O-CD 3.44Å; K135-Y397 HydrophobicContact CG-CE1 4.38Å; K135-Y397 HydrophobicContact CG-CE2 4.47Å
136T98.2Very high98.7Very high1 Ų15 Ų51%0.0063%0.027CC..SBendtrans-112.3156.1-178.650.90000112.2V132 Q140 M141 L189V132-T136 HydrophobicContact CB-CG2 3.8Å; V132-T136 HydrophobicContact CG2-CG2 3.99Å; T136-Q140 HydrophobicContact CG2-CB 4.48Å; T136-M141 PolarHBondContact OG1-SD 2.64Å; T136-M141 VanDerWaalsContact OG1-SD 3.4Å; T136-L189 HydrophobicContact CG2-CD1 3.9Å
137S98.4Very high98.7Very high0 Ų07.2 Ų7.20%04%0.038CC..  trans-87.2159.4174.278.80000111.9T139 Q140 M141 W388 G389 Y402S137-T139 PolarHBondContact O-N 3.07Å; S137-T139 VanDerWaalsContact O-N 3.17Å; S137-T139 PolarHBondContact OG-N 3.22Å; S137-Q140 WeakPolarHBondContact O-CB 3.46Å; S137-Q140 PolarHBondContact O-N 2.96Å; S137-Q140 PolarHBondContact OG-N 3.29Å; S137-Q140 VanDerWaalsContact OG-N 3.11Å; S137-M141 WeakPolarHBondContact O-CG 3.2Å; S137-M141 PolarHBondContact O-N 3.28Å; S137-W388 WeakPolarHBondContact CB-O 3.02Å; S137-W388 PolarHBondContact OG-O 3.02Å; S137-G389 WeakPolarHBondContact CB-O 3.47Å; S137-Y402 WeakPolarHBondContact CA-OH 3.49Å; S137-Y402 VanDerWaalsContact CB-OH 3.24Å; S137-Y402 WeakPolarHBondContact CB-OH 3.44Å
138P98.4Very high98.7Very high12 Ų127.2 Ų7.28%0.0784%0.038CC..Hα-helixtrans-53-33.9169.7-27.432.1000113.9M1 F5 I82 L85 M141 L142 Y402M1-P138 HydrophobicContact CE-CB 4Å; M1-P138 HydrophobicContact CE-CG 4.07Å; F5-P138 HydrophobicContact CD2-CB 3.79Å; F5-P138 HydrophobicContact CE2-CB 3.52Å; F5-P138 HydrophobicContact CZ-CB 4.31Å; I82-P138 HydrophobicContact CD1-CG 3.87Å; I82-P138 HydrophobicContact CG1-CG 4.23Å; L85-P138 HydrophobicContact CD2-CB 4.26Å; P138-M141 PolarHBondContact O-N 2.84Å; P138-L142 WeakPolarHBondContact O-CG 3.17Å; P138-L142 PolarHBondContact O-N 3.41Å; P138-L142 VanDerWaalsContact O-N 3.09Å; P138-Y402 HydrophobicContact CG-CD2 4.39Å; P138-Y402 HydrophobicContact CG-CG 4.3Å
139T98.4Very high98.7Very high4 Ų47.2 Ų7.23%0.0254%0.038CC..Hα-helixtrans-68.8-41.8176.2-64.30000112M1 S137 M141 L142 I143 W388M1-T139 VanDerWaalsContact CE-OG1 3.3Å; M1-T139 WeakPolarHBondContact CE-OG1 3.43Å; S137-T139 PolarHBondContact O-N 3.07Å; S137-T139 VanDerWaalsContact O-N 3.17Å; S137-T139 PolarHBondContact OG-N 3.22Å; T139-M141 PolarHBondContact O-N 2.83Å; T139-L142 PolarHBondContact O-N 3.18Å; T139-I143 HydrophobicContact CG2-CD1 4.16Å; T139-I143 WeakPolarHBondContact O-CG1 3.39Å; T139-I143 PolarHBondContact O-N 3.48Å; T139-W388 HydrophobicContact CG2-CE3 4.27Å
140Q98.6Very high98.7Very high4 Ų410.4 Ų10.42%0.0196%0.058CC..Hα-helixtrans-61-37.5174.1-71.5175-62.900111T136 S137 I143 M144 L383 W388T136-Q140 HydrophobicContact CG2-CB 4.48Å; S137-Q140 WeakPolarHBondContact O-CB 3.46Å; S137-Q140 PolarHBondContact O-N 2.96Å; S137-Q140 PolarHBondContact OG-N 3.29Å; S137-Q140 VanDerWaalsContact OG-N 3.11Å; Q140-I143 PolarHBondContact O-N 3.02Å; Q140-M144 WeakPolarHBondContact O-CB 3.49Å; Q140-M144 PolarHBondContact O-N 2.99Å; Q140-L383 HydrophobicContact CB-CD2 3.95Å; Q140-L383 HydrophobicContact CG-CD2 4.19Å; Q140-L383 PolarHBondContact NE2-O 3.17Å; Q140-L383 WeakPolarHBondContact O-CD2 3.47Å; Q140-W388 HydrophobicContact CG-CB 3.4Å; Q140-W388 HydrophobicContact CG-CG 3.89Å
141M98.8Very high98.7Very high0 Ų012.4 Ų12.40%07%0.066CC..Hα-helixtrans-65.7-43.6178.2-66.4-51.4-56.100112.5I82 V86 F129 V132 T136 S137 P138 T139 I143 M144 T145I82-M141 HydrophobicContact CG2-CB 4.01Å; I82-M141 HydrophobicContact CG2-CG 3.82Å; V86-M141 HydrophobicContact CG2-CB 3.75Å; V86-M141 HydrophobicContact CG2-CE 3.94Å; F129-M141 HydrophobicContact CB-CE 3.56Å; F129-M141 HydrophobicContact CD1-CE 4.46Å; F129-M141 HydrophobicContact CD2-CE 3.3Å; F129-M141 HydrophobicContact CD2-CG 4.34Å; F129-M141 HydrophobicContact CD2-SD 3.59Å; F129-M141 VanDerWaalsContact CD2-SD 3.59Å; F129-M141 HydrophobicContact CE2-CE 4.1Å; F129-M141 HydrophobicContact CE2-CG 4.26Å; F129-M141 HydrophobicContact CE2-SD 4.03Å; F129-M141 HydrophobicContact CG-CE 3.52Å; F129-M141 HydrophobicContact CG-SD 4.43Å; V132-M141 HydrophobicContact CG2-SD 4Å; T136-M141 PolarHBondContact OG1-SD 2.64Å; T136-M141 VanDerWaalsContact OG1-SD 3.4Å; S137-M141 WeakPolarHBondContact O-CG 3.2Å; S137-M141 PolarHBondContact O-N 3.28Å; P138-M141 PolarHBondContact O-N 2.84Å; T139-M141 PolarHBondContact O-N 2.83Å; M141-I143 VanDerWaalsContact C-N 3.31Å; M141-I143 PolarHBondContact O-N 2.94Å; M141-M144 HydrophobicContact CE-CE 3.41Å; M141-M144 VanDerWaalsContact CE-CE 3.41Å; M141-M144 HydrophobicContact CE-SD 4.44Å; M141-M144 PolarHBondContact O-N 3.31Å; M141-M144 HydrophobicContact SD-CE 4.16Å; M141-M144 HydrophobicContact SD-SD 4.49Å; M141-T145 PolarHBondContact O-N 2.91Å; M141-T145 PolarHBondContact O-OG1 3.4Å
142L98.8Very high98.7Very high4 Ų412.4 Ų12.42%0.0217%0.066CC..Hα-helixtrans-58.2-42.5173.7-65.3173.2000112.2F5 M8 A9 L12 L85 L89 P138 T139 T145 I146F5-L142 HydrophobicContact CD2-CD1 4.16Å; F5-L142 HydrophobicContact CE2-CD1 3.83Å; M8-L142 HydrophobicContact CB-CD1 4.48Å; M8-L142 HydrophobicContact CG-CB 4.48Å; M8-L142 HydrophobicContact CG-CD1 4Å; A9-L142 HydrophobicContact CB-CD1 4.23Å; L12-L142 HydrophobicContact CD1-CB 3.97Å; L12-L142 HydrophobicContact CD1-CD1 4.37Å; L85-L142 HydrophobicContact CD1-CD2 4.16Å; L85-L142 HydrophobicContact CD2-CD2 4.06Å; L85-L142 HydrophobicContact CD2-CG 4.35Å; L85-L142 HydrophobicContact CG-CD2 3.93Å; L89-L142 HydrophobicContact CB-CD2 4.46Å; L89-L142 HydrophobicContact CD2-CB 4.25Å; L89-L142 HydrophobicContact CD2-CD2 3.6Å; P138-L142 WeakPolarHBondContact O-CG 3.17Å; P138-L142 PolarHBondContact O-N 3.41Å; P138-L142 VanDerWaalsContact O-N 3.09Å; T139-L142 PolarHBondContact O-N 3.18Å; L142-T145 PolarHBondContact O-N 3.39Å; L142-I146 WeakPolarHBondContact O-CG1 3.25Å; L142-I146 PolarHBondContact O-N 3.35Å
143I98.8Very high98.6Very high22 Ų2212.4 Ų12.411%0.1137%0.066CC..Hα-helixtrans-65.7-44.5177.8-64.9165.4000110.7M8 T139 Q140 M141 T145 I146 L147 I382 L383 W388M8-I143 HydrophobicContact CE-CD1 4.27Å; M8-I143 HydrophobicContact CE-CG1 4.18Å; T139-I143 HydrophobicContact CG2-CD1 4.16Å; T139-I143 WeakPolarHBondContact O-CG1 3.39Å; T139-I143 PolarHBondContact O-N 3.48Å; Q140-I143 PolarHBondContact O-N 3.02Å; M141-I143 VanDerWaalsContact C-N 3.31Å; M141-I143 PolarHBondContact O-N 2.94Å; I143-T145 VanDerWaalsContact C-N 3.35Å; I143-T145 PolarHBondContact O-N 2.93Å; I143-I146 PolarHBondContact O-N 3.23Å; I143-L147 HydrophobicContact CG2-CD1 3.85Å; I143-L147 HydrophobicContact CG2-CG 4.48Å; I143-L147 WeakPolarHBondContact O-CG 3.09Å; I143-L147 PolarHBondContact O-N 2.71Å; I143-L147 VanDerWaalsContact O-N 3.12Å; I143-I382 HydrophobicContact CG2-CG2 4.2Å; I143-L383 HydrophobicContact CB-CD2 3.86Å; I143-L383 HydrophobicContact CG2-CD2 3.71Å; I143-W388 HydrophobicContact CD1-CD2 3.94Å; I143-W388 HydrophobicContact CD1-CE3 3.77Å; I143-W388 HydrophobicContact CD1-CH2 4.22Å; I143-W388 HydrophobicContact CD1-CZ2 4.36Å; I143-W388 HydrophobicContact CD1-CZ3 3.93Å
144M98.9Very high98.6Very high0 Ų016.9 Ų16.90%09%0.087CC..Hα-helixtrans-59.7-46.1177.7-162177.284.500110.8V125 V132 Q140 M141 I146 L147 E148 F181 V185 T379 L383V125-M144 HydrophobicContact CG1-CE 3.99Å; V132-M144 HydrophobicContact CG2-SD 4.3Å; Q140-M144 WeakPolarHBondContact O-CB 3.49Å; Q140-M144 PolarHBondContact O-N 2.99Å; M141-M144 HydrophobicContact CE-CE 3.41Å; M141-M144 VanDerWaalsContact CE-CE 3.41Å; M141-M144 HydrophobicContact CE-SD 4.44Å; M141-M144 PolarHBondContact O-N 3.31Å; M141-M144 HydrophobicContact SD-CE 4.16Å; M141-M144 HydrophobicContact SD-SD 4.49Å; M144-I146 PolarHBondContact O-N 3.21Å; M144-L147 PolarHBondContact O-N 3.14Å; M144-E148 WeakPolarHBondContact O-CB 3.21Å; M144-E148 PolarHBondContact O-N 3.17Å; M144-F181 HydrophobicContact CG-CE1 4.03Å; M144-V185 HydrophobicContact SD-CG1 4.38Å; M144-T379 HydrophobicContact CB-CG2 4.42Å; M144-T379 HydrophobicContact CG-CG2 3.93Å; M144-L383 HydrophobicContact CB-CD1 4Å; M144-L383 HydrophobicContact CG-CD1 4.13Å; M144-L383 HydrophobicContact SD-CD1 4.26Å
145T98.9Very high98.6Very high0 Ų016.9 Ų16.90%09%0.086CC..Hα-helixtrans-54.9-48.1176.7-55.80000112.2L89 V125 M141 L142 I143 I149L89-T145 HydrophobicContact CB-CG2 4.31Å; L89-T145 HydrophobicContact CD2-CG2 3.89Å; L89-T145 HydrophobicContact CG-CG2 3.94Å; V125-T145 HydrophobicContact CG1-CG2 4.48Å; V125-T145 HydrophobicContact CG2-CG2 4.42Å; M141-T145 PolarHBondContact O-N 2.91Å; M141-T145 PolarHBondContact O-OG1 3.4Å; L142-T145 PolarHBondContact O-N 3.39Å; I143-T145 VanDerWaalsContact C-N 3.35Å; I143-T145 PolarHBondContact O-N 2.93Å; T145-I149 HydrophobicContact CG2-CD1 3.82Å; T145-I149 WeakPolarHBondContact O-CB 3.23Å; T145-I149 WeakPolarHBondContact O-CG1 3.24Å; T145-I149 PolarHBondContact O-N 3.05Å
146I98.8Very high98.6Very high36 Ų3617.3 Ų17.319%0.1859%0.089CC..Hα-helixtrans-62.5-47-179.6-66.4-59.9000111.4L12 M16 L89 W93 L142 I143 M144 V150L12-I146 HydrophobicContact CD1-CG1 4.45Å; L12-I146 HydrophobicContact CD2-CD1 4.07Å; L12-I146 HydrophobicContact CD2-CG1 3.98Å; M16-I146 HydrophobicContact CE-CD1 3.87Å; L89-I146 HydrophobicContact CD1-CD1 4.18Å; L89-I146 HydrophobicContact CD2-CD1 4.11Å; L89-I146 HydrophobicContact CD2-CG1 4.25Å; L89-I146 HydrophobicContact CG-CD1 4.36Å; W93-I146 HydrophobicContact CB-CD1 4.24Å; W93-I146 HydrophobicContact CD2-CD1 4Å; W93-I146 HydrophobicContact CG-CD1 3.71Å; W93-I146 HydrophobicContact CZ2-CG2 4.38Å; W93-I146 PolarHBondContact NE1-O 3.34Å; L142-I146 WeakPolarHBondContact O-CG1 3.25Å; L142-I146 PolarHBondContact O-N 3.35Å; I143-I146 PolarHBondContact O-N 3.23Å; M144-I146 PolarHBondContact O-N 3.21Å; I146-V150 WeakPolarHBondContact O-CG2 3.06Å
147L98.9Very high98.5Very high47 Ų4720.5 Ų20.525%0.24610%0.101CC..Hα-helixtrans-71.1-47.7-176.3-66.3173.8000111.8I143 M144 I149 V150 F151 T379 I382I143-L147 HydrophobicContact CG2-CD1 3.85Å; I143-L147 HydrophobicContact CG2-CG 4.48Å; I143-L147 WeakPolarHBondContact O-CG 3.09Å; I143-L147 PolarHBondContact O-N 2.71Å; I143-L147 VanDerWaalsContact O-N 3.12Å; M144-L147 PolarHBondContact O-N 3.14Å; L147-I149 PolarHBondContact O-N 3.28Å; L147-V150 PolarHBondContact O-N 3.03Å; L147-F151 VanDerWaalsContact O-CD2 3.23Å; L147-F151 WeakPolarHBondContact O-CD2 3.47Å; L147-F151 PolarHBondContact O-N 3.46Å; L147-T379 HydrophobicContact CB-CG2 4.31Å; L147-T379 HydrophobicContact CD1-CG2 3.93Å; L147-I382 HydrophobicContact CD1-CD1 3.71Å
148E98.9Very high98.4Very high0 Ų022.3 Ų22.30%011%0.111CC..Hα-helixtrans-61.7-43.5-176.4-174.6169.9-179.100112.2V125 S128 M144 V150 F151 F152 F177 F181V125-E148 HydrophobicContact CG2-CB 4.19Å; V125-E148 HydrophobicContact CG2-CG 4.16Å; S128-E148 VanDerWaalsContact CB-OE1 3.23Å; S128-E148 WeakPolarHBondContact CB-OE1 3.49Å; S128-E148 WeakPolarHBondContact CB-OE2 3.47Å; S128-E148 PolarHBondContact OG-OE1 3.13Å; S128-E148 PolarHBondContact OG-OE2 3.47Å; M144-E148 WeakPolarHBondContact O-CB 3.21Å; M144-E148 PolarHBondContact O-N 3.17Å; E148-V150 PolarHBondContact O-N 3.07Å; E148-F151 PolarHBondContact O-N 2.85Å; E148-F151 VanDerWaalsContact O-N 3.15Å; E148-F152 WeakPolarHBondContact O-CB 3.48Å; E148-F152 PolarHBondContact O-N 2.8Å; E148-F177 HydrophobicContact CG-CE1 4.19Å; E148-F181 HydrophobicContact CB-CD1 4.3Å; E148-F181 HydrophobicContact CB-CE1 3.66Å; E148-F181 HydrophobicContact CB-CE2 4.05Å; E148-F181 HydrophobicContact CB-CZ 3.51Å; E148-F181 VanDerWaalsContact CD-CD1 3.43Å; E148-F181 HydrophobicContact CG-CD1 3.8Å; E148-F181 HydrophobicContact CG-CD2 4.09Å; E148-F181 HydrophobicContact CG-CE1 3.68Å; E148-F181 HydrophobicContact CG-CE2 3.97Å; E148-F181 HydrophobicContact CG-CG 4Å; E148-F181 HydrophobicContact CG-CZ 3.76Å
149I98.9Very high98.4Very high0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-62.4-32.2179.3-72.8177.4000111.9W93 V97 V125 T145 L147 F152 A153W93-I149 HydrophobicContact CB-CD1 4.44Å; W93-I149 HydrophobicContact CG-CG2 4.29Å; V97-I149 HydrophobicContact CB-CG2 4.24Å; V97-I149 HydrophobicContact CG2-CG2 4.24Å; V125-I149 HydrophobicContact CG2-CD1 4.12Å; V125-I149 HydrophobicContact CG2-CG1 3.71Å; T145-I149 HydrophobicContact CG2-CD1 3.82Å; T145-I149 WeakPolarHBondContact O-CB 3.23Å; T145-I149 WeakPolarHBondContact O-CG1 3.24Å; T145-I149 PolarHBondContact O-N 3.05Å; L147-I149 PolarHBondContact O-N 3.28Å; I149-F152 PolarHBondContact O-N 3.47Å; I149-A153 VanDerWaalsContact O-CB 3.3Å; I149-A153 WeakPolarHBondContact O-CB 3.45Å; I149-A153 PolarHBondContact O-N 2.92Å
150V98.6Very high98.2Very high68 Ų6824 Ų2441%0.41212%0.123SC..Hα-helixtrans-66.6-46.6174.7175.80000111.1W93 V97 I146 L147 E148 F152 H154W93-V150 HydrophobicContact CZ2-CG2 3.69Å; V97-V150 HydrophobicContact CG2-CG2 4.42Å; I146-V150 WeakPolarHBondContact O-CG2 3.06Å; L147-V150 PolarHBondContact O-N 3.03Å; E148-V150 PolarHBondContact O-N 3.07Å; V150-F152 VanDerWaalsContact C-N 3.34Å; V150-H154 WeakPolarHBondContact O-CB 3.25Å; V150-H154 PolarHBondContact O-N 2.99Å
151F98.8Very high98Very high43 Ų4328.1 Ų28.119%0.18914%0.142CC..Hα-helixtrans-65.2-39.2176.4-74.4-76.3000111.9L147 E148 N155 F177 F181 T371 M378L147-F151 VanDerWaalsContact O-CD2 3.23Å; L147-F151 WeakPolarHBondContact O-CD2 3.47Å; L147-F151 PolarHBondContact O-N 3.46Å; E148-F151 PolarHBondContact O-N 2.85Å; E148-F151 VanDerWaalsContact O-N 3.15Å; F151-N155 WeakPolarHBondContact O-CB 3.27Å; F151-N155 PolarHBondContact O-N 2.9Å; F151-F177 HydrophobicContact CB-CE2 4.34Å; F151-F177 HydrophobicContact CB-CZ 3.77Å; F151-F181 HydrophobicContact CB-CE2 4.47Å; F151-F181 HydrophobicContact CD2-CE2 4.1Å; F151-T371 HydrophobicContact CB-CG2 4.38Å; F151-T371 HydrophobicContact CD1-CG2 4.12Å; F151-M378 HydrophobicContact CE1-SD 4.48Å; F151-M378 HydrophobicContact CZ-CE 4.23Å; F151-M378 HydrophobicContact CZ-SD 3.95Å
152F98.8Very high97.8Very high0 Ų032.7 Ų32.70%017%0.165CC..Hα-helixtrans-60.4-54.2175.9165.8-98.7000110.7T124 E148 I149 V150 H154 N155 E156 T173 I174 F177T124-F152 HydrophobicContact CG2-CB 4.44Å; T124-F152 HydrophobicContact CG2-CD2 3.83Å; T124-F152 HydrophobicContact CG2-CG 4.33Å; T124-F152 WeakPolarHBondContact OG1-CD2 3.29Å; T124-F152 WeakPolarHBondContact OG1-CE2 3.26Å; E148-F152 WeakPolarHBondContact O-CB 3.48Å; E148-F152 PolarHBondContact O-N 2.8Å; I149-F152 PolarHBondContact O-N 3.47Å; V150-F152 VanDerWaalsContact C-N 3.34Å; F152-H154 VanDerWaalsContact C-N 3.29Å; F152-H154 PolarHBondContact O-N 3.03Å; F152-N155 PolarHBondContact O-N 3.43Å; F152-N155 VanDerWaalsContact O-N 3.09Å; F152-E156 WeakPolarHBondContact O-CB 3.49Å; F152-E156 PolarHBondContact O-N 3.35Å; F152-T173 VanDerWaalsContact CD2-O 3.31Å; F152-T173 WeakPolarHBondContact CD2-O 3.36Å; F152-T173 VanDerWaalsContact CE2-O 3.26Å; F152-T173 WeakPolarHBondContact CE2-O 3.3Å; F152-I174 HydrophobicContact CE2-CG1 3.83Å; F152-I174 HydrophobicContact CZ-CG1 4.27Å; F152-F177 HydrophobicContact CB-CD1 4.37Å; F152-F177 HydrophobicContact CB-CE1 3.72Å; F152-F177 HydrophobicContact CB-CZ 4Å; F152-F177 HydrophobicContact CD2-CD1 4.27Å; F152-F177 HydrophobicContact CD2-CE1 4.45Å; F152-F177 VanDerWaalsContact N-CZ 3.32Å
153A98.3Very high97.7Very high1 Ų134.8 Ų34.81%0.00817%0.174CC..Hα-helixtrans-61.8-38.6-178.400000111.8V97 Q98 L101 I149 E156 Y157V97-A153 HydrophobicContact CB-CB 4.39Å; V97-A153 HydrophobicContact CG1-CB 3.44Å; V97-A153 VanDerWaalsContact CG1-CB 3.44Å; Q98-A153 HydrophobicContact CG-CB 4.09Å; L101-A153 HydrophobicContact CD2-CB 4.27Å; L101-A153 VanDerWaalsContact CD2-O 3.23Å; L101-A153 WeakPolarHBondContact CD2-O 3.42Å; I149-A153 VanDerWaalsContact O-CB 3.3Å; I149-A153 WeakPolarHBondContact O-CB 3.45Å; I149-A153 PolarHBondContact O-N 2.92Å; A153-E156 PolarHBondContact O-N 3.45Å; A153-Y157 WeakPolarHBondContact O-CB 3.31Å; A153-Y157 PolarHBondContact O-N 3.29Å
154H97.7Very high97.6Very high95 Ų9539.5 Ų39.544%0.4419%0.194SC..Hα-helixtrans-62-47172.9-177.268.8000112.1V150 F152 Y157 L158V150-H154 WeakPolarHBondContact O-CB 3.25Å; V150-H154 PolarHBondContact O-N 2.99Å; F152-H154 VanDerWaalsContact C-N 3.29Å; F152-H154 PolarHBondContact O-N 3.03Å; H154-Y157 PolarHBondContact O-N 2.81Å; H154-L158 WeakPolarHBondContact O-CG 3.17Å; H154-L158 PolarHBondContact O-N 3.38Å
155N98.5Very high97.5Very high0 Ų040.1 Ų40.10%020%0.2CC..Hα-helixtrans-64.3-41.9177.5-179.765.5000112.1F151 F152 Y157 L158 V159 F177 S367 S368 T371F151-N155 WeakPolarHBondContact O-CB 3.27Å; F151-N155 PolarHBondContact O-N 2.9Å; F152-N155 PolarHBondContact O-N 3.43Å; F152-N155 VanDerWaalsContact O-N 3.09Å; N155-Y157 VanDerWaalsContact C-N 3.32Å; N155-Y157 PolarHBondContact O-N 2.88Å; N155-L158 WeakPolarHBondContact O-CB 3.35Å; N155-L158 PolarHBondContact O-N 3.49Å; N155-V159 WeakPolarHBondContact O-CG2 3.39Å; N155-V159 PolarHBondContact O-N 2.86Å; N155-F177 HydrophobicContact CB-CD2 4.03Å; N155-F177 HydrophobicContact CB-CE2 3.96Å; N155-S367 PolarHBondContact OD1-O 3.4Å; N155-S367 PolarHBondContact OD1-OG 3.1Å; N155-S368 WeakPolarHBondContact ND2-CA 2.99Å; N155-S368 WeakPolarHBondContact ND2-CB 3.23Å; N155-S368 PolarHBondContact ND2-OG 2.92Å; N155-S368 WeakPolarHBondContact OD1-CA 3.46Å; N155-S368 PolarHBondContact OD1-N 3.33Å; N155-S368 PolarHBondContact OD1-OG 3.23Å; N155-T371 HydrophobicContact CB-CG2 4.18Å
156E97.5Very high97.3Very high27 Ų2741.1 Ų41.113%0.12621%0.206CC..Hα-helixtrans-56.5-48.3175.3-176.3-177-121.200110.4Q98 F152 A153 L158 V159 S160Q98-E156 PolarHBondContact NE2-OE1 3.15Å; Q98-E156 PolarHBondContact NE2-OE2 2.99Å; F152-E156 WeakPolarHBondContact O-CB 3.49Å; F152-E156 PolarHBondContact O-N 3.35Å; A153-E156 PolarHBondContact O-N 3.45Å; E156-L158 PolarHBondContact O-N 2.81Å; E156-V159 PolarHBondContact O-N 2.88Å; E156-S160 WeakPolarHBondContact O-CB 3.47Å; E156-S160 PolarHBondContact O-N 3.26Å; E156-S160 PolarHBondContact O-OG 3.31Å
157Y96.2Very high97.3Very high68 Ų6840.2 Ų40.227%0.26720%0.202SC..Hα-helixtrans-60.7-41175.6-177.6-91.9000112.8L101 A153 H154 N155 V159 E161 I162L101-Y157 HydrophobicContact CD1-CD2 4.5Å; L101-Y157 HydrophobicContact CD2-CD2 4.22Å; L101-Y157 HydrophobicContact CD2-CG 3.98Å; L101-Y157 HydrophobicContact CG-CD2 3.9Å; L101-Y157 HydrophobicContact CG-CG 4.09Å; A153-Y157 WeakPolarHBondContact O-CB 3.31Å; A153-Y157 PolarHBondContact O-N 3.29Å; H154-Y157 PolarHBondContact O-N 2.81Å; N155-Y157 VanDerWaalsContact C-N 3.32Å; N155-Y157 PolarHBondContact O-N 2.88Å; Y157-V159 VanDerWaalsContact C-N 3.34Å; Y157-V159 PolarHBondContact O-N 3.4Å; Y157-E161 HydrophobicContact CD2-CB 3.92Å; Y157-E161 HydrophobicContact CD2-CG 3.68Å; Y157-E161 HydrophobicContact CE1-CB 4.39Å; Y157-E161 HydrophobicContact CE2-CB 3.79Å; Y157-E161 HydrophobicContact CE2-CG 3.7Å; Y157-E161 HydrophobicContact CG-CB 4.28Å; Y157-E161 HydrophobicContact CG-CG 4.41Å; Y157-E161 WeakPolarHBondContact O-CA 3Å; Y157-E161 VanDerWaalsContact O-CB 3.27Å; Y157-E161 WeakPolarHBondContact O-CB 3.31Å; Y157-E161 PolarHBondContact O-N 2.92Å; Y157-I162 HydrophobicContact CD1-CG1 4.33Å; Y157-I162 HydrophobicContact CE1-CD1 3.95Å; Y157-I162 HydrophobicContact CE1-CG1 4.09Å; Y157-I162 PolarHBondContact O-N 3.39Å
158L96.9Very high97.2Very high38 Ų3839 Ų3920%0.19920%0.195CC..Iπ-helixtrans-59.8-45.5174.1-70177.3000111.5H154 N155 E156 I162 F163H154-L158 WeakPolarHBondContact O-CG 3.17Å; H154-L158 PolarHBondContact O-N 3.38Å; N155-L158 WeakPolarHBondContact O-CB 3.35Å; N155-L158 PolarHBondContact O-N 3.49Å; E156-L158 PolarHBondContact O-N 2.81Å; L158-I162 HydrophobicContact CD2-CG1 4.12Å; L158-I162 WeakPolarHBondContact O-CB 3.18Å; L158-I162 PolarHBondContact O-N 2.84Å; L158-F163 HydrophobicContact CB-CE2 4.31Å; L158-F163 WeakPolarHBondContact O-CD2 3.46Å; L158-F163 WeakPolarHBondContact O-CG 3.45Å; L158-F163 PolarHBondContact O-N 3.32Å
159V97.8Very high97.1Very high4 Ų439 Ų392%0.02420%0.195CC..Iπ-helixtrans-69.1-50.8-177.8171.60000111.6N155 E156 Y157 K164 A165 T173 A364N155-V159 WeakPolarHBondContact O-CG2 3.39Å; N155-V159 PolarHBondContact O-N 2.86Å; E156-V159 PolarHBondContact O-N 2.88Å; Y157-V159 VanDerWaalsContact C-N 3.34Å; Y157-V159 PolarHBondContact O-N 3.4Å; V159-K164 PolarHBondContact O-N 3.18Å; V159-A165 HydrophobicContact CG1-CB 3.91Å; V159-A165 PolarHBondContact O-N 3.46Å; V159-T173 HydrophobicContact CB-CG2 3.82Å; V159-T173 HydrophobicContact CG1-CG2 3.76Å; V159-T173 HydrophobicContact CG2-CG2 3.83Å; V159-A364 HydrophobicContact CB-CB 4.3Å; V159-A364 HydrophobicContact CG1-CB 3.85Å; V159-A364 HydrophobicContact CG2-CB 3.78Å
160S94.8Very high97.1Very high48 Ų4839.3 Ų39.334%0.33620%0.198SC..Iπ-helixtrans-82.4-37.4-17265.40000113.3E156 K164E156-S160 WeakPolarHBondContact O-CB 3.47Å; E156-S160 PolarHBondContact O-N 3.26Å; E156-S160 PolarHBondContact O-OG 3.31Å; S160-K164 VanDerWaalsContact O-CD 3.23Å; S160-K164 WeakPolarHBondContact O-CD 3.37Å; S160-K164 PolarHBondContact O-NZ 3.32Å
161E93.8Very high97.1Very high90 Ų9036 Ų3642%0.42118%0.178SC..Iπ-helixtrans-99.9-38.2-174.3-64.5-55140.300113.8Y157 K164Y157-E161 HydrophobicContact CD2-CB 3.92Å; Y157-E161 HydrophobicContact CD2-CG 3.68Å; Y157-E161 HydrophobicContact CE1-CB 4.39Å; Y157-E161 HydrophobicContact CE2-CB 3.79Å; Y157-E161 HydrophobicContact CE2-CG 3.7Å; Y157-E161 HydrophobicContact CG-CB 4.28Å; Y157-E161 HydrophobicContact CG-CG 4.41Å; Y157-E161 WeakPolarHBondContact O-CA 3Å; Y157-E161 VanDerWaalsContact O-CB 3.27Å; Y157-E161 WeakPolarHBondContact O-CB 3.31Å; Y157-E161 PolarHBondContact O-N 2.92Å; E161-K164 WeakPolarHBondContact O-CD 3.46Å; E161-K164 WeakPolarHBondContact O-CE 3.49Å; E161-K164 PolarHBondContact O-NZ 2.82Å; E161-K164 IonicContact OE1-NZ 3.12Å; E161-K164 IonicContact OE2-NZ 2.93Å; E161-K164 PolarHBondContact OE2-NZ 2.66Å
162I95.4Very high97.1Very high95 Ų9534 Ų3449%0.48717%0.169SC..Iπ-helixtrans-91.2-53.5-176.6-53.9-57000111.4Y157 L158 K164Y157-I162 HydrophobicContact CD1-CG1 4.33Å; Y157-I162 HydrophobicContact CE1-CD1 3.95Å; Y157-I162 HydrophobicContact CE1-CG1 4.09Å; Y157-I162 PolarHBondContact O-N 3.39Å; L158-I162 HydrophobicContact CD2-CG1 4.12Å; L158-I162 WeakPolarHBondContact O-CB 3.18Å; L158-I162 PolarHBondContact O-N 2.84Å; I162-K164 VanDerWaalsContact C-N 3.33Å
163F97Very high97.1Very high48 Ų4834.5 Ų34.521%0.21117%0.172CC..SBendtrans-78.7-19.8-179.1-59-34.2000112.9L158 A165 M360 A363 A364 S367L158-F163 HydrophobicContact CB-CE2 4.31Å; L158-F163 WeakPolarHBondContact O-CD2 3.46Å; L158-F163 WeakPolarHBondContact O-CG 3.45Å; L158-F163 PolarHBondContact O-N 3.32Å; F163-A165 HydrophobicContact CB-CB 4.15Å; F163-A165 PolarHBondContact O-N 3.07Å; F163-A165 VanDerWaalsContact O-N 3.14Å; F163-M360 HydrophobicContact CB-CB 4.24Å; F163-M360 HydrophobicContact CB-SD 4.19Å; F163-M360 HydrophobicContact CD1-SD 3.93Å; F163-M360 HydrophobicContact CG-SD 4.41Å; F163-M360 VanDerWaalsContact O-CB 3.27Å; F163-M360 WeakPolarHBondContact O-CB 3.39Å; F163-M360 WeakPolarHBondContact O-CG 3.46Å; F163-A363 HydrophobicContact CD1-CB 4.31Å; F163-A363 HydrophobicContact CD2-CB 4.29Å; F163-A363 HydrophobicContact CE1-CB 4.25Å; F163-A363 HydrophobicContact CE2-CB 4.22Å; F163-A363 HydrophobicContact CG-CB 4.34Å; F163-A363 HydrophobicContact CZ-CB 4.21Å; F163-A364 HydrophobicContact CD2-CB 4.14Å; F163-S367 WeakPolarHBondContact CE2-OG 3.15Å
164K96.2Very high97.1Very high121 Ų12134.6 Ų34.653%0.52617%0.173SC..  trans50.336-172.4-58.5-56-172.1-176.20111.1V159 S160 E161 I162 T356V159-K164 PolarHBondContact O-N 3.18Å; S160-K164 VanDerWaalsContact O-CD 3.23Å; S160-K164 WeakPolarHBondContact O-CD 3.37Å; S160-K164 PolarHBondContact O-NZ 3.32Å; E161-K164 WeakPolarHBondContact O-CD 3.46Å; E161-K164 WeakPolarHBondContact O-CE 3.49Å; E161-K164 PolarHBondContact O-NZ 2.82Å; E161-K164 IonicContact OE1-NZ 3.12Å; E161-K164 IonicContact OE2-NZ 2.93Å; E161-K164 PolarHBondContact OE2-NZ 2.66Å; I162-K164 VanDerWaalsContact C-N 3.33Å; K164-T356 WeakPolarHBondContact O-CG2 3.37Å
165A97.1Very high97.2Very high14 Ų1430.1 Ų30.112%0.11615%0.152CC..  trans-75.4151.5176.800000109.8V159 F163 A364V159-A165 HydrophobicContact CG1-CB 3.91Å; V159-A165 PolarHBondContact O-N 3.46Å; F163-A165 HydrophobicContact CB-CB 4.15Å; F163-A165 PolarHBondContact O-N 3.07Å; F163-A165 VanDerWaalsContact O-N 3.14Å; A165-A364 HydrophobicContact CB-CB 3.44Å; A165-A364 VanDerWaalsContact CB-CB 3.44Å
166S95.4Very high97.2Very high20 Ų2030.1 Ų30.114%0.1415%0.152CC..  trans-100.4123.9176.5166.10000108.1T285 M289 Q361S166-T285 WeakPolarHBondContact O-CG2 3.36Å; S166-M289 VanDerWaalsContact OG-CE 3.31Å; S166-M289 WeakPolarHBondContact OG-CE 3.31Å; S166-Q361 PolarHBondContact O-NE2 3Å; S166-Q361 PolarHBondContact O-OE1 2.59Å
167D97.8Very high97.3Very high18 Ų1828.8 Ų28.810%0.09615%0.146CC..  trans-14659.1177.2-165.624.3000110.9G169 A170 S171 M172 T173 T285D167-G169 PolarHBondContact O-N 2.9Å; D167-A170 WeakPolarHBondContact O-CA 3.36Å; D167-A170 PolarHBondContact O-N 3.12Å; D167-A170 WeakPolarHBondContact OD2-CA 3.41Å; D167-S171 PolarHBondContact OD1-N 2.53Å; D167-M172 HydrophobicContact CB-CE 3.58Å; D167-M172 PolarHBondContact OD1-N 3.48Å; D167-M172 VanDerWaalsContact OD2-CA 3.31Å; D167-M172 WeakPolarHBondContact OD2-CA 3.24Å; D167-M172 WeakPolarHBondContact OD2-CB 3.29Å; D167-M172 PolarHBondContact OD2-N 2.89Å; D167-T173 PolarHBondContact OD2-N 3.28Å; D167-T173 PolarHBondContact OD2-OG1 3.39Å; D167-T285 VanDerWaalsContact OD1-CA 3.27Å; D167-T285 WeakPolarHBondContact OD1-CA 3.29Å; D167-T285 WeakPolarHBondContact OD1-CB 3.44Å; D167-T285 PolarHBondContact OD1-OG1 3.39Å
168I97.4Very high97.4Very high21 Ų2125.6 Ų25.611%0.10813%0.133CC..THydrogen-bonded Turntrans-64.8-38.2-160.1-162.764.6000114.5I229 A230 G284 A287 D288I168-I229 HydrophobicContact CD1-CD1 4.32Å; I168-I229 HydrophobicContact CD1-CG1 3.87Å; I168-A230 HydrophobicContact CD1-CB 4.2Å; I168-A230 HydrophobicContact CG1-CB 3.84Å; I168-G284 VanDerWaalsContact CG2-O 3.29Å; I168-G284 WeakPolarHBondContact CG2-O 3.45Å; I168-A287 HydrophobicContact CG2-CB 3.86Å; I168-D288 HydrophobicContact CB-CB 4.37Å; I168-D288 HydrophobicContact CG1-CB 4.34Å; I168-D288 HydrophobicContact CG2-CB 3.84Å; I168-D288 VanDerWaalsContact CG2-OD1 3.32Å; I168-D288 WeakPolarHBondContact CG2-OD1 3.5Å
169G97.5Very high97.5Very high0 Ų023.8 Ų23.80%012%0.124CC..THydrogen-bonded Turntrans-97.216.117200000113.3D167 S171 N226 G284D167-G169 PolarHBondContact O-N 2.9Å; G169-S171 PolarHBondContact O-N 3.27Å; G169-N226 WeakPolarHBondContact CA-OD1 3.32Å; G169-N226 PolarHBondContact O-OD1 2.82Å; G169-G284 WeakPolarHBondContact CA-O 3.35Å; G169-G284 PolarHBondContact N-O 2.81Å
170A98.3Very high97.6Very high6 Ų626.1 Ų26.15%0.0513%0.133CC..  trans56.14116800000116.1D167 M172 T173 I174 H175D167-A170 WeakPolarHBondContact O-CA 3.36Å; D167-A170 PolarHBondContact O-N 3.12Å; D167-A170 WeakPolarHBondContact OD2-CA 3.41Å; A170-M172 PolarHBondContact O-N 2.81Å; A170-T173 WeakPolarHBondContact CB-OG1 3.42Å; A170-I174 HydrophobicContact CB-CB 3.68Å; A170-I174 HydrophobicContact CB-CD1 3.33Å; A170-I174 HydrophobicContact CB-CG1 3.46Å; A170-I174 VanDerWaalsContact CB-CG1 3.46Å; A170-I174 PolarHBondContact O-N 3.23Å; A170-I174 VanDerWaalsContact O-N 3.16Å; A170-H175 PolarHBondContact O-CD2 2.77Å; A170-H175 PolarHBondContact O-N 3.35Å
171S98.9Very high97.8Very high0 Ų023.9 Ų23.90%012%0.117CC..Iπ-helixtrans-61.3-32.2173.8-47.20000111.2D167 G169 A176 V281 G284 T285 G338D167-S171 PolarHBondContact OD1-N 2.53Å; G169-S171 PolarHBondContact O-N 3.27Å; S171-A176 WeakPolarHBondContact O-CB 3.29Å; S171-A176 PolarHBondContact O-N 3.19Å; S171-V281 WeakPolarHBondContact CB-O 3.32Å; S171-V281 PolarHBondContact OG-O 3.12Å; S171-G284 VanDerWaalsContact OG-CA 3.22Å; S171-G284 WeakPolarHBondContact OG-CA 3.26Å; S171-G284 PolarHBondContact OG-N 3.23Å; S171-T285 WeakPolarHBondContact CB-OG1 3.2Å; S171-T285 PolarHBondContact OG-N 3.49Å; S171-T285 PolarHBondContact OG-OG1 3.32Å; S171-G338 WeakPolarHBondContact O-CA 3.44Å
172M98.8Very high98Very high0 Ų019.6 Ų19.60%010%0.097CC..Iπ-helixtrans-91.3-54.4179.8-47-175.2-74.400111.3D167 A170 F177 T285 A364 L365 S368D167-M172 HydrophobicContact CB-CE 3.58Å; D167-M172 PolarHBondContact OD1-N 3.48Å; D167-M172 VanDerWaalsContact OD2-CA 3.31Å; D167-M172 WeakPolarHBondContact OD2-CA 3.24Å; D167-M172 WeakPolarHBondContact OD2-CB 3.29Å; D167-M172 PolarHBondContact OD2-N 2.89Å; A170-M172 PolarHBondContact O-N 2.81Å; M172-F177 WeakPolarHBondContact O-CB 3.28Å; M172-F177 PolarHBondContact O-N 3.37Å; M172-T285 HydrophobicContact CE-CG2 3.99Å; M172-A364 HydrophobicContact CE-CB 3.82Å; M172-A364 HydrophobicContact SD-CB 4.26Å; M172-L365 HydrophobicContact CB-CD1 4.44Å; M172-L365 HydrophobicContact CG-CB 4.46Å; M172-L365 HydrophobicContact CG-CD1 4.01Å; M172-L365 HydrophobicContact SD-CB 3.65Å; M172-L365 HydrophobicContact SD-CD1 4.3Å; M172-S368 WeakPolarHBondContact O-CB 3.27Å
173T98.5Very high98.2Very high11 Ų1115.3 Ų15.37%0.0678%0.075CC..Iπ-helixtrans-75.8-28.5-169.554.90000114.5F152 V159 D167 A170 F177F152-T173 VanDerWaalsContact CD2-O 3.31Å; F152-T173 WeakPolarHBondContact CD2-O 3.36Å; F152-T173 VanDerWaalsContact CE2-O 3.26Å; F152-T173 WeakPolarHBondContact CE2-O 3.3Å; V159-T173 HydrophobicContact CB-CG2 3.82Å; V159-T173 HydrophobicContact CG1-CG2 3.76Å; V159-T173 HydrophobicContact CG2-CG2 3.83Å; D167-T173 PolarHBondContact OD2-N 3.28Å; D167-T173 PolarHBondContact OD2-OG1 3.39Å; A170-T173 WeakPolarHBondContact CB-OG1 3.42Å; T173-F177 WeakPolarHBondContact O-CB 3.31Å
174I98.8Very high98.3Very high2 Ų213.7 Ų13.71%0.017%0.07CC..Iπ-helixtrans-104.6-58.9175.8-67.1172.3000110.2F120 A123 I127 F152 A170 G178 F225F120-I174 HydrophobicContact CB-CD1 3.47Å; F120-I174 VanDerWaalsContact CB-CD1 3.47Å; F120-I174 HydrophobicContact CB-CG1 4.42Å; F120-I174 HydrophobicContact CD1-CD1 3.88Å; F120-I174 HydrophobicContact CD2-CD1 4.34Å; F120-I174 HydrophobicContact CG-CD1 3.65Å; A123-I174 HydrophobicContact CB-CG2 4.28Å; I127-I174 HydrophobicContact CD1-CG2 3.73Å; F152-I174 HydrophobicContact CE2-CG1 3.83Å; F152-I174 HydrophobicContact CZ-CG1 4.27Å; A170-I174 HydrophobicContact CB-CB 3.68Å; A170-I174 HydrophobicContact CB-CD1 3.33Å; A170-I174 HydrophobicContact CB-CG1 3.46Å; A170-I174 VanDerWaalsContact CB-CG1 3.46Å; A170-I174 PolarHBondContact O-N 3.23Å; A170-I174 VanDerWaalsContact O-N 3.16Å; I174-G178 WeakPolarHBondContact O-CA 3.09Å; I174-G178 PolarHBondContact O-N 3.12Å; I174-F225 HydrophobicContact CD1-CE1 4.25Å; I174-F225 HydrophobicContact CD1-CZ 3.77Å
175H98.9Very high98.4Very high1 Ų17.9 Ų7.91%0.0055%0.045CC..Iπ-helixtrans-76.1-54.4-166-65.3-59.7000113.4I127 A170 A179 W222 F225 V281 H334I127-H175 VanDerWaalsContact CD1-ND1 3.33Å; I127-H175 WeakPolarHBondContact CD1-ND1 3.32Å; A170-H175 PolarHBondContact O-CD2 2.77Å; A170-H175 PolarHBondContact O-N 3.35Å; H175-A179 WeakPolarHBondContact O-CB 3.43Å; H175-A179 PolarHBondContact O-N 2.96Å; H175-W222 AromaticContact CE1-CZ2 3.78Å; H175-W222 AromaticContact NE2-CZ2 3.89Å; H175-F225 AromaticContact NE2-CE1 3.95Å; H175-V281 HydrophobicContact CB-CG1 3.58Å; H175-H334 HydrophobicContact CB-CB 4.23Å; H175-H334 AromaticContact CE1-ND1 3.85Å; H175-H334 AromaticContact ND1-CE1 3.86Å; H175-H334 AromaticContact ND1-ND1 3.11Å; H175-H334 PolarHBondContact ND1-ND1 3.29Å; H175-H334 VanDerWaalsContact ND1-ND1 3.11Å
176A98.9Very high98.5Very high0 Ų07.5 Ų7.50%04%0.041CC..Iπ-helixtrans-63.7-46.3175.600000110.6S171 Y180S171-A176 WeakPolarHBondContact O-CB 3.29Å; S171-A176 PolarHBondContact O-N 3.19Å; A176-Y180 HydrophobicContact CB-CD2 4.48Å; A176-Y180 WeakPolarHBondContact O-CB 3.16Å; A176-Y180 WeakPolarHBondContact O-CD2 3.37Å; A176-Y180 PolarHBondContact O-N 2.98Å
177F98.9Very high98.6Very high0 Ų07.8 Ų7.80%05%0.047CC..Hα-helixtrans-56.4-59.7177.9178-82.4000112T124 E148 F151 F152 N155 M172 T173 A179 Y180 F181 S368 T371 A372T124-F177 HydrophobicContact CG2-CD1 3.4Å; T124-F177 HydrophobicContact CG2-CE1 3.76Å; E148-F177 HydrophobicContact CG-CE1 4.19Å; F151-F177 HydrophobicContact CB-CE2 4.34Å; F151-F177 HydrophobicContact CB-CZ 3.77Å; F152-F177 HydrophobicContact CB-CD1 4.37Å; F152-F177 HydrophobicContact CB-CE1 3.72Å; F152-F177 HydrophobicContact CB-CZ 4Å; F152-F177 HydrophobicContact CD2-CD1 4.27Å; F152-F177 HydrophobicContact CD2-CE1 4.45Å; F152-F177 VanDerWaalsContact N-CZ 3.32Å; N155-F177 HydrophobicContact CB-CD2 4.03Å; N155-F177 HydrophobicContact CB-CE2 3.96Å; M172-F177 WeakPolarHBondContact O-CB 3.28Å; M172-F177 PolarHBondContact O-N 3.37Å; T173-F177 WeakPolarHBondContact O-CB 3.31Å; F177-A179 VanDerWaalsContact C-N 3.32Å; F177-A179 PolarHBondContact O-N 3.18Å; F177-Y180 PolarHBondContact O-N 3.13Å; F177-F181 HydrophobicContact CE1-CB 4.48Å; F177-F181 HydrophobicContact CE1-CD2 4.35Å; F177-F181 HydrophobicContact CZ-CD2 4.22Å; F177-F181 WeakPolarHBondContact O-CB 3.16Å; F177-F181 PolarHBondContact O-N 3.25Å; F177-S368 WeakPolarHBondContact CD2-O 3.31Å; F177-T371 HydrophobicContact CE2-CG2 4.09Å; F177-A372 HydrophobicContact CB-CB 4.39Å; F177-A372 HydrophobicContact CD2-CB 3.7Å; F177-A372 HydrophobicContact CE2-CB 4.03Å; F177-A372 HydrophobicContact CG-CB 4Å; F177-A372 WeakPolarHBondContact O-CB 3.38Å
178G98.9Very high98.6Very high0 Ų08.6 Ų8.60%05%0.052CC..Hα-helixtrans-61.7-40.9-175.900000111.6S128 I174 F181 G182S128-G178 PolarHBondContact OG-O 3.48Å; I174-G178 WeakPolarHBondContact O-CA 3.09Å; I174-G178 PolarHBondContact O-N 3.12Å; G178-F181 PolarHBondContact O-N 3.08Å; G178-G182 PolarHBondContact O-N 3.11Å
179A98.9Very high98.7Very high0 Ų09 Ų90%05%0.054CC..Hα-helixtrans-64.5-47.2178.700000112.3I127 H175 F177 F181 G182 L183 V330 H334I127-A179 HydrophobicContact CG2-CB 3.98Å; H175-A179 WeakPolarHBondContact O-CB 3.43Å; H175-A179 PolarHBondContact O-N 2.96Å; F177-A179 VanDerWaalsContact C-N 3.32Å; F177-A179 PolarHBondContact O-N 3.18Å; A179-F181 VanDerWaalsContact C-N 3.33Å; A179-F181 PolarHBondContact O-N 3.27Å; A179-G182 PolarHBondContact O-N 3.31Å; A179-L183 WeakPolarHBondContact O-CB 3.18Å; A179-L183 WeakPolarHBondContact O-CD1 3.41Å; A179-L183 WeakPolarHBondContact O-CG 3.12Å; A179-L183 PolarHBondContact O-N 3.36Å; A179-V330 HydrophobicContact CB-CG2 4.38Å; A179-H334 HydrophobicContact CB-CB 3.73Å
180Y98.9Very high98.7Very high54 Ų5411 Ų1121%0.2126%0.062CC..Hα-helixtrans-69.1-31.8178.6-78.7-64.3000112.8A176 F177 L183 A184 S335 V339 I369A176-Y180 HydrophobicContact CB-CD2 4.48Å; A176-Y180 WeakPolarHBondContact O-CB 3.16Å; A176-Y180 WeakPolarHBondContact O-CD2 3.37Å; A176-Y180 PolarHBondContact O-N 2.98Å; F177-Y180 PolarHBondContact O-N 3.13Å; Y180-L183 HydrophobicContact CD1-CD1 4.31Å; Y180-A184 WeakPolarHBondContact O-CB 3.5Å; Y180-A184 PolarHBondContact O-N 2.77Å; Y180-S335 VanDerWaalsContact CE1-OG 3.31Å; Y180-S335 WeakPolarHBondContact CE1-OG 3.48Å; Y180-S335 WeakPolarHBondContact CE2-OG 3.21Å; Y180-S335 PolarHBondContact OH-OG 3.35Å; Y180-V339 HydrophobicContact CE2-CG2 4Å; Y180-I369 HydrophobicContact CD2-CB 4.25Å; Y180-I369 HydrophobicContact CD2-CD1 4.38Å; Y180-I369 HydrophobicContact CD2-CG1 3.76Å; Y180-I369 HydrophobicContact CD2-CG2 3.86Å; Y180-I369 HydrophobicContact CE2-CB 4.49Å; Y180-I369 HydrophobicContact CE2-CD1 3.85Å; Y180-I369 HydrophobicContact CE2-CG1 3.76Å; Y180-I369 HydrophobicContact CE2-CG2 4.02Å; Y180-I369 HydrophobicContact CG-CG2 4.14Å
181F98.9Very high98.5Very high0 Ų012.7 Ų12.70%07%0.067CC..Hα-helixtrans-63.1-54.1172.9-174.2-77.7000110.3S128 M144 E148 F151 F177 G178 A179 L183 A184 V185 A372 G376 T379S128-F181 WeakPolarHBondContact OG-CD1 3.44Å; M144-F181 HydrophobicContact CG-CE1 4.03Å; E148-F181 HydrophobicContact CB-CD1 4.3Å; E148-F181 HydrophobicContact CB-CE1 3.66Å; E148-F181 HydrophobicContact CB-CE2 4.05Å; E148-F181 HydrophobicContact CB-CZ 3.51Å; E148-F181 VanDerWaalsContact CD-CD1 3.43Å; E148-F181 HydrophobicContact CG-CD1 3.8Å; E148-F181 HydrophobicContact CG-CD2 4.09Å; E148-F181 HydrophobicContact CG-CE1 3.68Å; E148-F181 HydrophobicContact CG-CE2 3.97Å; E148-F181 HydrophobicContact CG-CG 4Å; E148-F181 HydrophobicContact CG-CZ 3.76Å; F151-F181 HydrophobicContact CB-CE2 4.47Å; F151-F181 HydrophobicContact CD2-CE2 4.1Å; F177-F181 HydrophobicContact CE1-CB 4.48Å; F177-F181 HydrophobicContact CE1-CD2 4.35Å; F177-F181 HydrophobicContact CZ-CD2 4.22Å; F177-F181 WeakPolarHBondContact O-CB 3.16Å; F177-F181 PolarHBondContact O-N 3.25Å; G178-F181 PolarHBondContact O-N 3.08Å; A179-F181 VanDerWaalsContact C-N 3.33Å; A179-F181 PolarHBondContact O-N 3.27Å; F181-L183 VanDerWaalsContact C-N 3.33Å; F181-L183 PolarHBondContact O-N 3.4Å; F181-A184 WeakPolarHBondContact O-CB 3.18Å; F181-A184 PolarHBondContact O-N 3.26Å; F181-A184 VanDerWaalsContact O-N 3.16Å; F181-V185 HydrophobicContact CD1-CG2 3.95Å; F181-V185 HydrophobicContact CE1-CG2 3.74Å; F181-V185 WeakPolarHBondContact O-CG2 3.49Å; F181-V185 PolarHBondContact O-N 2.93Å; F181-A372 WeakPolarHBondContact CA-O 3.24Å; F181-A372 HydrophobicContact CB-CB 4.1Å; F181-A372 WeakPolarHBondContact CD2-O 2.96Å; F181-G376 VanDerWaalsContact CD2-N 3.32Å; F181-G376 VanDerWaalsContact CE2-N 3.32Å; F181-T379 HydrophobicContact CE1-CG2 4.12Å; F181-T379 HydrophobicContact CZ-CG2 3.94Å; F181-T379 VanDerWaalsContact CZ-OG1 3.29Å; F181-T379 WeakPolarHBondContact CZ-OG1 3.45Å
182G98.9Very high98.1Very high0 Ų017.2 Ų17.20%010%0.098CC..Hα-helixtrans-58.7-40.3177.300000113.4S128 A131 G178 A179 V185 A186S128-G182 WeakPolarHBondContact OG-CA 3.23Å; S128-G182 PolarHBondContact OG-N 3.13Å; S128-G182 VanDerWaalsContact OG-N 3.12Å; A131-G182 VanDerWaalsContact CB-C 3.47Å; A131-G182 WeakPolarHBondContact CB-O 3.45Å; G178-G182 PolarHBondContact O-N 3.11Å; A179-G182 PolarHBondContact O-N 3.31Å; G182-V185 PolarHBondContact O-N 3.45Å; G182-A186 VanDerWaalsContact O-CB 3.29Å; G182-A186 WeakPolarHBondContact O-CB 3.32Å; G182-A186 PolarHBondContact O-N 3.16Å
183L98.9Very high97.8Very high6 Ų619.6 Ų19.63%0.03112%0.123CC..Hα-helixtrans-65.6-40175.8-70.8167.5000112.4A179 Y180 F181 A186 G187 I324 D326 H331A179-L183 WeakPolarHBondContact O-CB 3.18Å; A179-L183 WeakPolarHBondContact O-CD1 3.41Å; A179-L183 WeakPolarHBondContact O-CG 3.12Å; A179-L183 PolarHBondContact O-N 3.36Å; Y180-L183 HydrophobicContact CD1-CD1 4.31Å; F181-L183 VanDerWaalsContact C-N 3.33Å; F181-L183 PolarHBondContact O-N 3.4Å; L183-A186 PolarHBondContact O-N 2.95Å; L183-G187 PolarHBondContact O-N 3.4Å; L183-I324 HydrophobicContact CB-CG2 4.27Å; L183-I324 HydrophobicContact CD2-CG2 3.67Å; L183-D326 HydrophobicContact CD2-CB 3.79Å; L183-H331 HydrophobicContact CD1-CB 3.79Å; L183-H331 HydrophobicContact CD2-CB 4.21Å
184A98.9Very high97.6Very high13 Ų1319.2 Ų19.211%0.10712%0.121CC..Hα-helixtrans-64.1-43.2174.900000111.3Y180 F181 G187 I188 L377Y180-A184 WeakPolarHBondContact O-CB 3.5Å; Y180-A184 PolarHBondContact O-N 2.77Å; F181-A184 WeakPolarHBondContact O-CB 3.18Å; F181-A184 PolarHBondContact O-N 3.26Å; F181-A184 VanDerWaalsContact O-N 3.16Å; A184-G187 PolarHBondContact O-N 2.93Å; A184-I188 PolarHBondContact O-N 2.94Å; A184-I188 VanDerWaalsContact O-N 3.14Å; A184-L377 HydrophobicContact CB-CD2 4.35Å; A184-L377 HydrophobicContact CB-CG 4.2Å
185V98.9Very high97.1Very high0 Ų025.7 Ų25.70%015%0.145CC..Hα-helixtrans-59.6-49.8172.4176.50000110.5V132 M144 F181 G182 G187 I188 L189 G376 T379 L383V132-V185 HydrophobicContact CG1-CB 4.33Å; V132-V185 HydrophobicContact CG1-CG1 3.82Å; M144-V185 HydrophobicContact SD-CG1 4.38Å; F181-V185 HydrophobicContact CD1-CG2 3.95Å; F181-V185 HydrophobicContact CE1-CG2 3.74Å; F181-V185 WeakPolarHBondContact O-CG2 3.49Å; F181-V185 PolarHBondContact O-N 2.93Å; G182-V185 PolarHBondContact O-N 3.45Å; V185-G187 VanDerWaalsContact C-N 3.28Å; V185-G187 PolarHBondContact O-N 3.37Å; V185-I188 PolarHBondContact O-N 3.38Å; V185-I188 VanDerWaalsContact O-N 3.15Å; V185-L189 HydrophobicContact CG1-CD1 3.73Å; V185-L189 HydrophobicContact CG1-CG 4.21Å; V185-L189 WeakPolarHBondContact O-CB 3.44Å; V185-L189 WeakPolarHBondContact O-CG 3.42Å; V185-L189 PolarHBondContact O-N 3.44Å; V185-G376 VanDerWaalsContact CG2-O 3.26Å; V185-G376 WeakPolarHBondContact CG2-O 3.47Å; V185-T379 HydrophobicContact CG2-CG2 4.24Å; V185-L383 HydrophobicContact CG1-CD1 3.95Å
186A98.6Very high96.6Very high5 Ų535.6 Ų35.64%0.04119%0.188CC..Hα-helixtrans-60.9-34.6179.900000112.8A131 V132 G182 L183 L189 Y190 I324A131-A186 HydrophobicContact CB-CB 4.28Å; V132-A186 HydrophobicContact CG1-CB 4.09Å; G182-A186 VanDerWaalsContact O-CB 3.29Å; G182-A186 WeakPolarHBondContact O-CB 3.32Å; G182-A186 PolarHBondContact O-N 3.16Å; L183-A186 PolarHBondContact O-N 2.95Å; A186-L189 CarbonylContact O-C 3.38Å; A186-Y190 PolarHBondContact O-N 2.91Å; A186-I324 HydrophobicContact CB-CG2 4.36Å
187G98.3Very high96.2Very high26 Ų2637.7 Ų37.727%0.26821%0.209SC..Hα-helixtrans-65.6-43.3173.600000113L183 A184 V185 Y190L183-G187 PolarHBondContact O-N 3.4Å; A184-G187 PolarHBondContact O-N 2.93Å; V185-G187 VanDerWaalsContact C-N 3.28Å; V185-G187 PolarHBondContact O-N 3.37Å; G187-Y190 VanDerWaalsContact O-CB 3.31Å; G187-Y190 WeakPolarHBondContact O-CB 3.36Å; G187-Y190 PolarHBondContact O-N 3.47Å
188I98.6Very high96Very high36 Ų3639 Ų3919%0.18522%0.216CC..Hα-helixtrans-67.4-38.7176.1-65.7-64.6000111.7A184 V185 Y190 L377 G380 L381 K384A184-I188 PolarHBondContact O-N 2.94Å; A184-I188 VanDerWaalsContact O-N 3.14Å; V185-I188 PolarHBondContact O-N 3.38Å; V185-I188 VanDerWaalsContact O-N 3.15Å; I188-Y190 PolarHBondContact O-N 3.13Å; I188-L377 HydrophobicContact CD1-CD2 3.83Å; I188-L377 HydrophobicContact CG1-CD2 3.83Å; I188-G380 WeakPolarHBondContact CG2-O 3.43Å; I188-L381 HydrophobicContact CD1-CD2 4.3Å; I188-L381 HydrophobicContact CG2-CD2 4.14Å; I188-L381 HydrophobicContact CG2-CG 4.41Å; I188-K384 HydrophobicContact CG2-CB 4.29Å; I188-K384 HydrophobicContact CG2-CD 3.9Å; I188-K384 PolarHBondContact O-NZ 3.24Å; I188-K384 VanDerWaalsContact O-NZ 3.08Å
189L98Very high95.8Very high29 Ų2945.7 Ų45.715%0.15225%0.247CC..THydrogen-bonded Turntrans-83.512.5178.2-61-174.4000113.5T136 V185 A186 R191 L383 K384T136-L189 HydrophobicContact CG2-CD1 3.9Å; V185-L189 HydrophobicContact CG1-CD1 3.73Å; V185-L189 HydrophobicContact CG1-CG 4.21Å; V185-L189 WeakPolarHBondContact O-CB 3.44Å; V185-L189 WeakPolarHBondContact O-CG 3.42Å; V185-L189 PolarHBondContact O-N 3.44Å; A186-L189 CarbonylContact O-C 3.38Å; L189-R191 PolarHBondContact O-N 3.36Å; L189-L383 HydrophobicContact CD1-CB 4.19Å; L189-L383 HydrophobicContact CD2-CB 4.19Å; L189-K384 HydrophobicContact CD2-CB 3.88Å; L189-K384 HydrophobicContact CD2-CG 4.43Å
190Y97.2Very high95.7Very high43 Ų4345.9 Ų45.917%0.16925%0.248CC..  trans-54.2131.4-178.2-179.9-102.2000112.6A186 G187 I188 R195 R323 H325A186-Y190 PolarHBondContact O-N 2.91Å; G187-Y190 VanDerWaalsContact O-CB 3.31Å; G187-Y190 WeakPolarHBondContact O-CB 3.36Å; G187-Y190 PolarHBondContact O-N 3.47Å; I188-Y190 PolarHBondContact O-N 3.13Å; Y190-R195 WeakPolarHBondContact OH-CB 3.19Å; Y190-R195 WeakPolarHBondContact OH-CG 3.48Å; Y190-R323 WeakPolarHBondContact CB-O 3.33Å; Y190-R323 HydrophobicContact CD1-CB 3.84Å; Y190-R323 HydrophobicContact CD1-CG 4.22Å; Y190-R323 HydrophobicContact CD2-CB 3.77Å; Y190-R323 WeakPolarHBondContact CD2-O 3.29Å; Y190-R323 HydrophobicContact CE1-CB 3.9Å; Y190-R323 HydrophobicContact CE1-CG 3.86Å; Y190-R323 HydrophobicContact CE2-CB 3.82Å; Y190-R323 HydrophobicContact CE2-CG 4.34Å; Y190-R323 HydrophobicContact CG-CB 3.75Å; Y190-R323 VanDerWaalsContact CG-O 3.3Å; Y190-H325 HydrophobicContact CD2-CB 4.48Å
191R94.4Very high95.6Very high40 Ų4045.5 Ų45.515%0.15125%0.248CC..  trans-111.1110.4-179-69.2169.3-179.4-94.911.9109.9K135 L189 G193 L194 P391 D393K135-R191 PolarHBondContact O-NH2 3.45Å; L189-R191 PolarHBondContact O-N 3.36Å; R191-G193 PolarHBondContact O-N 3Å; R191-L194 HydrophobicContact CB-CB 4.3Å; R191-L194 HydrophobicContact CB-CD1 3.88Å; R191-L194 HydrophobicContact CB-CG 3.8Å; R191-L194 HydrophobicContact CG-CD1 4.38Å; R191-L194 PolarHBondContact O-N 3.45Å; R191-L194 VanDerWaalsContact O-N 3.11Å; R191-P391 VanDerWaalsContact CZ-O 3.31Å; R191-P391 PolarHBondContact NH1-O 3.41Å; R191-P391 PolarHBondContact NH2-O 2.67Å; R191-D393 VanDerWaalsContact CD-OD1 3.32Å; R191-D393 WeakPolarHBondContact CD-OD1 3.4Å; R191-D393 WeakPolarHBondContact CG-OD1 3.5Å; R191-D393 IonicContact CZ-OD1 3.37Å; R191-D393 IonicContact NE-OD1 3.21Å; R191-D393 IonicContact NH1-OD1 3.17Å; R191-D393 PolarHBondContact NH1-OD1 2.89Å
192S91.6Very high95.4Very high95 Ų9550.3 Ų50.366%0.66427%0.27SS*.G310 helixtrans-64.3-27.7-178.655.50000113L194 R195S192-L194 PolarHBondContact O-N 3.32Å; S192-R195 VanDerWaalsContact O-CB 3.32Å; S192-R195 WeakPolarHBondContact O-CB 3.38Å; S192-R195 PolarHBondContact O-N 3.09Å
193G92.7Very high95.2Very high51 Ų5152.4 Ų52.453%0.52629%0.285SS..G310 helixtrans-65.3-24.9175.200000113.6R191 D393R191-G193 PolarHBondContact O-N 3Å; G193-D393 WeakPolarHBondContact CA-OD2 3.42Å; G193-D393 PolarHBondContact N-OD2 2.96Å
194L92.9Very high95.1Very high2 Ų253.1 Ų53.11%0.0129%0.292CS..G310 helixtrans-91.1-0.8179.7-54.2-174.5000113.4K135 R191 S192 K196 G197 H198 D393 C396 Y397K135-L194 HydrophobicContact CD-CD1 4.03Å; K135-L194 HydrophobicContact CG-CD1 4.05Å; R191-L194 HydrophobicContact CB-CB 4.3Å; R191-L194 HydrophobicContact CB-CD1 3.88Å; R191-L194 HydrophobicContact CB-CG 3.8Å; R191-L194 HydrophobicContact CG-CD1 4.38Å; R191-L194 PolarHBondContact O-N 3.45Å; R191-L194 VanDerWaalsContact O-N 3.11Å; S192-L194 PolarHBondContact O-N 3.32Å; L194-K196 PolarHBondContact O-N 3.38Å; L194-G197 PolarHBondContact O-N 3.3Å; L194-H198 HydrophobicContact CD2-CB 4.15Å; L194-D393 HydrophobicContact CD2-CB 4.16Å; L194-D393 WeakPolarHBondContact CD2-O 3.32Å; L194-C396 HydrophobicContact CD1-CB 4.37Å; L194-Y397 HydrophobicContact CD1-CE2 4.19Å
195R89.3Confident95Very high138 Ų13861.3 Ų61.352%0.52132%0.321SS..THydrogen-bonded Turntrans-57-30-174.8-177176.7-178.2-157.72.1113.9Y190 S192 G197 T320Y190-R195 WeakPolarHBondContact OH-CB 3.19Å; Y190-R195 WeakPolarHBondContact OH-CG 3.48Å; S192-R195 VanDerWaalsContact O-CB 3.32Å; S192-R195 WeakPolarHBondContact O-CB 3.38Å; S192-R195 PolarHBondContact O-N 3.09Å; R195-G197 VanDerWaalsContact C-N 3.35Å; R195-T320 PolarHBondContact NH2-O 3.35Å
196K87.3Confident94.9Very high210 Ų21067 Ų6791%0.91334%0.343SS*.THydrogen-bonded Turntrans-94.710.7179.9-65.7-174.5178.5-179.50112.9L194L194-K196 PolarHBondContact O-N 3.38Å
197G90.5Very high94.9Very high43 Ų4367 Ų6744%0.44334%0.343SS..  trans87.2170.2-170.700000112.5L194 R195L194-G197 PolarHBondContact O-N 3.3Å; R195-G197 VanDerWaalsContact C-N 3.35Å
198H95.7Very high94.9Very high29 Ų2966.6 Ų66.613%0.13434%0.335CS..  trans-128140.6177.7-169.7-88.7000110L194 N200 E201 D393 Q394 C396 Y397L194-H198 HydrophobicContact CD2-CB 4.15Å; H198-N200 PolarHBondContact ND1-N 2.99Å; H198-N200 VanDerWaalsContact ND1-N 3.14Å; H198-N200 PolarHBondContact O-N 2.9Å; H198-N200 VanDerWaalsContact O-N 3.11Å; H198-E201 HydrophobicContact CB-CB 3.98Å; H198-E201 WeakPolarHBondContact O-CB 3.26Å; H198-E201 PolarHBondContact O-N 3.32Å; H198-D393 PolarHBondContact CD2-O 3.28Å; H198-D393 VanDerWaalsContact CD2-O 3.29Å; H198-D393 PolarHBondContact NE2-O 3.14Å; H198-Q394 PolarHBondContact NE2-O 2.95Å; H198-C396 PolarHBondContact CE1-O 3.44Å; H198-Y397 HydrophobicContact CB-CD2 3.92Å; H198-Y397 HydrophobicContact CB-CE2 3.79Å; H198-Y397 AromaticContact CG-CD2 3.76Å; H198-Y397 AromaticContact ND1-CD2 3.62Å
199E94.9Very high94.8Very high139 Ų13969.2 Ų69.265%0.6535%0.349SS*.THydrogen-bonded Turntrans-62.4-21.7-176.558.7165.3-149.200114.7K73K73-E199 VanDerWaalsContact CE-O 3.26Å; K73-E199 WeakPolarHBondContact CE-O 3.27Å; K73-E199 PolarHBondContact NZ-O 2.96Å
200N96.1Very high94.8Very high4 Ų472.8 Ų72.82%0.02136%0.363CS..THydrogen-bonded Turntrans-98-5176.5-60.8-32.1000112.9K74 H198 E202K74-N200 WeakPolarHBondContact CD-OD1 3.45Å; K74-N200 PolarHBondContact NZ-OD1 2.85Å; H198-N200 PolarHBondContact ND1-N 2.99Å; H198-N200 VanDerWaalsContact ND1-N 3.14Å; H198-N200 PolarHBondContact O-N 2.9Å; H198-N200 VanDerWaalsContact O-N 3.11Å; N200-E202 PolarHBondContact O-N 2.85Å; N200-E202 VanDerWaalsContact O-N 3.09Å
201E96.7Very high94.9Very high47 Ų4770.7 Ų70.722%0.2236%0.355CS..SBendtrans-85.458.7172.5-169.3177.3-14600110L72 H198 H325 Y397L72-E201 HydrophobicContact CD2-CG 4.32Å; H198-E201 HydrophobicContact CB-CB 3.98Å; H198-E201 WeakPolarHBondContact O-CB 3.26Å; H198-E201 PolarHBondContact O-N 3.32Å; E201-H325 VanDerWaalsContact CD-NE2 3.29Å; E201-H325 IonicContact OE1-CD2 3.77Å; E201-H325 IonicContact OE1-CE1 2.58Å; E201-H325 PolarHBondContact OE1-CE1 2.94Å; E201-H325 IonicContact OE1-NE2 3.96Å; E201-H325 PolarHBondContact OE1-NE2 3.18Å; E201-H325 IonicContact OE2-CE1 3.61Å; E201-H325 PolarHBondContact OE2-CE1 3.47Å; E201-H325 IonicContact OE2-NE2 2.81Å; E201-H325 PolarHBondContact OE2-NE2 2.99Å; E201-H325 VanDerWaalsContact OE2-NE2 3.09Å; E201-Y397 HydrophobicContact CB-CD1 4.35Å; E201-Y397 HydrophobicContact CB-CD2 4.03Å; E201-Y397 HydrophobicContact CB-CE1 4.24Å; E201-Y397 HydrophobicContact CB-CE2 3.93Å; E201-Y397 HydrophobicContact CB-CG 4.24Å; E201-Y397 HydrophobicContact CG-CD1 4.37Å; E201-Y397 HydrophobicContact CG-CE1 3.92Å; E201-Y397 HydrophobicContact CG-CE2 4.31Å; E201-Y397 PolarHBondContact OE1-OH 2.99Å; E201-Y397 PolarHBondContact OE2-OH 3.38Å
202E94.5Very high95.1Very high101 Ų10170.6 Ų70.647%0.47236%0.357SS..SBendtrans-148.4166175.764.1174-15800110.4K73 N200K73-E202 HydrophobicContact CD-CG 3.73Å; K73-E202 WeakPolarHBondContact CE-OE1 3.36Å; K73-E202 HydrophobicContact CG-CG 4.32Å; K73-E202 WeakPolarHBondContact CG-O 3.46Å; K73-E202 PolarHBondContact N-O 3.24Å; K73-E202 VanDerWaalsContact NZ-CD 3.34Å; K73-E202 IonicContact NZ-OE1 2.8Å; K73-E202 PolarHBondContact NZ-OE1 3.12Å; N200-E202 PolarHBondContact O-N 2.85Å; N200-E202 VanDerWaalsContact O-N 3.09Å
203S96.3Very high95.4Very high43 Ų4368.9 Ų68.930%0.30134%0.34SS..BIsolated β-bridgetrans-96.7165.1174.667.60000112.7F71 D208F71-S203 WeakPolarHBondContact O-CA 3.17Å; F71-S203 WeakPolarHBondContact O-CB 3.38Å; S203-D208 VanDerWaalsContact CB-CG 3.49Å; S203-D208 VanDerWaalsContact CB-OD1 3.26Å; S203-D208 WeakPolarHBondContact CB-OD1 3.25Å; S203-D208 VanDerWaalsContact CB-OD2 3.32Å; S203-D208 WeakPolarHBondContact CB-OD2 3.23Å; S203-D208 PolarHBondContact OG-OD1 3.47Å; S203-D208 PolarHBondContact OG-OD2 3.12Å
204A96.1Very high95.7Very high22 Ų2266.5 Ų66.518%0.18232%0.315CS..  trans-121.8162.3163.700000108.3K73 Y206 S207 D208K73-A204 HydrophobicContact CB-CB 3.94Å; A204-Y206 VanDerWaalsContact C-N 3.29Å; A204-Y206 HydrophobicContact CB-CD1 4.15Å; A204-Y206 HydrophobicContact CB-CE1 3.65Å; A204-Y206 HydrophobicContact CB-CE2 4.36Å; A204-Y206 PolarHBondContact O-N 2.9Å; A204-S207 PolarHBondContact N-OG 3.27Å; A204-S207 PolarHBondContact O-N 3.39Å; A204-S207 PolarHBondContact O-OG 2.87Å; A204-D208 PolarHBondContact O-N 2.9Å
205Y97.1Very high96Very high185 Ų18566.5 Ų66.573%0.72532%0.315SS*.Hα-helixtrans-52.1-45.6-176.5-177.3-98.6000113.4L209Y205-L209 HydrophobicContact CD1-CD1 3.96Å; Y205-L209 HydrophobicContact CE1-CD1 3.48Å; Y205-L209 VanDerWaalsContact CE1-CD1 3.48Å; Y205-L209 HydrophobicContact CE1-CG 4.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.21Å; Y205-L209 PolarHBondContact O-N 2.97Å
206Y96.3Very high96.5Very high118 Ų11864.3 Ų64.346%0.46331%0.313SS..Hα-helixtrans-73.3-32.2179.956.1-93.1000112.9A204 D208 L209 F210A204-Y206 VanDerWaalsContact C-N 3.29Å; A204-Y206 HydrophobicContact CB-CD1 4.15Å; A204-Y206 HydrophobicContact CB-CE1 3.65Å; A204-Y206 HydrophobicContact CB-CE2 4.36Å; A204-Y206 PolarHBondContact O-N 2.9Å; Y206-D208 VanDerWaalsContact C-N 3.32Å; Y206-L209 PolarHBondContact O-N 3.48Å; Y206-F210 WeakPolarHBondContact O-CD2 3.11Å; Y206-F210 PolarHBondContact O-N 2.99Å
207S97.6Very high97Very high5 Ų557.6 Ų57.64%0.03528%0.284CS..Hα-helixtrans-70.7-33.8177.270.20000110.9T70 F71 A204 F210 A211T70-S207 WeakPolarHBondContact O-CB 3.33Å; F71-S207 WeakPolarHBondContact O-CB 3.33Å; F71-S207 PolarHBondContact O-OG 2.91Å; A204-S207 PolarHBondContact N-OG 3.27Å; A204-S207 PolarHBondContact O-N 3.39Å; A204-S207 PolarHBondContact O-OG 2.87Å; S207-F210 PolarHBondContact O-N 3.07Å; S207-A211 WeakPolarHBondContact O-CB 3.38Å; S207-A211 PolarHBondContact O-N 3.37Å
208D98.4Very high97.4Very high19 Ų1955.6 Ų55.610%0.10226%0.263CS..Hα-helixtrans-67-36171.5-80.6-32.6000113.1S203 A204 Y206 A211 M212 M269 Q273S203-D208 VanDerWaalsContact CB-CG 3.49Å; S203-D208 VanDerWaalsContact CB-OD1 3.26Å; S203-D208 WeakPolarHBondContact CB-OD1 3.25Å; S203-D208 VanDerWaalsContact CB-OD2 3.32Å; S203-D208 WeakPolarHBondContact CB-OD2 3.23Å; S203-D208 PolarHBondContact OG-OD1 3.47Å; S203-D208 PolarHBondContact OG-OD2 3.12Å; A204-D208 PolarHBondContact O-N 2.9Å; Y206-D208 VanDerWaalsContact C-N 3.32Å; D208-A211 PolarHBondContact O-N 3.42Å; D208-M212 WeakPolarHBondContact O-CG 3.46Å; D208-M212 PolarHBondContact O-N 3.47Å; D208-M269 HydrophobicContact CB-CB 4.48Å; D208-M269 HydrophobicContact CB-CG 4.48Å; D208-Q273 VanDerWaalsContact CA-NE2 3.29Å; D208-Q273 PolarHBondContact O-NE2 3.23Å; D208-Q273 PolarHBondContact OD1-NE2 2.59Å
209L98.1Very high97.6Very high91 Ų9157.1 Ų57.148%0.47627%0.268SS..Hα-helixtrans-65.4-41.3172.4-71.4176.8000111.8Y205 Y206 M212 I213Y205-L209 HydrophobicContact CD1-CD1 3.96Å; Y205-L209 HydrophobicContact CE1-CD1 3.48Å; Y205-L209 VanDerWaalsContact CE1-CD1 3.48Å; Y205-L209 HydrophobicContact CE1-CG 4.26Å; Y205-L209 WeakPolarHBondContact O-CG 3.21Å; Y205-L209 PolarHBondContact O-N 2.97Å; Y206-L209 PolarHBondContact O-N 3.48Å; L209-M212 PolarHBondContact O-N 3.41Å; L209-I213 PolarHBondContact O-N 2.98Å
210F97.6Very high97.8Very high103 Ų10355.1 Ų55.145%0.45226%0.26SS..Hα-helixtrans-64.3-41.7173.5-80-63.1000111.9F67 T70 Y206 S207 M212 I213F67-F210 HydrophobicContact CD1-CB 4.3Å; F67-F210 HydrophobicContact CD1-CD1 4.14Å; F67-F210 AromaticContact CE1-CD1 3.87Å; F67-F210 HydrophobicContact CE1-CD1 3.87Å; F67-F210 HydrophobicContact CE1-CE1 4.49Å; T70-F210 WeakPolarHBondContact OG1-CB 3.29Å; Y206-F210 WeakPolarHBondContact O-CD2 3.11Å; Y206-F210 PolarHBondContact O-N 2.99Å; S207-F210 PolarHBondContact O-N 3.07Å; F210-M212 VanDerWaalsContact C-N 3.27Å; F210-M212 PolarHBondContact O-N 3.43Å; F210-I213 HydrophobicContact CD1-CD1 3.89Å; F210-I213 HydrophobicContact CE1-CD1 4.45Å; F210-I213 VanDerWaalsContact O-CB 3.26Å; F210-I213 WeakPolarHBondContact O-CB 3.28Å; F210-I213 PolarHBondContact O-N 2.86Å
211A98.6Very high97.9Very high0 Ų057.2 Ų57.20%027%0.269CS..Hα-helixtrans-60-37175.400000113.1F67 F71 S207 D208 I213 G214 T215 Q273F67-A211 VanDerWaalsContact O-CA 3.29Å; F67-A211 WeakPolarHBondContact O-CA 3.34Å; F71-A211 HydrophobicContact CB-CB 3.8Å; S207-A211 WeakPolarHBondContact O-CB 3.38Å; S207-A211 PolarHBondContact O-N 3.37Å; D208-A211 PolarHBondContact O-N 3.42Å; A211-I213 PolarHBondContact O-N 2.82Å; A211-G214 WeakPolarHBondContact O-CA 3.42Å; A211-G214 PolarHBondContact O-N 2.86Å; A211-T215 PolarHBondContact O-N 2.88Å; A211-T215 PolarHBondContact O-OG1 3.34Å; A211-Q273 HydrophobicContact CB-CG 4.3Å
212M98.7Very high98Very high37 Ų3755.1 Ų55.118%0.18226%0.259CS..Hα-helixtrans-62.7-26.4174.3-77.9-58.7-5300113.8D208 L209 F210 G214 T215 L216 M269 I272 Q273D208-M212 WeakPolarHBondContact O-CG 3.46Å; D208-M212 PolarHBondContact O-N 3.47Å; L209-M212 PolarHBondContact O-N 3.41Å; F210-M212 VanDerWaalsContact C-N 3.27Å; F210-M212 PolarHBondContact O-N 3.43Å; M212-G214 VanDerWaalsContact C-N 3.32Å; M212-T215 HydrophobicContact CE-CG2 4.06Å; M212-T215 PolarHBondContact O-N 3.07Å; M212-T215 HydrophobicContact SD-CG2 4.34Å; M212-L216 HydrophobicContact CE-CD2 4.41Å; M212-L216 HydrophobicContact CE-CG 4.28Å; M212-L216 WeakPolarHBondContact O-CB 3.36Å; M212-L216 VanDerWaalsContact O-CG 3.25Å; M212-L216 WeakPolarHBondContact O-CG 3.29Å; M212-L216 PolarHBondContact O-N 3.44Å; M212-M269 HydrophobicContact CG-CE 3.37Å; M212-M269 HydrophobicContact SD-CE 3.63Å; M212-I272 HydrophobicContact CE-CG2 4.46Å; M212-I272 HydrophobicContact SD-CG2 4.22Å; M212-Q273 HydrophobicContact CG-CG 4.01Å; M212-Q273 HydrophobicContact SD-CB 4.29Å; M212-Q273 HydrophobicContact SD-CG 3.45Å; M212-Q273 WeakPolarHBondContact SD-CG 3.47Å
213I98.8Very high98.2Very high60 Ų6051.1 Ų51.131%0.30824%0.241SC..Hα-helixtrans-59.6-49.3171.4-59.9177.3000109V63 F67 L209 F210 A211 T215 L216 F217V63-I213 HydrophobicContact CG1-CG2 4.21Å; F67-I213 HydrophobicContact CB-CB 4.34Å; F67-I213 HydrophobicContact CD1-CB 4.49Å; F67-I213 HydrophobicContact CD1-CD1 4.49Å; F67-I213 HydrophobicContact CG-CB 4.45Å; F67-I213 HydrophobicContact CG-CG2 4.41Å; L209-I213 PolarHBondContact O-N 2.98Å; F210-I213 HydrophobicContact CD1-CD1 3.89Å; F210-I213 HydrophobicContact CE1-CD1 4.45Å; F210-I213 VanDerWaalsContact O-CB 3.26Å; F210-I213 WeakPolarHBondContact O-CB 3.28Å; F210-I213 PolarHBondContact O-N 2.86Å; A211-I213 PolarHBondContact O-N 2.82Å; I213-T215 PolarHBondContact O-N 3.28Å; I213-L216 PolarHBondContact O-N 3.34Å; I213-F217 HydrophobicContact CG2-CD2 3.77Å; I213-F217 HydrophobicContact CG2-CE2 3.87Å; I213-F217 WeakPolarHBondContact O-CD2 3.47Å; I213-F217 PolarHBondContact O-N 3.31Å
214G98.8Very high98.3Very high0 Ų049.8 Ų49.80%023%0.232CC..Hα-helixtrans-57.6-48.9176.400000112.4G64 A211 M212 L216 F217 L218G64-G214 WeakPolarHBondContact O-CA 3.38Å; A211-G214 WeakPolarHBondContact O-CA 3.42Å; A211-G214 PolarHBondContact O-N 2.86Å; M212-G214 VanDerWaalsContact C-N 3.32Å; G214-L216 PolarHBondContact O-N 2.89Å; G214-F217 PolarHBondContact O-N 3.14Å; G214-L218 WeakPolarHBondContact O-CB 3.43Å; G214-L218 VanDerWaalsContact O-CG 3.27Å; G214-L218 WeakPolarHBondContact O-CG 3.23Å; G214-L218 PolarHBondContact O-N 3.41Å
215T98.9Very high98.4Very high3 Ų348.9 Ų48.92%0.01822%0.224CC..Hα-helixtrans-53.5-49.2175.4-57.30000112.4L68 A211 M212 I213 L218 W219 Q273 L277L68-T215 WeakPolarHBondContact CD1-OG1 3.37Å; A211-T215 PolarHBondContact O-N 2.88Å; A211-T215 PolarHBondContact O-OG1 3.34Å; M212-T215 HydrophobicContact CE-CG2 4.06Å; M212-T215 PolarHBondContact O-N 3.07Å; M212-T215 HydrophobicContact SD-CG2 4.34Å; I213-T215 PolarHBondContact O-N 3.28Å; T215-L218 PolarHBondContact O-N 2.93Å; T215-W219 VanDerWaalsContact O-CB 3.28Å; T215-W219 WeakPolarHBondContact O-CB 3.39Å; T215-W219 PolarHBondContact O-N 2.96Å; T215-Q273 WeakPolarHBondContact CB-O 3.26Å; T215-Q273 WeakPolarHBondContact CG2-O 3.45Å; T215-Q273 WeakPolarHBondContact OG1-CA 3.41Å; T215-Q273 WeakPolarHBondContact OG1-CB 3.41Å; T215-Q273 PolarHBondContact OG1-O 2.89Å; T215-L277 HydrophobicContact CG2-CD1 4.41Å; T215-L277 HydrophobicContact CG2-CD2 4.11Å; T215-L277 HydrophobicContact CG2-CG 4.27Å; T215-L277 WeakPolarHBondContact O-CD2 3.31Å
216L98.9Very high98.5Very high91 Ų9140 Ų4048%0.47619%0.189SC..Hα-helixtrans-67.9-41.8-175.3-69.6172.1000112M212 I213 G214 W219 M220M212-L216 HydrophobicContact CE-CD2 4.41Å; M212-L216 HydrophobicContact CE-CG 4.28Å; M212-L216 WeakPolarHBondContact O-CB 3.36Å; M212-L216 VanDerWaalsContact O-CG 3.25Å; M212-L216 WeakPolarHBondContact O-CG 3.29Å; M212-L216 PolarHBondContact O-N 3.44Å; I213-L216 PolarHBondContact O-N 3.34Å; G214-L216 PolarHBondContact O-N 2.89Å; L216-W219 PolarHBondContact O-N 3.31Å; L216-M220 HydrophobicContact CB-CE 4.4Å; L216-M220 WeakPolarHBondContact O-CB 3.41Å; L216-M220 WeakPolarHBondContact O-CE 3.13Å; L216-M220 VanDerWaalsContact O-CG 3.26Å; L216-M220 WeakPolarHBondContact O-CG 3.36Å; L216-M220 PolarHBondContact O-N 3.45Å
217F98.8Very high98.6Very high69 Ų6934.4 Ų34.430%0.30317%0.167SC..Hα-helixtrans-65.4-40.9176.3-86.1-78.8000112.2V59 V63 I213 G214 M220 F221V59-F217 HydrophobicContact CG1-CB 4.4Å; V59-F217 HydrophobicContact CG1-CD1 3.43Å; V59-F217 VanDerWaalsContact CG1-CD1 3.43Å; V59-F217 HydrophobicContact CG1-CE1 3.93Å; V59-F217 HydrophobicContact CG1-CG 4.11Å; V63-F217 HydrophobicContact CG1-CB 4.39Å; V63-F217 HydrophobicContact CG1-CD2 3.67Å; V63-F217 HydrophobicContact CG1-CE2 4.08Å; V63-F217 HydrophobicContact CG1-CG 3.99Å; I213-F217 HydrophobicContact CG2-CD2 3.77Å; I213-F217 HydrophobicContact CG2-CE2 3.87Å; I213-F217 WeakPolarHBondContact O-CD2 3.47Å; I213-F217 PolarHBondContact O-N 3.31Å; G214-F217 PolarHBondContact O-N 3.14Å; F217-M220 HydrophobicContact CD1-CE 4.42Å; F217-F221 HydrophobicContact CD1-CD2 4.11Å; F217-F221 AromaticContact CD1-CE2 3.62Å; F217-F221 HydrophobicContact CD1-CE2 3.62Å; F217-F221 HydrophobicContact CD1-CZ 4.31Å; F217-F221 HydrophobicContact CE1-CE2 4.04Å; F217-F221 HydrophobicContact CE1-CZ 4.43Å; F217-F221 WeakPolarHBondContact O-CB 3.13Å; F217-F221 PolarHBondContact O-N 3.09Å
218L98.9Very high98.5Very high1 Ų134.3 Ų34.31%0.00517%0.167CC..Hα-helixtrans-59.8-49.9172.1-70.2169.4000111.1M60 F65 L68 G214 T215 M220 F221 W222 L277M60-L218 HydrophobicContact CB-CD2 3.8Å; M60-L218 HydrophobicContact CE-CD2 3.84Å; M60-L218 HydrophobicContact CG-CD2 4.13Å; F65-L218 HydrophobicContact CD2-CD2 4.1Å; F65-L218 HydrophobicContact CE2-CD2 4.13Å; L68-L218 HydrophobicContact CB-CD1 4.3Å; L68-L218 HydrophobicContact CD2-CD1 3.71Å; G214-L218 WeakPolarHBondContact O-CB 3.43Å; G214-L218 VanDerWaalsContact O-CG 3.27Å; G214-L218 WeakPolarHBondContact O-CG 3.23Å; G214-L218 PolarHBondContact O-N 3.41Å; T215-L218 PolarHBondContact O-N 2.93Å; L218-M220 PolarHBondContact O-N 2.84Å; L218-F221 PolarHBondContact O-N 3.34Å; L218-W222 HydrophobicContact CB-CE3 4.04Å; L218-W222 HydrophobicContact CB-CZ3 3.84Å; L218-W222 WeakPolarHBondContact O-CB 3.34Å; L218-W222 PolarHBondContact O-N 3.22Å; L218-L277 HydrophobicContact CB-CD1 4.14Å; L218-L277 HydrophobicContact CB-CD2 3.99Å; L218-L277 HydrophobicContact CD1-CD1 3.77Å
219W98.9Very high98.3Very high62 Ų6236 Ų3624%0.23518%0.175CC..Hα-helixtrans-62.1-45.4-176.8-168.696.3000112.5T215 L216 L247 V251 L277T215-W219 VanDerWaalsContact O-CB 3.28Å; T215-W219 WeakPolarHBondContact O-CB 3.39Å; T215-W219 PolarHBondContact O-N 2.96Å; L216-W219 PolarHBondContact O-N 3.31Å; W219-L247 HydrophobicContact CZ2-CB 4.05Å; W219-L247 WeakPolarHBondContact O-CD1 3.33Å; W219-V251 HydrophobicContact CZ2-CG2 4.4Å; W219-V251 VanDerWaalsContact NE1-CG2 3.26Å; W219-L277 HydrophobicContact CB-CD2 3.68Å; W219-L277 HydrophobicContact CG-CD2 4.33Å
220M98.9Very high98.1Very high97 Ų9732 Ų3248%0.47816%0.155SC..Hα-helixtrans-69.7-35-177-70.4-175.7-59.500113L216 F217 L218 P223L216-M220 HydrophobicContact CB-CE 4.4Å; L216-M220 WeakPolarHBondContact O-CB 3.41Å; L216-M220 WeakPolarHBondContact O-CE 3.13Å; L216-M220 VanDerWaalsContact O-CG 3.26Å; L216-M220 WeakPolarHBondContact O-CG 3.36Å; L216-M220 PolarHBondContact O-N 3.45Å; F217-M220 HydrophobicContact CD1-CE 4.42Å; L218-M220 PolarHBondContact O-N 2.84Å; M220-P223 WeakPolarHBondContact O-CD 3.34Å
221F98.9Very high97.8Very high48 Ų4832.8 Ų32.821%0.21116%0.16CC..Hα-helixtrans-98.4-5.2-175-66.7-23.5000114.4D56 V59 M60 F217 L218 P223 S224 F225D56-F221 HydrophobicContact CB-CB 3.98Å; D56-F221 HydrophobicContact CB-CD1 4.16Å; D56-F221 HydrophobicContact CB-CD2 4.32Å; D56-F221 HydrophobicContact CB-CG 3.92Å; V59-F221 HydrophobicContact CB-CD2 3.91Å; V59-F221 HydrophobicContact CB-CE2 3.77Å; V59-F221 HydrophobicContact CG1-CD2 3.9Å; V59-F221 HydrophobicContact CG1-CE2 3.61Å; V59-F221 HydrophobicContact CG2-CE2 4.26Å; M60-F221 HydrophobicContact CG-CB 3.68Å; M60-F221 HydrophobicContact SD-CB 3.73Å; F217-F221 HydrophobicContact CD1-CD2 4.11Å; F217-F221 AromaticContact CD1-CE2 3.62Å; F217-F221 HydrophobicContact CD1-CE2 3.62Å; F217-F221 HydrophobicContact CD1-CZ 4.31Å; F217-F221 HydrophobicContact CE1-CE2 4.04Å; F217-F221 HydrophobicContact CE1-CZ 4.43Å; F217-F221 WeakPolarHBondContact O-CB 3.13Å; F217-F221 PolarHBondContact O-N 3.09Å; L218-F221 PolarHBondContact O-N 3.34Å; F221-P223 VanDerWaalsContact C-CD 3.42Å; F221-P223 VanDerWaalsContact C-N 3.33Å; F221-S224 WeakPolarHBondContact O-CB 3.35Å; F221-S224 PolarHBondContact O-N 3.42Å; F221-F225 PolarHBondContact O-N 3.04Å; F221-F225 VanDerWaalsContact O-N 3.08Å
222W98.9Very high97.4Very high3 Ų337 Ų371%0.01119%0.188CC..Hα-helixtrans-55.4-37.5175.2-135.6-59.2000114.9M60 H175 L218 S224 F225 N226 T243 L247 L277 G280 V281M60-W222 HydrophobicContact CE-CB 4.41Å; M60-W222 HydrophobicContact CE-CD2 3.95Å; M60-W222 HydrophobicContact CE-CE3 4.07Å; M60-W222 HydrophobicContact CE-CG 4.13Å; H175-W222 AromaticContact CE1-CZ2 3.78Å; H175-W222 AromaticContact NE2-CZ2 3.89Å; L218-W222 HydrophobicContact CB-CE3 4.04Å; L218-W222 HydrophobicContact CB-CZ3 3.84Å; L218-W222 WeakPolarHBondContact O-CB 3.34Å; L218-W222 PolarHBondContact O-N 3.22Å; W222-S224 PolarHBondContact O-N 2.92Å; W222-F225 WeakPolarHBondContact O-CB 3.46Å; W222-F225 PolarHBondContact O-N 3.22Å; W222-F225 VanDerWaalsContact O-N 3.13Å; W222-N226 PolarHBondContact O-N 3.22Å; W222-T243 HydrophobicContact CB-CG2 4.1Å; W222-T243 HydrophobicContact CG-CG2 4.38Å; W222-L247 HydrophobicContact CB-CD1 3.57Å; W222-L247 HydrophobicContact CG-CD1 4.23Å; W222-L277 HydrophobicContact CE3-CB 4.33Å; W222-L277 HydrophobicContact CE3-CD2 4.08Å; W222-L277 HydrophobicContact CH2-CB 4.01Å; W222-L277 HydrophobicContact CZ3-CB 3.55Å; W222-L277 HydrophobicContact CZ3-CD1 4.06Å; W222-L277 HydrophobicContact CZ3-CD2 3.81Å; W222-L277 HydrophobicContact CZ3-CG 4Å; W222-G280 VanDerWaalsContact NE1-C 3.31Å; W222-G280 PolarHBondContact NE1-O 3.33Å; W222-V281 HydrophobicContact CH2-CG2 3.88Å; W222-V281 HydrophobicContact CZ2-CB 4.5Å; W222-V281 HydrophobicContact CZ2-CG2 3.44Å; W222-V281 VanDerWaalsContact CZ2-CG2 3.44Å
223P98.8Very high97Very high16 Ų1637.6 Ų37.610%0.10420%0.203CC..Hα-helixtrans-56.5-40.5174.5-26.636.2000112.5M220 F221 S227 I240 T243M220-P223 WeakPolarHBondContact O-CD 3.34Å; F221-P223 VanDerWaalsContact C-CD 3.42Å; F221-P223 VanDerWaalsContact C-N 3.33Å; P223-S227 WeakPolarHBondContact O-CB 3.46Å; P223-S227 PolarHBondContact O-N 3.19Å; P223-S227 PolarHBondContact O-OG 3.28Å; P223-S227 VanDerWaalsContact O-OG 3.04Å; P223-I240 HydrophobicContact CB-CB 4.47Å; P223-I240 HydrophobicContact CB-CG2 4.01Å; P223-T243 HydrophobicContact CB-CG2 4.44Å; P223-T243 HydrophobicContact CG-CG2 4.21Å
224S98.6Very high96.7Very high16 Ų1640.4 Ų40.411%0.11222%0.219CC..Hα-helixtrans-65.6-43.4173.9-55.80000111.3D56 F221 W222 N226 S227 A228D56-S224 VanDerWaalsContact OD2-CB 3.31Å; D56-S224 WeakPolarHBondContact OD2-CB 3.39Å; D56-S224 PolarHBondContact OD2-OG 2.85Å; F221-S224 WeakPolarHBondContact O-CB 3.35Å; F221-S224 PolarHBondContact O-N 3.42Å; W222-S224 PolarHBondContact O-N 2.92Å; S224-N226 PolarHBondContact O-N 2.92Å; S224-S227 CarbonylContact O-C 3.58Å; S224-S227 PolarHBondContact O-N 3.28Å; S224-S227 VanDerWaalsContact O-N 3.15Å; S224-S227 PolarHBondContact O-OG 2.97Å; S224-A228 WeakPolarHBondContact O-CA 3.49Å; S224-A228 VanDerWaalsContact O-CB 3.29Å; S224-A228 WeakPolarHBondContact O-CB 3.36Å; S224-A228 PolarHBondContact O-N 3.42Å
225F98.6Very high96.6Very high2 Ų244.7 Ų44.71%0.00924%0.237CC..Hα-helixtrans-54.8-50.1175.4-171-82.7000112.4V57 M60 F120 A123 I174 H175 F221 W222 S227V57-F225 HydrophobicContact CG1-CD2 4.02Å; V57-F225 HydrophobicContact CG1-CE2 4.31Å; V57-F225 HydrophobicContact CG2-CB 4.33Å; V57-F225 HydrophobicContact CG2-CD2 4.2Å; M60-F225 HydrophobicContact CE-CB 3.91Å; M60-F225 HydrophobicContact CE-CD2 3.84Å; M60-F225 HydrophobicContact CE-CG 4.01Å; M60-F225 HydrophobicContact SD-CB 3.7Å; M60-F225 HydrophobicContact SD-CD2 3.97Å; M60-F225 HydrophobicContact SD-CG 4.23Å; F120-F225 HydrophobicContact CD1-CD2 4.11Å; F120-F225 HydrophobicContact CD1-CE1 4.29Å; F120-F225 AromaticContact CD1-CE2 3.45Å; F120-F225 HydrophobicContact CD1-CE2 3.45Å; F120-F225 VanDerWaalsContact CD1-CE2 3.45Å; F120-F225 AromaticContact CD1-CZ 3.55Å; F120-F225 HydrophobicContact CD1-CZ 3.55Å; F120-F225 HydrophobicContact CE1-CD1 4.12Å; F120-F225 AromaticContact CE1-CD2 3.6Å; F120-F225 HydrophobicContact CE1-CD2 3.6Å; F120-F225 AromaticContact CE1-CE1 3.96Å; F120-F225 HydrophobicContact CE1-CE1 3.96Å; F120-F225 AromaticContact CE1-CE2 3.41Å; F120-F225 HydrophobicContact CE1-CE2 3.41Å; F120-F225 VanDerWaalsContact CE1-CE2 3.41Å; F120-F225 AromaticContact CE1-CG 3.95Å; F120-F225 HydrophobicContact CE1-CG 3.95Å; F120-F225 AromaticContact CE1-CZ 3.59Å; F120-F225 HydrophobicContact CE1-CZ 3.59Å; A123-F225 HydrophobicContact CB-CE2 4.44Å; I174-F225 HydrophobicContact CD1-CE1 4.25Å; I174-F225 HydrophobicContact CD1-CZ 3.77Å; H175-F225 AromaticContact NE2-CE1 3.95Å; F221-F225 PolarHBondContact O-N 3.04Å; F221-F225 VanDerWaalsContact O-N 3.08Å; W222-F225 WeakPolarHBondContact O-CB 3.46Å; W222-F225 PolarHBondContact O-N 3.22Å; W222-F225 VanDerWaalsContact O-N 3.13Å; F225-S227 PolarHBondContact O-N 2.92Å
226N98.7Very high96.5Very high0 Ų046.3 Ų46.30%025%0.245CC..Hα-helixtrans-74.1-12.4-178.3-77-0.4000113.7G169 W222 S224 T243 G280 A287G169-N226 WeakPolarHBondContact CA-OD1 3.32Å; G169-N226 PolarHBondContact O-OD1 2.82Å; W222-N226 PolarHBondContact O-N 3.22Å; S224-N226 PolarHBondContact O-N 2.92Å; N226-T243 HydrophobicContact CB-CG2 4.26Å; N226-T243 VanDerWaalsContact CB-OG1 3.26Å; N226-T243 WeakPolarHBondContact CB-OG1 3.32Å; N226-T243 WeakPolarHBondContact ND2-CG2 3.24Å; N226-T243 PolarHBondContact ND2-OG1 3.07Å; N226-G280 PolarHBondContact ND2-O 3.02Å; N226-A287 HydrophobicContact CB-CB 4.23Å
227S97.9Very high96.4Very high0 Ų045.4 Ų45.40%025%0.245CC..Hα-helixtrans-113.3-8.6-177.777.60000114.2P223 S224 F225 I229 A230 Q236 I240P223-S227 WeakPolarHBondContact O-CB 3.46Å; P223-S227 PolarHBondContact O-N 3.19Å; P223-S227 PolarHBondContact O-OG 3.28Å; P223-S227 VanDerWaalsContact O-OG 3.04Å; S224-S227 CarbonylContact O-C 3.58Å; S224-S227 PolarHBondContact O-N 3.28Å; S224-S227 VanDerWaalsContact O-N 3.15Å; S224-S227 PolarHBondContact O-OG 2.97Å; F225-S227 PolarHBondContact O-N 2.92Å; S227-I229 VanDerWaalsContact C-N 3.25Å; S227-I229 PolarHBondContact O-N 3.21Å; S227-A230 WeakPolarHBondContact O-CB 3.36Å; S227-A230 PolarHBondContact O-N 2.73Å; S227-A230 VanDerWaalsContact O-N 3.1Å; S227-Q236 PolarHBondContact O-NE2 3.36Å; S227-I240 WeakPolarHBondContact OG-CG1 3.18Å
228A96Very high96.3Very high3 Ų346 Ų463%0.02525%0.246CC..THydrogen-bonded Turntrans-59-35.1-169.100000113.5L53 V57 I116 F120 S224L53-A228 HydrophobicContact CB-CB 4.33Å; V57-A228 HydrophobicContact CG2-CB 4.25Å; I116-A228 HydrophobicContact CD1-CB 4.36Å; I116-A228 HydrophobicContact CG2-CB 3.81Å; F120-A228 HydrophobicContact CZ-CB 4.15Å; S224-A228 WeakPolarHBondContact O-CA 3.49Å; S224-A228 VanDerWaalsContact O-CB 3.29Å; S224-A228 WeakPolarHBondContact O-CB 3.36Å; S224-A228 PolarHBondContact O-N 3.42Å
229I93.6Very high96.3Very high54 Ų5446 Ų4628%0.27725%0.245SC..THydrogen-bonded Turntrans-110.17.5179.359.9164.9000113.1I116 F120 I168 S227I116-I229 HydrophobicContact CG2-CG2 4.08Å; F120-I229 HydrophobicContact CE2-CD1 4.01Å; F120-I229 HydrophobicContact CE2-CG1 4.08Å; F120-I229 HydrophobicContact CE2-CG2 3.94Å; I168-I229 HydrophobicContact CD1-CD1 4.32Å; I168-I229 HydrophobicContact CD1-CG1 3.87Å; S227-I229 VanDerWaalsContact C-N 3.25Å; S227-I229 PolarHBondContact O-N 3.21Å
230A94.8Very high96.3Very high6 Ų646.1 Ų46.15%0.0525%0.25CS..SBendtrans-68.2149.9174.700000110.9I168 S227 P232 Q236I168-A230 HydrophobicContact CD1-CB 4.2Å; I168-A230 HydrophobicContact CG1-CB 3.84Å; S227-A230 WeakPolarHBondContact O-CB 3.36Å; S227-A230 PolarHBondContact O-N 2.73Å; S227-A230 VanDerWaalsContact O-N 3.1Å; A230-P232 WeakPolarHBondContact O-CD 3.43Å; A230-Q236 HydrophobicContact CB-CB 4.04Å; A230-Q236 HydrophobicContact CB-CG 4.37Å
231E91.4Very high96.3Very high120 Ų12044.1 Ų44.156%0.56124%0.243SC*.PPolyproline II helixtrans-57.9125.5175.3-165.8179.8166.800109.8K235 Q236E231-K235 HydrophobicContact CB-CB 4.24Å; E231-K235 HydrophobicContact CB-CD 3.99Å; E231-K235 IonicContact OE2-NZ 2.71Å; E231-K235 PolarHBondContact OE2-NZ 2.92Å; E231-Q236 WeakPolarHBondContact O-CB 3.33Å; E231-Q236 PolarHBondContact O-N 3.46Å
232P89.1Confident96.3Very high90 Ų9042 Ų4258%0.58423%0.234SC*.THydrogen-bonded Turntrans-55.1145.5-177.7-28.335.3000113A230A230-P232 WeakPolarHBondContact O-CD 3.43Å
233G91Very high96.3Very high48 Ų4841.9 Ų41.950%0.49523%0.233SC..THydrogen-bonded Turntrans95.5-124-176.700000112.6K235 Q236 C237G233-K235 PolarHBondContact O-N 3.26Å; G233-Q236 PolarHBondContact O-N 2.94Å; G233-C237 WeakPolarHBondContact O-CB 3.4Å; G233-C237 PolarHBondContact O-N 2.88Å
234D93.5Very high96.3Very high119 Ų11946.9 Ų46.964%0.63625%0.251SS*.Hα-helixtrans-68.3-38-163.6-135.661.8000113.3R238D234-R238 WeakPolarHBondContact O-CB 3.35Å; D234-R238 PolarHBondContact O-N 3.01Å; D234-R238 IonicContact OD2-NH2 3.73Å; D234-R238 PolarHBondContact OD2-NH2 3.11Å
235K95.8Very high96.3Very high90 Ų9050 Ų5039%0.39126%0.263SS..Hα-helixtrans-69.6-44.8177.4-78.5-170.5-171.6157.60112.1E231 G233 R238 A239 D288E231-K235 HydrophobicContact CB-CB 4.24Å; E231-K235 HydrophobicContact CB-CD 3.99Å; E231-K235 IonicContact OE2-NZ 2.71Å; E231-K235 PolarHBondContact OE2-NZ 2.92Å; G233-K235 PolarHBondContact O-N 3.26Å; K235-R238 WeakPolarHBondContact O-CB 3.34Å; K235-R238 PolarHBondContact O-N 3.17Å; K235-A239 PolarHBondContact O-N 3.39Å; K235-D288 HydrophobicContact CB-CB 4.11Å
236Q96.3Very high96.3Very high37 Ų3749.9 Ų49.917%0.17326%0.262CS..Hα-helixtrans-62-46.8175.8-171.1177.960.800112L53 S227 A230 E231 G233 R238 A239 I240L53-Q236 VanDerWaalsContact CD1-NE2 3.33Å; S227-Q236 PolarHBondContact O-NE2 3.36Å; A230-Q236 HydrophobicContact CB-CB 4.04Å; A230-Q236 HydrophobicContact CB-CG 4.37Å; E231-Q236 WeakPolarHBondContact O-CB 3.33Å; E231-Q236 PolarHBondContact O-N 3.46Å; G233-Q236 PolarHBondContact O-N 2.94Å; Q236-R238 VanDerWaalsContact C-N 3.29Å; Q236-R238 PolarHBondContact O-N 2.72Å; Q236-A239 PolarHBondContact O-N 3.43Å; Q236-I240 HydrophobicContact CG-CD1 4.47Å; Q236-I240 WeakPolarHBondContact O-CG1 3.47Å; Q236-I240 PolarHBondContact O-N 3.1Å
237C96.8Very high96.3Very high73 Ų7349.9 Ų49.949%0.49326%0.262SS..Hα-helixtrans-58-43.4175.1-177.90000111.6G233 I240 V241G233-C237 WeakPolarHBondContact O-CB 3.4Å; G233-C237 PolarHBondContact O-N 2.88Å; C237-I240 PolarHBondContact O-N 3.4Å; C237-V241 WeakPolarHBondContact O-CG2 3.49Å; C237-V241 PolarHBondContact O-N 3.28Å
238R97.8Very high96.4Very high82 Ų8251.3 Ų51.331%0.30927%0.274SS..Hα-helixtrans-62.9-42.8177.2-168.9179.4-47.4-98.3-4.6112.5D234 K235 Q236 I240 V241 N242 A287 M289D234-R238 WeakPolarHBondContact O-CB 3.35Å; D234-R238 PolarHBondContact O-N 3.01Å; D234-R238 IonicContact OD2-NH2 3.73Å; D234-R238 PolarHBondContact OD2-NH2 3.11Å; K235-R238 WeakPolarHBondContact O-CB 3.34Å; K235-R238 PolarHBondContact O-N 3.17Å; Q236-R238 VanDerWaalsContact C-N 3.29Å; Q236-R238 PolarHBondContact O-N 2.72Å; R238-I240 VanDerWaalsContact C-N 3.33Å; R238-I240 PolarHBondContact O-N 3.13Å; R238-V241 PolarHBondContact O-N 3.34Å; R238-N242 WeakPolarHBondContact CG-ND2 3.2Å; R238-N242 VanDerWaalsContact O-CB 3.26Å; R238-N242 WeakPolarHBondContact O-CB 3.39Å; R238-N242 PolarHBondContact O-N 2.8Å; R238-N242 PolarHBondContact O-ND2 3.03Å; R238-A287 CarbonylContact C-O 3.49Å; R238-M289 WeakPolarHBondContact CD-O 3.38Å
239A98.6Very high96.5Very high0 Ų051.7 Ų51.70%028%0.277CS..Hα-helixtrans-59.5-42.717500000112.3K235 Q236 T243 A287 D288K235-A239 PolarHBondContact O-N 3.39Å; Q236-A239 PolarHBondContact O-N 3.43Å; A239-T243 WeakPolarHBondContact O-CB 3.4Å; A239-T243 PolarHBondContact O-N 2.85Å; A239-T243 PolarHBondContact O-OG1 3.5Å; A239-A287 WeakPolarHBondContact CA-O 3.22Å; A239-A287 HydrophobicContact CB-CB 3.99Å; A239-A287 PolarHBondContact N-O 2.93Å; A239-D288 HydrophobicContact CB-CB 4.27Å
240I98.6Very high96.8Very high65 Ų6549.1 Ų49.133%0.33326%0.264SS..Hα-helixtrans-61.2-54175.4-66167000110.4P223 S227 Q236 C237 R238 T243 Y244P223-I240 HydrophobicContact CB-CB 4.47Å; P223-I240 HydrophobicContact CB-CG2 4.01Å; S227-I240 WeakPolarHBondContact OG-CG1 3.18Å; Q236-I240 HydrophobicContact CG-CD1 4.47Å; Q236-I240 WeakPolarHBondContact O-CG1 3.47Å; Q236-I240 PolarHBondContact O-N 3.1Å; C237-I240 PolarHBondContact O-N 3.4Å; R238-I240 VanDerWaalsContact C-N 3.33Å; R238-I240 PolarHBondContact O-N 3.13Å; I240-T243 PolarHBondContact O-N 3.15Å; I240-Y244 WeakPolarHBondContact O-CB 3.3Å; I240-Y244 PolarHBondContact O-N 3.44Å
241V98.6Very high97Very high55 Ų5550.5 Ų50.533%0.33327%0.272SS..Hα-helixtrans-64.8-44.4-175.1172.60000111.8C237 R238 T243 Y244 F245C237-V241 WeakPolarHBondContact O-CG2 3.49Å; C237-V241 PolarHBondContact O-N 3.28Å; R238-V241 PolarHBondContact O-N 3.34Å; V241-T243 VanDerWaalsContact C-N 3.33Å; V241-T243 PolarHBondContact O-N 3.37Å; V241-Y244 PolarHBondContact O-N 2.95Å; V241-F245 HydrophobicContact CG1-CD2 3.76Å; V241-F245 HydrophobicContact CG1-CE2 3.82Å; V241-F245 WeakPolarHBondContact O-CD2 3.49Å; V241-F245 PolarHBondContact O-N 3.49Å; V241-F245 VanDerWaalsContact O-N 3.09Å
242N98.8Very high97.3Very high3 Ų350.7 Ų50.72%0.01628%0.276CS..Hα-helixtrans-64.2-40177.7-78.4-26.9000111.7R238 S246 V283 A287 I291 S296R238-N242 WeakPolarHBondContact CG-ND2 3.2Å; R238-N242 VanDerWaalsContact O-CB 3.26Å; R238-N242 WeakPolarHBondContact O-CB 3.39Å; R238-N242 PolarHBondContact O-N 2.8Å; R238-N242 PolarHBondContact O-ND2 3.03Å; N242-S246 VanDerWaalsContact O-CB 3.23Å; N242-S246 WeakPolarHBondContact O-CB 3.31Å; N242-S246 PolarHBondContact O-N 3.3Å; N242-V283 HydrophobicContact CB-CG2 4.17Å; N242-A287 PolarHBondContact ND2-O 2.82Å; N242-I291 VanDerWaalsContact ND2-CG1 3.29Å; N242-I291 WeakPolarHBondContact ND2-CG1 3.35Å; N242-S296 WeakPolarHBondContact O-CB 3.26Å; N242-S296 PolarHBondContact O-OG 2.7Å; N242-S296 PolarHBondContact OD1-OG 2.76Å
243T98.9Very high97.8Very high0 Ų047.6 Ų47.60%026%0.256CS..Hα-helixtrans-65.9-44.8177.2-57.60000111.7W222 P223 N226 A239 I240 V241 F245 S246 L247 V283W222-T243 HydrophobicContact CB-CG2 4.1Å; W222-T243 HydrophobicContact CG-CG2 4.38Å; P223-T243 HydrophobicContact CB-CG2 4.44Å; P223-T243 HydrophobicContact CG-CG2 4.21Å; N226-T243 HydrophobicContact CB-CG2 4.26Å; N226-T243 VanDerWaalsContact CB-OG1 3.26Å; N226-T243 WeakPolarHBondContact CB-OG1 3.32Å; N226-T243 WeakPolarHBondContact ND2-CG2 3.24Å; N226-T243 PolarHBondContact ND2-OG1 3.07Å; A239-T243 WeakPolarHBondContact O-CB 3.4Å; A239-T243 PolarHBondContact O-N 2.85Å; A239-T243 PolarHBondContact O-OG1 3.5Å; I240-T243 PolarHBondContact O-N 3.15Å; V241-T243 VanDerWaalsContact C-N 3.33Å; V241-T243 PolarHBondContact O-N 3.37Å; T243-F245 PolarHBondContact O-N 3.44Å; T243-S246 PolarHBondContact O-N 2.87Å; T243-L247 HydrophobicContact CG2-CD1 4.09Å; T243-L247 WeakPolarHBondContact O-CB 3.27Å; T243-L247 WeakPolarHBondContact O-CG 3.39Å; T243-L247 PolarHBondContact O-N 3.36Å; T243-V283 HydrophobicContact CG2-CG1 4.39Å
244Y98.9Very high98.2Very high122 Ų12245.3 Ų45.348%0.47823%0.232SC..Hα-helixtrans-56.2-51.7177.1177.5-92.8000112.4I240 V241 L247 A248I240-Y244 WeakPolarHBondContact O-CB 3.3Å; I240-Y244 PolarHBondContact O-N 3.44Å; V241-Y244 PolarHBondContact O-N 2.95Å; Y244-L247 PolarHBondContact O-N 3.07Å; Y244-A248 PolarHBondContact O-N 3.49Å
245F98.9Very high98.4Very high80 Ų8043.4 Ų43.435%0.35122%0.218SC..Hα-helixtrans-72.9-32.6-178.1-77.5-60.9000113.4V241 T243 A249 P293 M297V241-F245 HydrophobicContact CG1-CD2 3.76Å; V241-F245 HydrophobicContact CG1-CE2 3.82Å; V241-F245 WeakPolarHBondContact O-CD2 3.49Å; V241-F245 PolarHBondContact O-N 3.49Å; V241-F245 VanDerWaalsContact O-N 3.09Å; T243-F245 PolarHBondContact O-N 3.44Å; F245-A249 WeakPolarHBondContact O-CB 3.44Å; F245-A249 PolarHBondContact O-N 2.96Å; F245-P293 HydrophobicContact CD2-CB 4.39Å; F245-M297 HydrophobicContact CB-CG 3.89Å
246S98.9Very high98.6Very high0 Ų041.5 Ų41.50%022%0.219CC..Hα-helixtrans-61-48.5171.6-178.50000111.2N242 T243 A248 A249 C250 G279 S296 G300N242-S246 VanDerWaalsContact O-CB 3.23Å; N242-S246 WeakPolarHBondContact O-CB 3.31Å; N242-S246 PolarHBondContact O-N 3.3Å; T243-S246 PolarHBondContact O-N 2.87Å; S246-A248 PolarHBondContact O-N 3.02Å; S246-A249 PolarHBondContact O-N 3.43Å; S246-C250 VanDerWaalsContact O-CB 3.22Å; S246-C250 WeakPolarHBondContact O-CB 3.45Å; S246-C250 PolarHBondContact O-N 3.2Å; S246-G279 VanDerWaalsContact OG-C 3.27Å; S246-G279 WeakPolarHBondContact OG-CA 3.45Å; S246-G279 PolarHBondContact OG-O 3.46Å; S246-S296 WeakPolarHBondContact CA-O 3.31Å; S246-S296 WeakPolarHBondContact CB-O 3.36Å; S246-S296 PolarHBondContact OG-O 3.24Å; S246-G300 WeakPolarHBondContact O-CA 3.34Å; S246-G300 WeakPolarHBondContact OG-CA 3.39Å; S246-G300 PolarHBondContact OG-N 3.19Å
247L98.9Very high98.7Very high1 Ų142.3 Ų42.31%0.00522%0.222CC..Hα-helixtrans-62.7-43.2178.4-83.5174.6000112.8W219 W222 T243 Y244 C250 V251 G280W219-L247 HydrophobicContact CZ2-CB 4.05Å; W219-L247 WeakPolarHBondContact O-CD1 3.33Å; W222-L247 HydrophobicContact CB-CD1 3.57Å; W222-L247 HydrophobicContact CG-CD1 4.23Å; T243-L247 HydrophobicContact CG2-CD1 4.09Å; T243-L247 WeakPolarHBondContact O-CB 3.27Å; T243-L247 WeakPolarHBondContact O-CG 3.39Å; T243-L247 PolarHBondContact O-N 3.36Å; Y244-L247 PolarHBondContact O-N 3.07Å; L247-C250 WeakPolarHBondContact O-CB 3.34Å; L247-C250 PolarHBondContact O-N 3.32Å; L247-V251 WeakPolarHBondContact O-CG2 3.48Å; L247-V251 PolarHBondContact O-N 2.95Å; L247-G280 VanDerWaalsContact CD2-N 3.31Å
248A98.9Very high98.8Very high30 Ų3038.9 Ų38.925%0.24820%0.199CC..Hα-helixtrans-58.5-49.7176.100000111.3Y244 S246 C250 V251 L252Y244-A248 PolarHBondContact O-N 3.49Å; S246-A248 PolarHBondContact O-N 3.02Å; A248-C250 VanDerWaalsContact C-N 3.33Å; A248-C250 PolarHBondContact O-N 3.5Å; A248-V251 PolarHBondContact O-N 2.92Å; A248-L252 WeakPolarHBondContact O-CD2 3.32Å; A248-L252 PolarHBondContact O-N 2.94Å
249A98.9Very high98.8Very high10 Ų1036.9 Ų36.98%0.08320%0.198CC..Hα-helixtrans-64.2-38.1177.900000112.6F245 S246 V251 L252 T253 M297F245-A249 WeakPolarHBondContact O-CB 3.44Å; F245-A249 PolarHBondContact O-N 2.96Å; S246-A249 PolarHBondContact O-N 3.43Å; A249-V251 PolarHBondContact O-N 3.38Å; A249-L252 PolarHBondContact O-N 3.48Å; A249-T253 PolarHBondContact O-N 2.91Å; A249-T253 VanDerWaalsContact O-N 3.13Å; A249-T253 PolarHBondContact O-OG1 3.09Å; A249-T253 VanDerWaalsContact O-OG1 3.13Å; A249-M297 HydrophobicContact CB-CB 4.01Å; A249-M297 HydrophobicContact CB-CG 4.4Å; A249-M297 WeakPolarHBondContact CB-O 3.43Å
250C98.9Very high98.8Very high0 Ų043 Ų430%023%0.23CC..Hα-helixtrans-59.7-42175.9-174.90000112.4S246 L247 A248 T253 A254 A275 G279 G300 G304S246-C250 VanDerWaalsContact O-CB 3.22Å; S246-C250 WeakPolarHBondContact O-CB 3.45Å; S246-C250 PolarHBondContact O-N 3.2Å; L247-C250 WeakPolarHBondContact O-CB 3.34Å; L247-C250 PolarHBondContact O-N 3.32Å; A248-C250 VanDerWaalsContact C-N 3.33Å; A248-C250 PolarHBondContact O-N 3.5Å; C250-T253 WeakPolarHBondContact CA-OG1 3.41Å; C250-T253 PolarHBondContact O-N 3.34Å; C250-T253 PolarHBondContact O-OG1 3.4Å; C250-A254 WeakPolarHBondContact O-CB 3.35Å; C250-A254 PolarHBondContact O-N 3.15Å; C250-A275 PolarHBondContact SG-O 2.86Å; C250-G279 PolarHBondContact SG-N 2.85Å; C250-G300 VanDerWaalsContact CA-O 3.3Å; C250-G300 WeakPolarHBondContact CA-O 3.38Å; C250-G300 WeakPolarHBondContact CB-O 3.34Å; C250-G304 VanDerWaalsContact SG-CA 3.52Å
251V98.9Very high98.8Very high35 Ų3541.4 Ų41.421%0.21222%0.223CC..Hα-helixtrans-59.1-51176.8170.40000111.2W219 L247 A248 A249 T253 A254 F255 T276W219-V251 HydrophobicContact CZ2-CG2 4.4Å; W219-V251 VanDerWaalsContact NE1-CG2 3.26Å; L247-V251 WeakPolarHBondContact O-CG2 3.48Å; L247-V251 PolarHBondContact O-N 2.95Å; A248-V251 PolarHBondContact O-N 2.92Å; A249-V251 PolarHBondContact O-N 3.38Å; V251-T253 VanDerWaalsContact C-N 3.32Å; V251-T253 PolarHBondContact O-N 2.99Å; V251-A254 PolarHBondContact O-N 3.07Å; V251-F255 HydrophobicContact CG1-CD2 3.93Å; V251-F255 HydrophobicContact CG1-CE2 3.97Å; V251-F255 VanDerWaalsContact O-CD2 3.32Å; V251-F255 WeakPolarHBondContact O-CD2 3.4Å; V251-F255 PolarHBondContact O-N 3.43Å; V251-T276 HydrophobicContact CG1-CG2 4.5Å; V251-T276 HydrophobicContact CG2-CG2 4.18Å
252L98.8Very high98.7Very high125 Ų12540.8 Ų40.865%0.65422%0.216SC*.Hα-helixtrans-61.2-43.5-177.2-82-56.3000111.4A248 A249 A256A248-L252 WeakPolarHBondContact O-CD2 3.32Å; A248-L252 PolarHBondContact O-N 2.94Å; A249-L252 PolarHBondContact O-N 3.48Å; L252-A256 WeakPolarHBondContact O-CB 3.44Å; L252-A256 PolarHBondContact O-N 3.03Å
253T98.8Very high98.4Very high25 Ų2547.4 Ų47.415%0.15325%0.247CC..Hα-helixtrans-68.8-40.3177.755.90000112.7A249 C250 V251 F255 A256 F257 S301A249-T253 PolarHBondContact O-N 2.91Å; A249-T253 VanDerWaalsContact O-N 3.13Å; A249-T253 PolarHBondContact O-OG1 3.09Å; A249-T253 VanDerWaalsContact O-OG1 3.13Å; C250-T253 WeakPolarHBondContact CA-OG1 3.41Å; C250-T253 PolarHBondContact O-N 3.34Å; C250-T253 PolarHBondContact O-OG1 3.4Å; V251-T253 VanDerWaalsContact C-N 3.32Å; V251-T253 PolarHBondContact O-N 2.99Å; T253-F255 PolarHBondContact O-N 3.5Å; T253-A256 PolarHBondContact O-N 3.19Å; T253-F257 WeakPolarHBondContact O-CB 3.22Å; T253-F257 WeakPolarHBondContact O-CD2 3.46Å; T253-F257 PolarHBondContact O-N 2.98Å; T253-S301 PolarHBondContact OG1-O 2.99Å
254A98.8Very high98.3Very high0 Ų057.5 Ų57.50%029%0.285CS..Hα-helixtrans-61.4-43.9176.300000111.8C250 V251 S258 A275 T276 V308C250-A254 WeakPolarHBondContact O-CB 3.35Å; C250-A254 PolarHBondContact O-N 3.15Å; V251-A254 PolarHBondContact O-N 3.07Å; A254-S258 WeakPolarHBondContact O-CB 3.19Å; A254-S258 PolarHBondContact O-N 3.37Å; A254-A275 HydrophobicContact CB-CB 4.09Å; A254-T276 HydrophobicContact CB-CG2 4Å; A254-V308 HydrophobicContact CB-CG2 4.14Å
255F98.8Very high98.1Very high78 Ų7853.5 Ų53.534%0.34228%0.281SS..Hα-helixtrans-64.1-45.5175-88.9-103.5000112.2V251 T253 S258 S259 L267 I272 T276V251-F255 HydrophobicContact CG1-CD2 3.93Å; V251-F255 HydrophobicContact CG1-CE2 3.97Å; V251-F255 VanDerWaalsContact O-CD2 3.32Å; V251-F255 WeakPolarHBondContact O-CD2 3.4Å; V251-F255 PolarHBondContact O-N 3.43Å; T253-F255 PolarHBondContact O-N 3.5Å; F255-S258 PolarHBondContact O-N 2.73Å; F255-S259 PolarHBondContact O-N 3.22Å; F255-S259 VanDerWaalsContact O-N 3.07Å; F255-L267 HydrophobicContact CD1-CD1 3.63Å; F255-L267 HydrophobicContact CD1-CD2 4.04Å; F255-L267 HydrophobicContact CD1-CG 4.48Å; F255-L267 HydrophobicContact CE1-CD1 3.72Å; F255-L267 WeakPolarHBondContact O-CD2 3.16Å; F255-I272 HydrophobicContact CD1-CD1 3.86Å; F255-I272 HydrophobicContact CD2-CD1 3.65Å; F255-I272 HydrophobicContact CE1-CD1 3.85Å; F255-I272 HydrophobicContact CE1-CG1 4.18Å; F255-I272 HydrophobicContact CE1-CG2 4.43Å; F255-I272 HydrophobicContact CE2-CB 4.48Å; F255-I272 HydrophobicContact CE2-CD1 3.65Å; F255-I272 HydrophobicContact CE2-CG1 4.25Å; F255-I272 HydrophobicContact CE2-CG2 3.68Å; F255-I272 HydrophobicContact CG-CD1 3.77Å; F255-I272 HydrophobicContact CZ-CB 4.37Å; F255-I272 HydrophobicContact CZ-CD1 3.75Å; F255-I272 HydrophobicContact CZ-CG1 3.97Å; F255-I272 HydrophobicContact CZ-CG2 3.49Å; F255-I272 VanDerWaalsContact CZ-CG2 3.49Å; F255-T276 HydrophobicContact CD2-CG2 4.26Å; F255-T276 HydrophobicContact CE2-CG2 4.03Å
256A98.8Very high98Very high50 Ų5056.5 Ų56.541%0.41329%0.294SS..Hα-helixtrans-60.1-52.1178.800000111.3L252 T253 S258 S259 L260L252-A256 WeakPolarHBondContact O-CB 3.44Å; L252-A256 PolarHBondContact O-N 3.03Å; T253-A256 PolarHBondContact O-N 3.19Å; A256-S258 PolarHBondContact O-N 3.06Å; A256-S259 PolarHBondContact O-N 3.44Å; A256-L260 VanDerWaalsContact O-CG 3.29Å; A256-L260 WeakPolarHBondContact O-CG 3.49Å; A256-L260 PolarHBondContact O-N 3.46Å
257F98.8Very high98Very high55 Ų5561 Ų6124%0.24132%0.317CS..Hα-helixtrans-68-34.9-179.9-84.1-95.8000112.4T253 S259 L260 V261 M305 V308 L309T253-F257 WeakPolarHBondContact O-CB 3.22Å; T253-F257 WeakPolarHBondContact O-CD2 3.46Å; T253-F257 PolarHBondContact O-N 2.98Å; F257-S259 VanDerWaalsContact C-N 3.33Å; F257-S259 PolarHBondContact O-N 2.8Å; F257-L260 HydrophobicContact CD1-CD1 4.42Å; F257-L260 HydrophobicContact CG-CD1 4.47Å; F257-L260 PolarHBondContact O-N 2.96Å; F257-V261 WeakPolarHBondContact O-CG2 3.4Å; F257-V261 PolarHBondContact O-N 3.4Å; F257-M305 HydrophobicContact CD1-CG 3.83Å; F257-M305 HydrophobicContact CD2-CB 4.06Å; F257-M305 HydrophobicContact CD2-CG 4.14Å; F257-M305 HydrophobicContact CE1-CB 4.44Å; F257-M305 HydrophobicContact CE1-CG 3.51Å; F257-M305 HydrophobicContact CE1-SD 3.73Å; F257-M305 HydrophobicContact CE2-CB 3.98Å; F257-M305 HydrophobicContact CE2-CG 3.84Å; F257-M305 HydrophobicContact CE2-SD 4Å; F257-M305 HydrophobicContact CG-CB 4.33Å; F257-M305 HydrophobicContact CG-CG 4.14Å; F257-M305 HydrophobicContact CZ-CB 4.18Å; F257-M305 HydrophobicContact CZ-CG 3.52Å; F257-M305 HydrophobicContact CZ-SD 3.36Å; F257-M305 WeakPolarHBondContact CZ-SD 3.37Å; F257-V308 HydrophobicContact CB-CB 4.08Å; F257-V308 HydrophobicContact CB-CG1 3.93Å; F257-V308 HydrophobicContact CB-CG2 4.4Å; F257-L309 HydrophobicContact CD1-CD2 4.39Å
258S98.7Very high98Very high0 Ų063.4 Ų63.40%033%0.331CS..Hα-helixtrans-57.6-48174.2-176.10000110.7A254 F255 A256 E262 N268 H271A254-S258 WeakPolarHBondContact O-CB 3.19Å; A254-S258 PolarHBondContact O-N 3.37Å; F255-S258 PolarHBondContact O-N 2.73Å; A256-S258 PolarHBondContact O-N 3.06Å; S258-E262 VanDerWaalsContact O-CB 3.27Å; S258-E262 WeakPolarHBondContact O-CB 3.45Å; S258-E262 WeakPolarHBondContact O-CG 3.45Å; S258-E262 PolarHBondContact O-N 3.02Å; S258-E262 VanDerWaalsContact O-N 3.12Å; S258-N268 PolarHBondContact OG-N 3.34Å; S258-H271 WeakPolarHBondContact CB-ND1 3.4Å; S258-H271 PolarHBondContact OG-ND1 2.83Å
259S98.6Very high97.9Very high41 Ų4165.2 Ų65.229%0.28733%0.334SS..Hα-helixtrans-62.8-43.1174.7-174.50000112.4F255 A256 F257 V261 E262 G265 K266F255-S259 PolarHBondContact O-N 3.22Å; F255-S259 VanDerWaalsContact O-N 3.07Å; A256-S259 PolarHBondContact O-N 3.44Å; F257-S259 VanDerWaalsContact C-N 3.33Å; F257-S259 PolarHBondContact O-N 2.8Å; S259-V261 PolarHBondContact O-N 2.81Å; S259-E262 PolarHBondContact O-N 3.23Å; S259-G265 WeakPolarHBondContact O-CA 3.37Å; S259-G265 VanDerWaalsContact OG-C 3.27Å; S259-G265 WeakPolarHBondContact OG-CA 3.39Å; S259-G265 PolarHBondContact OG-O 3.34Å; S259-K266 WeakPolarHBondContact CA-O 3.26Å
260L98.4Very high97.9Very high128 Ų12866.7 Ų66.767%0.6734%0.343SS*.Hα-helixtrans-62.7-38.2-179.1-73.2170.5000113.4A256 F257A256-L260 VanDerWaalsContact O-CG 3.29Å; A256-L260 WeakPolarHBondContact O-CG 3.49Å; A256-L260 PolarHBondContact O-N 3.46Å; F257-L260 HydrophobicContact CD1-CD1 4.42Å; F257-L260 HydrophobicContact CG-CD1 4.47Å; F257-L260 PolarHBondContact O-N 2.96Å
261V98Very high97.9Very high31 Ų3166.9 Ų66.919%0.18834%0.343CS..Hα-helixtrans-92.2-13.7-176.1-570000113.7F257 S259 V308 L309 K312 F313F257-V261 WeakPolarHBondContact O-CG2 3.4Å; F257-V261 PolarHBondContact O-N 3.4Å; S259-V261 PolarHBondContact O-N 2.81Å; V261-V308 HydrophobicContact CG2-CG1 3.89Å; V261-L309 HydrophobicContact CG1-CD2 4.02Å; V261-K312 HydrophobicContact CB-CG 4.07Å; V261-K312 HydrophobicContact CG2-CB 4.12Å; V261-K312 HydrophobicContact CG2-CD 4.24Å; V261-K312 HydrophobicContact CG2-CG 3.98Å; V261-K312 WeakPolarHBondContact O-CE 3.38Å; V261-K312 PolarHBondContact O-NZ 3.43Å; V261-F313 HydrophobicContact CG1-CE2 4.18Å; V261-F313 HydrophobicContact CG1-CZ 4.44Å
262E97.1Very high97.8Very high43 Ų4365.7 Ų65.720%0.20134%0.336CS..SBendtrans-93.4151.6178.4-75.3-55.9149.300113.5S258 S259 R264 G265 K266 N268 H271 K312S258-E262 VanDerWaalsContact O-CB 3.27Å; S258-E262 WeakPolarHBondContact O-CB 3.45Å; S258-E262 WeakPolarHBondContact O-CG 3.45Å; S258-E262 PolarHBondContact O-N 3.02Å; S258-E262 VanDerWaalsContact O-N 3.12Å; S259-E262 PolarHBondContact O-N 3.23Å; E262-R264 PolarHBondContact O-N 3.34Å; E262-G265 PolarHBondContact O-N 3.04Å; E262-K266 VanDerWaalsContact CB-O 3.24Å; E262-K266 WeakPolarHBondContact CB-O 3.4Å; E262-N268 HydrophobicContact CG-CB 3.94Å; E262-H271 IonicContact OE1-CE1 2.67Å; E262-K312 IonicContact OE1-NZ 3.54Å; E262-K312 PolarHBondContact OE1-NZ 3.32Å; E262-K312 IonicContact OE2-NZ 3.81Å; E262-K312 PolarHBondContact OE2-NZ 2.72Å; E262-K312 VanDerWaalsContact OE2-NZ 3.17Å
263H93.4Very high97.8Very high142 Ų14259.8 Ų59.866%0.65731%0.305SS*.G310 helixtrans-66.6131.2-174.9-170.7-97.9000111.2G265H263-G265 VanDerWaalsContact C-N 3.26Å; H263-G265 PolarHBondContact O-N 3.48Å
264R95.3Very high97.8Very high211 Ų21159.1 Ų59.180%0.79630%0.3SS*.G310 helixtrans61.624.6-177-61.6170.9-176.4-172.14.3114.6E262 K266E262-R264 PolarHBondContact O-N 3.34Å; R264-K266 PolarHBondContact O-N 2.95Å
265G95.3Very high97.8Very high39 Ų3959.1 Ų59.140%0.40230%0.3SS..G310 helixtrans72.315.1175.800000114.2S259 E262 H263S259-G265 WeakPolarHBondContact O-CA 3.37Å; S259-G265 VanDerWaalsContact OG-C 3.27Å; S259-G265 WeakPolarHBondContact OG-CA 3.39Å; S259-G265 PolarHBondContact OG-O 3.34Å; E262-G265 PolarHBondContact O-N 3.04Å; H263-G265 VanDerWaalsContact C-N 3.26Å; H263-G265 PolarHBondContact O-N 3.48Å
266K97.8Very high97.8Very high143 Ų14355.7 Ų55.762%0.62229%0.286SS*.PPolyproline II helixtrans-72161.4177.4-68.8-171175.2-1710111.2S259 E262 R264S259-K266 WeakPolarHBondContact CA-O 3.26Å; E262-K266 VanDerWaalsContact CB-O 3.24Å; E262-K266 WeakPolarHBondContact CB-O 3.4Å; R264-K266 PolarHBondContact O-N 2.95Å
267L98.3Very high97.8Very high93 Ų9353.3 Ų53.349%0.48727%0.266SS..PPolyproline II helixtrans-97.5141.7174.4-60.2172.1000110.6F255F255-L267 HydrophobicContact CD1-CD1 3.63Å; F255-L267 HydrophobicContact CD1-CD2 4.04Å; F255-L267 HydrophobicContact CD1-CG 4.48Å; F255-L267 HydrophobicContact CE1-CD1 3.72Å; F255-L267 WeakPolarHBondContact O-CD2 3.16Å
268N98.1Very high97.8Very high53 Ų5350.7 Ų50.728%0.28326%0.255SS..PPolyproline II helixtrans-103.6125.2173.4-177.7-27000110.4S258 E262 V270 H271 I272S258-N268 PolarHBondContact OG-N 3.34Å; E262-N268 HydrophobicContact CG-CB 3.94Å; N268-V270 VanDerWaalsContact C-N 3.28Å; N268-V270 PolarHBondContact O-N 3Å; N268-V270 WeakPolarHBondContact OD1-CB 3.3Å; N268-V270 PolarHBondContact OD1-N 3.49Å; N268-H271 WeakPolarHBondContact O-CB 3.26Å; N268-H271 PolarHBondContact O-N 3.15Å; N268-H271 VanDerWaalsContact O-N 3.12Å; N268-I272 WeakPolarHBondContact O-CG1 3.26Å; N268-I272 PolarHBondContact O-N 3.27Å
269M98.2Very high97.9Very high67 Ų6750.7 Ų50.733%0.3326%0.255SS..Hα-helixtrans-62.8-30.5-177.5-78-56.3-63.500113.7D208 M212 H271 I272 Q273D208-M269 HydrophobicContact CB-CB 4.48Å; D208-M269 HydrophobicContact CB-CG 4.48Å; M212-M269 HydrophobicContact CG-CE 3.37Å; M212-M269 HydrophobicContact SD-CE 3.63Å; M269-H271 VanDerWaalsContact C-N 3.3Å; M269-H271 PolarHBondContact O-N 3.07Å; M269-I272 PolarHBondContact O-N 2.8Å; M269-I272 VanDerWaalsContact O-N 3.14Å; M269-Q273 HydrophobicContact CE-CG 4.09Å; M269-Q273 WeakPolarHBondContact O-CB 3.4Å; M269-Q273 VanDerWaalsContact O-CG 3.23Å; M269-Q273 WeakPolarHBondContact O-CG 3.48Å; M269-Q273 PolarHBondContact O-N 2.95Å; M269-Q273 PolarHBondContact O-OE1 3.01Å
270V97.7Very high97.9Very high42 Ų4248.8 Ų48.826%0.25524%0.241SC..Hα-helixtrans-62.3-41.3175.1177.50000110.7N268 N274 Y311N268-V270 VanDerWaalsContact C-N 3.28Å; N268-V270 PolarHBondContact O-N 3Å; N268-V270 WeakPolarHBondContact OD1-CB 3.3Å; N268-V270 PolarHBondContact OD1-N 3.49Å; V270-N274 WeakPolarHBondContact O-CB 3.22Å; V270-N274 PolarHBondContact O-N 3.26Å; V270-N274 PolarHBondContact O-ND2 3.16Å; V270-Y311 HydrophobicContact CG1-CD1 3.73Å; V270-Y311 HydrophobicContact CG1-CE1 3.73Å; V270-Y311 HydrophobicContact CG1-CG 4.5Å
271H98.6Very high97.9Very high4 Ų442.7 Ų42.72%0.01921%0.209CC..Hα-helixtrans-63.5-44.6174.1-58.4163.8000110.7S258 E262 N268 M269 A275 V308S258-H271 WeakPolarHBondContact CB-ND1 3.4Å; S258-H271 PolarHBondContact OG-ND1 2.83Å; E262-H271 IonicContact OE1-CE1 2.67Å; N268-H271 WeakPolarHBondContact O-CB 3.26Å; N268-H271 PolarHBondContact O-N 3.15Å; N268-H271 VanDerWaalsContact O-N 3.12Å; M269-H271 VanDerWaalsContact C-N 3.3Å; M269-H271 PolarHBondContact O-N 3.07Å; H271-A275 WeakPolarHBondContact O-CA 3.35Å; H271-A275 WeakPolarHBondContact O-CB 3.22Å; H271-A275 PolarHBondContact O-N 3.28Å; H271-V308 HydrophobicContact CB-CG2 4.22Å
272I98.6Very high97.9Very high10 Ų1041.2 Ų41.25%0.05120%0.2CC..Hα-helixtrans-69.7-40.8-175.7-57.8-39.7000112.1M212 F255 N268 M269 N274 T276M212-I272 HydrophobicContact CE-CG2 4.46Å; M212-I272 HydrophobicContact SD-CG2 4.22Å; F255-I272 HydrophobicContact CD1-CD1 3.86Å; F255-I272 HydrophobicContact CD2-CD1 3.65Å; F255-I272 HydrophobicContact CE1-CD1 3.85Å; F255-I272 HydrophobicContact CE1-CG1 4.18Å; F255-I272 HydrophobicContact CE1-CG2 4.43Å; F255-I272 HydrophobicContact CE2-CB 4.48Å; F255-I272 HydrophobicContact CE2-CD1 3.65Å; F255-I272 HydrophobicContact CE2-CG1 4.25Å; F255-I272 HydrophobicContact CE2-CG2 3.68Å; F255-I272 HydrophobicContact CG-CD1 3.77Å; F255-I272 HydrophobicContact CZ-CB 4.37Å; F255-I272 HydrophobicContact CZ-CD1 3.75Å; F255-I272 HydrophobicContact CZ-CG1 3.97Å; F255-I272 HydrophobicContact CZ-CG2 3.49Å; F255-I272 VanDerWaalsContact CZ-CG2 3.49Å; N268-I272 WeakPolarHBondContact O-CG1 3.26Å; N268-I272 PolarHBondContact O-N 3.27Å; M269-I272 PolarHBondContact O-N 2.8Å; M269-I272 VanDerWaalsContact O-N 3.14Å; I272-N274 VanDerWaalsContact C-N 3.32Å; I272-N274 PolarHBondContact O-N 3.34Å; I272-T276 HydrophobicContact CG2-CG2 4.43Å; I272-T276 WeakPolarHBondContact O-CB 3.45Å; I272-T276 WeakPolarHBondContact O-CG2 3.38Å; I272-T276 PolarHBondContact O-OG1 2.62Å
273Q98.7Very high98Very high1 Ų139.1 Ų39.11%0.00519%0.191CC..Hα-helixtrans-67.6-34179.9-73157.8-4.300112.3L68 D208 A211 M212 T215 M269 L277L68-Q273 HydrophobicContact CD1-CB 4.09Å; D208-Q273 VanDerWaalsContact CA-NE2 3.29Å; D208-Q273 PolarHBondContact O-NE2 3.23Å; D208-Q273 PolarHBondContact OD1-NE2 2.59Å; A211-Q273 HydrophobicContact CB-CG 4.3Å; M212-Q273 HydrophobicContact CG-CG 4.01Å; M212-Q273 HydrophobicContact SD-CB 4.29Å; M212-Q273 HydrophobicContact SD-CG 3.45Å; M212-Q273 WeakPolarHBondContact SD-CG 3.47Å; T215-Q273 WeakPolarHBondContact CB-O 3.26Å; T215-Q273 WeakPolarHBondContact CG2-O 3.45Å; T215-Q273 WeakPolarHBondContact OG1-CA 3.41Å; T215-Q273 WeakPolarHBondContact OG1-CB 3.41Å; T215-Q273 PolarHBondContact OG1-O 2.89Å; M269-Q273 HydrophobicContact CE-CG 4.09Å; M269-Q273 WeakPolarHBondContact O-CB 3.4Å; M269-Q273 VanDerWaalsContact O-CG 3.23Å; M269-Q273 WeakPolarHBondContact O-CG 3.48Å; M269-Q273 PolarHBondContact O-N 2.95Å; M269-Q273 PolarHBondContact O-OE1 3.01Å; Q273-L277 WeakPolarHBondContact O-CD1 3.33Å
274N98.7Very high98.3Very high11 Ų1132.4 Ų32.46%0.05916%0.159CC..Hα-helixtrans-111.3-56.9-170.7-61.4-81.6000112.8V270 I272 T276 L277 Y311 L333V270-N274 WeakPolarHBondContact O-CB 3.22Å; V270-N274 PolarHBondContact O-N 3.26Å; V270-N274 PolarHBondContact O-ND2 3.16Å; I272-N274 VanDerWaalsContact C-N 3.32Å; I272-N274 PolarHBondContact O-N 3.34Å; N274-T276 PolarHBondContact O-N 2.9Å; N274-T276 VanDerWaalsContact O-N 3.09Å; N274-L277 VanDerWaalsContact O-CB 3.26Å; N274-L277 WeakPolarHBondContact O-CB 3.35Å; N274-L277 PolarHBondContact O-N 3.41Å; N274-Y311 HydrophobicContact CB-CE2 3.8Å; N274-Y311 WeakPolarHBondContact CB-OH 3.4Å; N274-L333 HydrophobicContact CB-CD2 4.25Å; N274-L333 WeakPolarHBondContact O-CD1 3.27Å
275A98.8Very high98.4Very high0 Ų022.3 Ų22.30%012%0.121CC..G310 helixtrans-64.3-22.4-171.300000113.6C250 A254 H271 L277 A278 S307 V308C250-A275 PolarHBondContact SG-O 2.86Å; A254-A275 HydrophobicContact CB-CB 4.09Å; H271-A275 WeakPolarHBondContact O-CA 3.35Å; H271-A275 WeakPolarHBondContact O-CB 3.22Å; H271-A275 PolarHBondContact O-N 3.28Å; A275-L277 PolarHBondContact O-N 3.3Å; A275-A278 VanDerWaalsContact O-CB 3.32Å; A275-A278 WeakPolarHBondContact O-CB 3.42Å; A275-A278 PolarHBondContact O-N 3.37Å; A275-S307 WeakPolarHBondContact CA-OG 3.4Å; A275-S307 WeakPolarHBondContact CB-OG 3.33Å; A275-V308 HydrophobicContact CB-CG2 3.61Å
276T98.9Very high98.5Very high6 Ų620.5 Ų20.54%0.03710%0.102CC..G310 helixtrans-65.1-19.6173.9560000113.5V251 A254 F255 I272 N274V251-T276 HydrophobicContact CG1-CG2 4.5Å; V251-T276 HydrophobicContact CG2-CG2 4.18Å; A254-T276 HydrophobicContact CB-CG2 4Å; F255-T276 HydrophobicContact CD2-CG2 4.26Å; F255-T276 HydrophobicContact CE2-CG2 4.03Å; I272-T276 HydrophobicContact CG2-CG2 4.43Å; I272-T276 WeakPolarHBondContact O-CB 3.45Å; I272-T276 WeakPolarHBondContact O-CG2 3.38Å; I272-T276 PolarHBondContact O-OG1 2.62Å; N274-T276 PolarHBondContact O-N 2.9Å; N274-T276 VanDerWaalsContact O-N 3.09Å
277L98.9Very high98.6Very high0 Ų013.7 Ų13.70%07%0.073CC..G310 helixtrans-89.5-15.2179.4-57.9175.9000112.9L68 T215 L218 W219 W222 Q273 N274 A275 G279 G280 L333L68-L277 HydrophobicContact CD2-CD1 4.24Å; T215-L277 HydrophobicContact CG2-CD1 4.41Å; T215-L277 HydrophobicContact CG2-CD2 4.11Å; T215-L277 HydrophobicContact CG2-CG 4.27Å; T215-L277 WeakPolarHBondContact O-CD2 3.31Å; L218-L277 HydrophobicContact CB-CD1 4.14Å; L218-L277 HydrophobicContact CB-CD2 3.99Å; L218-L277 HydrophobicContact CD1-CD1 3.77Å; W219-L277 HydrophobicContact CB-CD2 3.68Å; W219-L277 HydrophobicContact CG-CD2 4.33Å; W222-L277 HydrophobicContact CE3-CB 4.33Å; W222-L277 HydrophobicContact CE3-CD2 4.08Å; W222-L277 HydrophobicContact CH2-CB 4.01Å; W222-L277 HydrophobicContact CZ3-CB 3.55Å; W222-L277 HydrophobicContact CZ3-CD1 4.06Å; W222-L277 HydrophobicContact CZ3-CD2 3.81Å; W222-L277 HydrophobicContact CZ3-CG 4Å; Q273-L277 WeakPolarHBondContact O-CD1 3.33Å; N274-L277 VanDerWaalsContact O-CB 3.26Å; N274-L277 WeakPolarHBondContact O-CB 3.35Å; N274-L277 PolarHBondContact O-N 3.41Å; A275-L277 PolarHBondContact O-N 3.3Å; L277-G279 PolarHBondContact O-N 3Å; L277-G279 VanDerWaalsContact O-N 3.11Å; L277-G280 PolarHBondContact O-N 3.41Å; L277-L333 HydrophobicContact CB-CD1 3.62Å; L277-L333 HydrophobicContact CB-CD2 4.39Å; L277-L333 HydrophobicContact CD1-CD2 4.18Å
278A98.9Very high98.5Very high0 Ų010.2 Ų10.20%06%0.055CC..Hα-helixtrans-59.5-28.5-173.600000113.5A275 G280 V281 A282 A303 L333 P337A275-A278 VanDerWaalsContact O-CB 3.32Å; A275-A278 WeakPolarHBondContact O-CB 3.42Å; A275-A278 PolarHBondContact O-N 3.37Å; A278-G280 VanDerWaalsContact C-N 3.34Å; A278-V281 PolarHBondContact O-N 2.88Å; A278-A282 VanDerWaalsContact O-CB 3.31Å; A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 3.5Å; A278-A303 HydrophobicContact CB-CB 3.96Å; A278-A303 WeakPolarHBondContact O-CB 3.37Å; A278-L333 HydrophobicContact CB-CD1 4.23Å; A278-P337 HydrophobicContact CB-CB 4.08Å; A278-P337 HydrophobicContact CB-CG 3.67Å
279G98.9Very high98.5Very high0 Ų08 Ų80%04%0.042CC..Hα-helixtrans-66.9-33.2176.500000113.5S246 C250 L277 V283S246-G279 VanDerWaalsContact OG-C 3.27Å; S246-G279 WeakPolarHBondContact OG-CA 3.45Å; S246-G279 PolarHBondContact OG-O 3.46Å; C250-G279 PolarHBondContact SG-N 2.85Å; L277-G279 PolarHBondContact O-N 3Å; L277-G279 VanDerWaalsContact O-N 3.11Å; G279-V283 VanDerWaalsContact O-CG1 3.27Å; G279-V283 WeakPolarHBondContact O-CG1 3.21Å; G279-V283 PolarHBondContact O-N 3.22Å
280G98.8Very high98.4Very high0 Ų07.4 Ų7.40%05%0.049CC..Hα-helixtrans-66.8-43.3174.800000111.3W222 N226 L247 L277 A278W222-G280 VanDerWaalsContact NE1-C 3.31Å; W222-G280 PolarHBondContact NE1-O 3.33Å; N226-G280 PolarHBondContact ND2-O 3.02Å; L247-G280 VanDerWaalsContact CD2-N 3.31Å; L277-G280 PolarHBondContact O-N 3.41Å; A278-G280 VanDerWaalsContact C-N 3.34Å
281V98.9Very high98.4Very high0 Ų06.6 Ų6.60%04%0.043CC..Hα-helixtrans-61.6-51.2172.61770000111.1S171 H175 W222 A278 V283 G284 L333 P337S171-V281 WeakPolarHBondContact CB-O 3.32Å; S171-V281 PolarHBondContact OG-O 3.12Å; H175-V281 HydrophobicContact CB-CG1 3.58Å; W222-V281 HydrophobicContact CH2-CG2 3.88Å; W222-V281 HydrophobicContact CZ2-CB 4.5Å; W222-V281 HydrophobicContact CZ2-CG2 3.44Å; W222-V281 VanDerWaalsContact CZ2-CG2 3.44Å; A278-V281 PolarHBondContact O-N 2.88Å; V281-V283 PolarHBondContact O-N 3.13Å; V281-G284 PolarHBondContact O-N 3.48Å; V281-L333 HydrophobicContact CG2-CD1 4.27Å; V281-P337 HydrophobicContact CB-CB 3.96Å; V281-P337 HydrophobicContact CG1-CB 3.79Å
282A98.9Very high98.2Very high0 Ų012.5 Ų12.50%07%0.07CC..Hα-helixtrans-72.2-23.6-169.300000114.5A278 I299 A303 P337 V340 G341A278-A282 VanDerWaalsContact O-CB 3.31Å; A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 3.5Å; A282-I299 HydrophobicContact CB-CG2 3.73Å; A282-I299 WeakPolarHBondContact O-CG2 3.18Å; A282-A303 HydrophobicContact CB-CB 3.47Å; A282-A303 VanDerWaalsContact CB-CB 3.47Å; A282-P337 WeakPolarHBondContact CA-O 3.29Å; A282-P337 HydrophobicContact CB-CB 4.15Å; A282-V340 HydrophobicContact CB-CB 4.4Å; A282-V340 HydrophobicContact CB-CG1 4.09Å; A282-G341 WeakPolarHBondContact O-CA 3.26Å
283V98.9Very high98.1Very high0 Ų014.9 Ų14.90%09%0.086CC..Hα-helixtrans-87.5-15.3176.9730000112.6N242 T243 G279 V281 T285 C286 A287 I291 I299N242-V283 HydrophobicContact CB-CG2 4.17Å; T243-V283 HydrophobicContact CG2-CG1 4.39Å; G279-V283 VanDerWaalsContact O-CG1 3.27Å; G279-V283 WeakPolarHBondContact O-CG1 3.21Å; G279-V283 PolarHBondContact O-N 3.22Å; V281-V283 PolarHBondContact O-N 3.13Å; V283-T285 PolarHBondContact O-N 3.47Å; V283-C286 CarbonylContact O-C 3.46Å; V283-C286 PolarHBondContact O-N 2.92Å; V283-C286 PolarHBondContact O-SG 3.45Å; V283-C286 VanDerWaalsContact O-SG 3.38Å; V283-A287 WeakPolarHBondContact O-CA 3.43Å; V283-A287 PolarHBondContact O-N 3.39Å; V283-I291 HydrophobicContact CG2-CD1 4.38Å; V283-I299 HydrophobicContact CB-CG2 4.34Å
284G98.7Very high98Very high0 Ų021.1 Ų21.10%011%0.113CC..G310 helixtrans-47.8-52.1-169.200000114.5I168 G169 S171 V281 C286 A287I168-G284 VanDerWaalsContact CG2-O 3.29Å; I168-G284 WeakPolarHBondContact CG2-O 3.45Å; G169-G284 WeakPolarHBondContact CA-O 3.35Å; G169-G284 PolarHBondContact N-O 2.81Å; S171-G284 VanDerWaalsContact OG-CA 3.22Å; S171-G284 WeakPolarHBondContact OG-CA 3.26Å; S171-G284 PolarHBondContact OG-N 3.23Å; V281-G284 PolarHBondContact O-N 3.48Å; G284-C286 VanDerWaalsContact C-N 3.27Å; G284-C286 PolarHBondContact O-N 3.38Å; G284-A287 PolarHBondContact O-N 3.48Å
285T98.5Very high98Very high0 Ų021.4 Ų21.40%012%0.119CC..G310 helixtrans-57.3-39.1-178.8-59.30000113.3S166 D167 S171 M172 V283 M289 G341S166-T285 WeakPolarHBondContact O-CG2 3.36Å; D167-T285 VanDerWaalsContact OD1-CA 3.27Å; D167-T285 WeakPolarHBondContact OD1-CA 3.29Å; D167-T285 WeakPolarHBondContact OD1-CB 3.44Å; D167-T285 PolarHBondContact OD1-OG1 3.39Å; S171-T285 WeakPolarHBondContact CB-OG1 3.2Å; S171-T285 PolarHBondContact OG-N 3.49Å; S171-T285 PolarHBondContact OG-OG1 3.32Å; M172-T285 HydrophobicContact CE-CG2 3.99Å; V283-T285 PolarHBondContact O-N 3.47Å; T285-M289 WeakPolarHBondContact O-CE 2.92Å; T285-G341 WeakPolarHBondContact CB-O 3.38Å
286C97.8Very high98Very high0 Ų021.4 Ų21.40%012%0.119CC..G310 helixtrans-107.212.8-175.461.40000113.8V283 G284 D288 M289 A348V283-C286 CarbonylContact O-C 3.46Å; V283-C286 PolarHBondContact O-N 2.92Å; V283-C286 PolarHBondContact O-SG 3.45Å; V283-C286 VanDerWaalsContact O-SG 3.38Å; G284-C286 VanDerWaalsContact C-N 3.27Å; G284-C286 PolarHBondContact O-N 3.38Å; C286-D288 VanDerWaalsContact C-N 3.29Å; C286-D288 PolarHBondContact O-N 3.29Å; C286-M289 HydrophobicContact CB-CB 4.31Å; C286-M289 HydrophobicContact CB-CG 4.23Å; C286-M289 HydrophobicContact CB-SD 3.79Å; C286-M289 WeakPolarHBondContact O-CB 3.34Å; C286-M289 PolarHBondContact O-N 3.03Å; C286-M289 VanDerWaalsContact O-N 3.12Å; C286-A348 HydrophobicContact CB-CB 4.11Å
287A98.4Very high98Very high0 Ų025.3 Ų25.30%014%0.138CC..THydrogen-bonded Turntrans-60.6-40.5-171.300000111.6I168 N226 R238 A239 N242 V283 G284I168-A287 HydrophobicContact CG2-CB 3.86Å; N226-A287 HydrophobicContact CB-CB 4.23Å; R238-A287 CarbonylContact C-O 3.49Å; A239-A287 WeakPolarHBondContact CA-O 3.22Å; A239-A287 HydrophobicContact CB-CB 3.99Å; A239-A287 PolarHBondContact N-O 2.93Å; N242-A287 PolarHBondContact ND2-O 2.82Å; V283-A287 WeakPolarHBondContact O-CA 3.43Å; V283-A287 PolarHBondContact O-N 3.39Å; G284-A287 PolarHBondContact O-N 3.48Å
288D97.6Very high98Very high21 Ų2129.5 Ų29.511%0.11216%0.159CC..THydrogen-bonded Turntrans-89.6-3.6178.773.3-29.3000114.3I168 K235 A239 C286I168-D288 HydrophobicContact CB-CB 4.37Å; I168-D288 HydrophobicContact CG1-CB 4.34Å; I168-D288 HydrophobicContact CG2-CB 3.84Å; I168-D288 VanDerWaalsContact CG2-OD1 3.32Å; I168-D288 WeakPolarHBondContact CG2-OD1 3.5Å; K235-D288 HydrophobicContact CB-CB 4.11Å; A239-D288 HydrophobicContact CB-CB 4.27Å; C286-D288 VanDerWaalsContact C-N 3.29Å; C286-D288 PolarHBondContact O-N 3.29Å
289M97.6Very high98Very high5 Ų530.5 Ų30.53%0.02517%0.165CC..SBendtrans-76.7156177.6-62.1-175.3-172.400111.2S166 R238 T285 C286 I291 A348 V349 A353S166-M289 VanDerWaalsContact OG-CE 3.31Å; S166-M289 WeakPolarHBondContact OG-CE 3.31Å; R238-M289 WeakPolarHBondContact CD-O 3.38Å; T285-M289 WeakPolarHBondContact O-CE 2.92Å; C286-M289 HydrophobicContact CB-CB 4.31Å; C286-M289 HydrophobicContact CB-CG 4.23Å; C286-M289 HydrophobicContact CB-SD 3.79Å; C286-M289 WeakPolarHBondContact O-CB 3.34Å; C286-M289 PolarHBondContact O-N 3.03Å; C286-M289 VanDerWaalsContact O-N 3.12Å; M289-I291 HydrophobicContact CB-CG2 4.48Å; M289-I291 PolarHBondContact O-N 3.02Å; M289-A348 HydrophobicContact SD-CB 3.72Å; M289-V349 HydrophobicContact CE-CG2 4.1Å; M289-V349 HydrophobicContact SD-CG2 4.17Å; M289-A353 HydrophobicContact CB-CB 4.13Å
290A95.9Very high98Very high56 Ų5630.5 Ų30.546%0.46317%0.165SC..SBendtrans-72.543.4-178.200000114.4A353A290-A353 HydrophobicContact CB-CB 4.4Å; A290-A353 PolarHBondContact N-O 3.38Å; A290-A353 VanDerWaalsContact N-O 3.08Å
291I96.8Very high98Very high25 Ų2532.4 Ų32.413%0.12818%0.178CC..  trans-73.5148.2168.666.1173000110.2N242 V283 M289 I299 A348 A353N242-I291 VanDerWaalsContact ND2-CG1 3.29Å; N242-I291 WeakPolarHBondContact ND2-CG1 3.35Å; V283-I291 HydrophobicContact CG2-CD1 4.38Å; M289-I291 HydrophobicContact CB-CG2 4.48Å; M289-I291 PolarHBondContact O-N 3.02Å; I291-I299 HydrophobicContact CD1-CD1 4.23Å; I291-A348 HydrophobicContact CG2-CB 3.72Å; I291-A353 HydrophobicContact CG2-CB 4.22Å
292H95.5Very high98Very high127 Ų12735.9 Ų35.959%0.58820%0.196SC*.  trans-74.4152.1172.7-70.4-72.8000111.1F294 G295 S296H292-F294 VanDerWaalsContact C-N 3.25Å; H292-F294 HydrophobicContact CB-CD1 3.48Å; H292-F294 VanDerWaalsContact CB-CD1 3.48Å; H292-F294 HydrophobicContact CB-CE1 3.31Å; H292-F294 HydrophobicContact CB-CG 4.46Å; H292-F294 HydrophobicContact CB-CZ 4.17Å; H292-F294 AromaticContact CD2-CE1 3.9Å; H292-F294 AromaticContact CG-CE1 3.73Å; H292-F294 PolarHBondContact O-N 2.98Å; H292-G295 WeakPolarHBondContact O-CA 3.43Å; H292-G295 PolarHBondContact O-N 2.95Å; H292-S296 PolarHBondContact O-N 3.45Å
293P96.1Very high98Very high61 Ų6135.9 Ų35.940%0.39620%0.196SC..Hα-helixtrans-56.9-32.7178.8-28.435.7000114.6F245 G295 S296 M297F245-P293 HydrophobicContact CD2-CB 4.39Å; P293-G295 PolarHBondContact O-N 3.24Å; P293-S296 PolarHBondContact O-N 2.98Å; P293-S296 PolarHBondContact O-OG 3.23Å; P293-M297 WeakPolarHBondContact O-CG 3.42Å; P293-M297 PolarHBondContact O-N 3.49Å; P293-M297 VanDerWaalsContact O-N 3.13Å
294F97.8Very high98Very high131 Ų13135.9 Ų35.958%0.57520%0.196SC*.Hα-helixtrans-66-28.617477.2-95.9000112H292 M297 I298H292-F294 VanDerWaalsContact C-N 3.25Å; H292-F294 HydrophobicContact CB-CD1 3.48Å; H292-F294 VanDerWaalsContact CB-CD1 3.48Å; H292-F294 HydrophobicContact CB-CE1 3.31Å; H292-F294 HydrophobicContact CB-CG 4.46Å; H292-F294 HydrophobicContact CB-CZ 4.17Å; H292-F294 AromaticContact CD2-CE1 3.9Å; H292-F294 AromaticContact CG-CE1 3.73Å; H292-F294 PolarHBondContact O-N 2.98Å; F294-M297 PolarHBondContact O-N 3.23Å; F294-I298 HydrophobicContact CD2-CD1 3.84Å; F294-I298 HydrophobicContact CE2-CD1 4.23Å; F294-I298 VanDerWaalsContact O-CG1 3.31Å; F294-I298 WeakPolarHBondContact O-CG1 3.3Å; F294-I298 PolarHBondContact O-N 3.23Å
295G98.3Very high98Very high17 Ų1738.8 Ų38.818%0.17521%0.21CC..Hα-helixtrans-65.6-43.317500000111.8H292 P293 M297 I298 I299H292-G295 WeakPolarHBondContact O-CA 3.43Å; H292-G295 PolarHBondContact O-N 2.95Å; P293-G295 PolarHBondContact O-N 3.24Å; G295-M297 VanDerWaalsContact C-N 3.34Å; G295-M297 PolarHBondContact O-N 2.92Å; G295-I298 PolarHBondContact O-N 3.48Å; G295-I299 WeakPolarHBondContact O-CG1 3.31Å; G295-I299 PolarHBondContact O-N 3.27Å
296S98.6Very high98Very high0 Ų040.6 Ų40.60%022%0.221CC..Hα-helixtrans-66.2-36.3174.759.80000112.2N242 S246 H292 P293 I298 I299 G300N242-S296 WeakPolarHBondContact O-CB 3.26Å; N242-S296 PolarHBondContact O-OG 2.7Å; N242-S296 PolarHBondContact OD1-OG 2.76Å; S246-S296 WeakPolarHBondContact CA-O 3.31Å; S246-S296 WeakPolarHBondContact CB-O 3.36Å; S246-S296 PolarHBondContact OG-O 3.24Å; H292-S296 PolarHBondContact O-N 3.45Å; P293-S296 PolarHBondContact O-N 2.98Å; P293-S296 PolarHBondContact O-OG 3.23Å; S296-I298 VanDerWaalsContact C-N 3.35Å; S296-I298 PolarHBondContact O-N 3.49Å; S296-I299 PolarHBondContact O-N 3.42Å; S296-G300 PolarHBondContact O-N 2.9Å
297M98.9Very high98.1Very high88 Ų8840.6 Ų40.643%0.43322%0.221SC..Hα-helixtrans-61.7-39.9171.4-64.9175.371.300112.8F245 A249 P293 F294 G295 S301F245-M297 HydrophobicContact CB-CG 3.89Å; A249-M297 HydrophobicContact CB-CB 4.01Å; A249-M297 HydrophobicContact CB-CG 4.4Å; A249-M297 WeakPolarHBondContact CB-O 3.43Å; P293-M297 WeakPolarHBondContact O-CG 3.42Å; P293-M297 PolarHBondContact O-N 3.49Å; P293-M297 VanDerWaalsContact O-N 3.13Å; F294-M297 PolarHBondContact O-N 3.23Å; G295-M297 VanDerWaalsContact C-N 3.34Å; G295-M297 PolarHBondContact O-N 2.92Å; M297-S301 WeakPolarHBondContact O-CB 3.23Å; M297-S301 PolarHBondContact O-N 3.38Å; M297-S301 PolarHBondContact O-OG 3.4Å
298I98.8Very high98.1Very high88 Ų8840.6 Ų40.645%0.45122%0.221SC..Hα-helixtrans-63.7-47176-70.9165.5000110.3F294 G295 S296 G300 S301 I302F294-I298 HydrophobicContact CD2-CD1 3.84Å; F294-I298 HydrophobicContact CE2-CD1 4.23Å; F294-I298 VanDerWaalsContact O-CG1 3.31Å; F294-I298 WeakPolarHBondContact O-CG1 3.3Å; F294-I298 PolarHBondContact O-N 3.23Å; G295-I298 PolarHBondContact O-N 3.48Å; S296-I298 VanDerWaalsContact C-N 3.35Å; S296-I298 PolarHBondContact O-N 3.49Å; I298-G300 PolarHBondContact O-N 3.37Å; I298-S301 WeakPolarHBondContact O-CB 3.49Å; I298-S301 PolarHBondContact O-N 3.02Å; I298-I302 HydrophobicContact CG2-CD1 3.77Å; I298-I302 HydrophobicContact CG2-CG1 4.47Å; I298-I302 WeakPolarHBondContact O-CG1 3.38Å; I298-I302 PolarHBondContact O-N 3.09Å
299I98.9Very high98.1Very high22 Ų2242.4 Ų42.411%0.11323%0.23CC..Hα-helixtrans-57.2-50.4177.5-67.4164.2000110.3A282 V283 I291 G295 S296 S301 I302 A303 A344A282-I299 HydrophobicContact CB-CG2 3.73Å; A282-I299 WeakPolarHBondContact O-CG2 3.18Å; V283-I299 HydrophobicContact CB-CG2 4.34Å; I291-I299 HydrophobicContact CD1-CD1 4.23Å; G295-I299 WeakPolarHBondContact O-CG1 3.31Å; G295-I299 PolarHBondContact O-N 3.27Å; S296-I299 PolarHBondContact O-N 3.42Å; I299-S301 PolarHBondContact O-N 3.41Å; I299-I302 PolarHBondContact O-N 3.48Å; I299-A303 WeakPolarHBondContact O-CB 3.34Å; I299-A303 PolarHBondContact O-N 3.41Å; I299-A344 HydrophobicContact CD1-CB 3.82Å; I299-A344 HydrophobicContact CG1-CB 4.08Å
300G98.9Very high98.2Very high0 Ų042.1 Ų42.10%023%0.229CC..Hα-helixtrans-60.4-41.3177.800000113.6S246 C250 S296 I298 A303 G304S246-G300 WeakPolarHBondContact O-CA 3.34Å; S246-G300 WeakPolarHBondContact OG-CA 3.39Å; S246-G300 PolarHBondContact OG-N 3.19Å; C250-G300 VanDerWaalsContact CA-O 3.3Å; C250-G300 WeakPolarHBondContact CA-O 3.38Å; C250-G300 WeakPolarHBondContact CB-O 3.34Å; S296-G300 PolarHBondContact O-N 2.9Å; I298-G300 PolarHBondContact O-N 3.37Å; G300-A303 PolarHBondContact O-N 2.7Å; G300-G304 PolarHBondContact O-N 2.95Å
301S98.9Very high98.3Very high40 Ų4040.5 Ų40.528%0.2821%0.211SC..Hα-helixtrans-61.4-44.5176.1-60.50000112.5T253 M297 I298 I299 M305T253-S301 PolarHBondContact OG1-O 2.99Å; M297-S301 WeakPolarHBondContact O-CB 3.23Å; M297-S301 PolarHBondContact O-N 3.38Å; M297-S301 PolarHBondContact O-OG 3.4Å; I298-S301 WeakPolarHBondContact O-CB 3.49Å; I298-S301 PolarHBondContact O-N 3.02Å; I299-S301 PolarHBondContact O-N 3.41Å; S301-M305 PolarHBondContact O-N 3.13Å
302I98.8Very high98.3Very high73 Ų7342.4 Ų42.437%0.37422%0.218SC..Hα-helixtrans-64.5-44.1177.3-68.8168.1000109.8I298 I299 M305 V306 V340I298-I302 HydrophobicContact CG2-CD1 3.77Å; I298-I302 HydrophobicContact CG2-CG1 4.47Å; I298-I302 WeakPolarHBondContact O-CG1 3.38Å; I298-I302 PolarHBondContact O-N 3.09Å; I299-I302 PolarHBondContact O-N 3.48Å; I302-M305 PolarHBondContact O-N 2.92Å; I302-V306 HydrophobicContact CG2-CG2 4.13Å; I302-V306 WeakPolarHBondContact O-CB 3.34Å; I302-V306 VanDerWaalsContact O-CG2 3.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.41Å; I302-V306 PolarHBondContact O-N 3.18Å; I302-V340 HydrophobicContact CG2-CG1 4.35Å
303A98.9Very high98.4Very high0 Ų042 Ų420%022%0.215CC..Hα-helixtrans-62.2-46.2-179.300000112.4A278 A282 I299 G300 M305 V306 S307 P337A278-A303 HydrophobicContact CB-CB 3.96Å; A278-A303 WeakPolarHBondContact O-CB 3.37Å; A282-A303 HydrophobicContact CB-CB 3.47Å; A282-A303 VanDerWaalsContact CB-CB 3.47Å; I299-A303 WeakPolarHBondContact O-CB 3.34Å; I299-A303 PolarHBondContact O-N 3.41Å; G300-A303 PolarHBondContact O-N 2.7Å; A303-M305 PolarHBondContact O-N 3.08Å; A303-V306 PolarHBondContact O-N 2.69Å; A303-S307 WeakPolarHBondContact O-CB 3.48Å; A303-S307 PolarHBondContact O-N 2.93Å; A303-P337 HydrophobicContact CB-CB 4.45Å
304G98.8Very high98.5Very high0 Ų042 Ų420%021%0.211CC..Hα-helixtrans-60.8-44.617700000112.4C250 G300 V308C250-G304 VanDerWaalsContact SG-CA 3.52Å; G300-G304 PolarHBondContact O-N 2.95Å; G304-V308 WeakPolarHBondContact O-CG2 3.38Å; G304-V308 PolarHBondContact O-N 3.35Å; G304-V308 VanDerWaalsContact O-N 3.13Å
305M98.7Very high98.4Very high60 Ų6037.1 Ų37.130%0.29619%0.193SC..Hα-helixtrans-59.9-54.9174.1173.4179.568.100112F257 S301 I302 A303 S307 V308 L309F257-M305 HydrophobicContact CD1-CG 3.83Å; F257-M305 HydrophobicContact CD2-CB 4.06Å; F257-M305 HydrophobicContact CD2-CG 4.14Å; F257-M305 HydrophobicContact CE1-CB 4.44Å; F257-M305 HydrophobicContact CE1-CG 3.51Å; F257-M305 HydrophobicContact CE1-SD 3.73Å; F257-M305 HydrophobicContact CE2-CB 3.98Å; F257-M305 HydrophobicContact CE2-CG 3.84Å; F257-M305 HydrophobicContact CE2-SD 4Å; F257-M305 HydrophobicContact CG-CB 4.33Å; F257-M305 HydrophobicContact CG-CG 4.14Å; F257-M305 HydrophobicContact CZ-CB 4.18Å; F257-M305 HydrophobicContact CZ-CG 3.52Å; F257-M305 HydrophobicContact CZ-SD 3.36Å; F257-M305 WeakPolarHBondContact CZ-SD 3.37Å; S301-M305 PolarHBondContact O-N 3.13Å; I302-M305 PolarHBondContact O-N 2.92Å; A303-M305 PolarHBondContact O-N 3.08Å; M305-S307 VanDerWaalsContact C-N 3.29Å; M305-S307 PolarHBondContact O-N 3.31Å; M305-V308 PolarHBondContact O-N 2.94Å; M305-L309 HydrophobicContact CG-CD1 3.87Å; M305-L309 HydrophobicContact CG-CG 4.46Å; M305-L309 VanDerWaalsContact O-CG 3.28Å; M305-L309 WeakPolarHBondContact O-CG 3.4Å; M305-L309 PolarHBondContact O-N 2.93Å
306V98.4Very high98.2Very high39 Ų3939.4 Ų39.424%0.23620%0.204CC..Hα-helixtrans-62.3-38.7-176.7170.30000111I302 A303 L309 G310 L336I302-V306 HydrophobicContact CG2-CG2 4.13Å; I302-V306 WeakPolarHBondContact O-CB 3.34Å; I302-V306 VanDerWaalsContact O-CG2 3.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.41Å; I302-V306 PolarHBondContact O-N 3.18Å; A303-V306 PolarHBondContact O-N 2.69Å; V306-L309 PolarHBondContact O-N 3.04Å; V306-G310 PolarHBondContact O-N 3.29Å; V306-L336 HydrophobicContact CG1-CB 3.96Å; V306-L336 HydrophobicContact CG1-CD1 4.03Å; V306-L336 HydrophobicContact CG1-CG 4.49Å
307S98.8Very high98Very high0 Ų043.1 Ų43.10%022%0.224CC..Hα-helixtrans-62.8-49.6177.8-170.60000111.7A275 A303 M305 L309 G310 Y311 N332A275-S307 WeakPolarHBondContact CA-OG 3.4Å; A275-S307 WeakPolarHBondContact CB-OG 3.33Å; A303-S307 WeakPolarHBondContact O-CB 3.48Å; A303-S307 PolarHBondContact O-N 2.93Å; M305-S307 VanDerWaalsContact C-N 3.29Å; M305-S307 PolarHBondContact O-N 3.31Å; S307-L309 PolarHBondContact O-N 3.26Å; S307-G310 WeakPolarHBondContact O-CA 3.26Å; S307-G310 PolarHBondContact O-N 3.45Å; S307-G310 VanDerWaalsContact O-N 3.11Å; S307-Y311 VanDerWaalsContact O-CD2 3.24Å; S307-Y311 WeakPolarHBondContact O-CD2 3.22Å; S307-Y311 PolarHBondContact O-N 3.35Å; S307-N332 WeakPolarHBondContact CA-O 3.49Å; S307-N332 WeakPolarHBondContact CB-O 3.27Å; S307-N332 PolarHBondContact OG-O 3.31Å
308V98.9Very high97.7Very high0 Ų040.6 Ų40.60%021%0.21CC..Hα-helixtrans-60.8-45177.2172.40000111.8A254 F257 V261 H271 A275 G304 M305 G310 Y311 K312A254-V308 HydrophobicContact CB-CG2 4.14Å; F257-V308 HydrophobicContact CB-CB 4.08Å; F257-V308 HydrophobicContact CB-CG1 3.93Å; F257-V308 HydrophobicContact CB-CG2 4.4Å; V261-V308 HydrophobicContact CG2-CG1 3.89Å; H271-V308 HydrophobicContact CB-CG2 4.22Å; A275-V308 HydrophobicContact CB-CG2 3.61Å; G304-V308 WeakPolarHBondContact O-CG2 3.38Å; G304-V308 PolarHBondContact O-N 3.35Å; G304-V308 VanDerWaalsContact O-N 3.13Å; M305-V308 PolarHBondContact O-N 2.94Å; V308-G310 PolarHBondContact O-N 3.03Å; V308-Y311 PolarHBondContact O-N 3.37Å; V308-K312 PolarHBondContact O-N 2.81Å
309L98.6Very high97.3Very high58 Ų5837.2 Ų37.230%0.30419%0.194SC..Hα-helixtrans-62.5-36176.5-65.1176.2000111.4F257 V261 M305 V306 S307 K312 F313F257-L309 HydrophobicContact CD1-CD2 4.39Å; V261-L309 HydrophobicContact CG1-CD2 4.02Å; M305-L309 HydrophobicContact CG-CD1 3.87Å; M305-L309 HydrophobicContact CG-CG 4.46Å; M305-L309 VanDerWaalsContact O-CG 3.28Å; M305-L309 WeakPolarHBondContact O-CG 3.4Å; M305-L309 PolarHBondContact O-N 2.93Å; V306-L309 PolarHBondContact O-N 3.04Å; S307-L309 PolarHBondContact O-N 3.26Å; L309-K312 PolarHBondContact O-N 3.46Å; L309-F313 HydrophobicContact CB-CD2 4.36Å; L309-F313 HydrophobicContact CD2-CD2 4.06Å; L309-F313 HydrophobicContact CD2-CE2 3.7Å; L309-F313 WeakPolarHBondContact O-CB 3.43Å; L309-F313 WeakPolarHBondContact O-CD2 3.42Å; L309-F313 PolarHBondContact O-N 3.32Å
310G98.5Very high96.9Very high0 Ų038.8 Ų38.80%021%0.205CC..Iπ-helixtrans-59.8-51.1172.900000112.4V306 S307 V308 K312 L314 T315 N332V306-G310 PolarHBondContact O-N 3.29Å; S307-G310 WeakPolarHBondContact O-CA 3.26Å; S307-G310 PolarHBondContact O-N 3.45Å; S307-G310 VanDerWaalsContact O-N 3.11Å; V308-G310 PolarHBondContact O-N 3.03Å; G310-K312 VanDerWaalsContact C-N 3.34Å; G310-K312 PolarHBondContact O-N 2.97Å; G310-L314 CarbonylContact O-C 3.59Å; G310-L314 WeakPolarHBondContact O-CA 3.44Å; G310-L314 WeakPolarHBondContact O-CB 3.37Å; G310-L314 PolarHBondContact O-N 2.89Å; G310-T315 PolarHBondContact O-N 3.37Å; G310-N332 VanDerWaalsContact CA-OD1 3.24Å; G310-N332 WeakPolarHBondContact CA-OD1 3.22Å; G310-N332 PolarHBondContact O-OD1 3.05Å
311Y98.3Very high96.6Very high21 Ų2146.4 Ų46.48%0.08224%0.238CC..Iπ-helixtrans-58.5-46.2176.1-82.8-74.7000112.1V270 N274 S307 V308 C328 G329 N332V270-Y311 HydrophobicContact CG1-CD1 3.73Å; V270-Y311 HydrophobicContact CG1-CE1 3.73Å; V270-Y311 HydrophobicContact CG1-CG 4.5Å; N274-Y311 HydrophobicContact CB-CE2 3.8Å; N274-Y311 WeakPolarHBondContact CB-OH 3.4Å; S307-Y311 VanDerWaalsContact O-CD2 3.24Å; S307-Y311 WeakPolarHBondContact O-CD2 3.22Å; S307-Y311 PolarHBondContact O-N 3.35Å; V308-Y311 PolarHBondContact O-N 3.37Å; Y311-C328 PolarHBondContact OH-O 3.36Å; Y311-G329 PolarHBondContact OH-O 3.47Å; Y311-N332 WeakPolarHBondContact CA-ND2 3.35Å; Y311-N332 HydrophobicContact CD1-CB 4.48Å; Y311-N332 WeakPolarHBondContact CD1-ND2 3.44Å; Y311-N332 HydrophobicContact CD2-CB 3.58Å; Y311-N332 HydrophobicContact CE1-CB 4.43Å; Y311-N332 HydrophobicContact CE2-CB 3.5Å; Y311-N332 VanDerWaalsContact CE2-CB 3.5Å; Y311-N332 HydrophobicContact CG-CB 4.06Å; Y311-N332 PolarHBondContact N-ND2 2.9Å
312K97.8Very high96.4Very high65 Ų6549 Ų4928%0.28325%0.248SC..Iπ-helixtrans-70.2-40.7-175.3-172.562165.6-167.50113.4V261 E262 V308 L309 G310V261-K312 HydrophobicContact CB-CG 4.07Å; V261-K312 HydrophobicContact CG2-CB 4.12Å; V261-K312 HydrophobicContact CG2-CD 4.24Å; V261-K312 HydrophobicContact CG2-CG 3.98Å; V261-K312 WeakPolarHBondContact O-CE 3.38Å; V261-K312 PolarHBondContact O-NZ 3.43Å; E262-K312 IonicContact OE1-NZ 3.54Å; E262-K312 PolarHBondContact OE1-NZ 3.32Å; E262-K312 IonicContact OE2-NZ 3.81Å; E262-K312 PolarHBondContact OE2-NZ 2.72Å; E262-K312 VanDerWaalsContact OE2-NZ 3.17Å; V308-K312 PolarHBondContact O-N 2.81Å; L309-K312 PolarHBondContact O-N 3.46Å; G310-K312 VanDerWaalsContact C-N 3.34Å; G310-K312 PolarHBondContact O-N 2.97Å
313F97.1Very high96.3Very high119 Ų11953.4 Ų53.452%0.52226%0.26SS..Iπ-helixtrans-118.3-37.1-166.6-57-65.9000113.9V261 L309 L317V261-F313 HydrophobicContact CG1-CE2 4.18Å; V261-F313 HydrophobicContact CG1-CZ 4.44Å; L309-F313 HydrophobicContact CB-CD2 4.36Å; L309-F313 HydrophobicContact CD2-CD2 4.06Å; L309-F313 HydrophobicContact CD2-CE2 3.7Å; L309-F313 WeakPolarHBondContact O-CB 3.43Å; L309-F313 WeakPolarHBondContact O-CD2 3.42Å; L309-F313 PolarHBondContact O-N 3.32Å; F313-L317 WeakPolarHBondContact O-CB 3.29Å
314L97Very high96.2Very high60 Ų6055 Ų5531%0.31427%0.268SS..Iπ-helixtrans-85-42.2-174.9-60.3179.2000112.7G310 L317 F318 L336G310-L314 CarbonylContact O-C 3.59Å; G310-L314 WeakPolarHBondContact O-CA 3.44Å; G310-L314 WeakPolarHBondContact O-CB 3.37Å; G310-L314 PolarHBondContact O-N 2.89Å; L314-L317 WeakPolarHBondContact O-CA 3.47Å; L314-L317 WeakPolarHBondContact O-CB 3.35Å; L314-L317 PolarHBondContact O-N 3.32Å; L314-F318 HydrophobicContact CB-CD2 4.48Å; L314-F318 HydrophobicContact CB-CE2 4.49Å; L314-F318 VanDerWaalsContact O-CD2 3.29Å; L314-F318 WeakPolarHBondContact O-CD2 3.25Å; L314-F318 PolarHBondContact O-N 2.81Å; L314-L336 HydrophobicContact CD1-CD1 3.67Å
315T96Very high96.1Very high30 Ų3055.5 Ų55.518%0.18427%0.27CS..Hα-helixtrans-54.6-47.5176.2-74.10000112.9G310 L317 F318 T319 N332G310-T315 PolarHBondContact O-N 3.37Å; T315-L317 VanDerWaalsContact C-N 3.32Å; T315-L317 PolarHBondContact O-N 3.02Å; T315-F318 PolarHBondContact O-N 3.4Å; T315-T319 PolarHBondContact O-N 2.95Å; T315-T319 VanDerWaalsContact O-N 3.1Å; T315-T319 PolarHBondContact O-OG1 3.45Å; T315-N332 PolarHBondContact OG1-ND2 2.96Å
316P93.8Very high96.1Very high64 Ų6453 Ų5342%0.41626%0.258SS..Hα-helixtrans-62.7-37.1175.1-2435000113.1T320P316-T320 WeakPolarHBondContact O-CB 3.36Å; P316-T320 WeakPolarHBondContact O-CG2 3.37Å; P316-T320 PolarHBondContact O-N 2.86Å; P316-T320 PolarHBondContact O-OG1 3.45Å
317L94.6Very high96.1Very high79 Ų7951.8 Ų51.841%0.41425%0.251SS..Hα-helixtrans-66.3-46.5178.2-176.1150.8000111.4F313 L314 T315 T319 T320 K321 L322F313-L317 WeakPolarHBondContact O-CB 3.29Å; L314-L317 WeakPolarHBondContact O-CA 3.47Å; L314-L317 WeakPolarHBondContact O-CB 3.35Å; L314-L317 PolarHBondContact O-N 3.32Å; T315-L317 VanDerWaalsContact C-N 3.32Å; T315-L317 PolarHBondContact O-N 3.02Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 PolarHBondContact O-N 3.34Å; L317-T320 PolarHBondContact O-N 3.34Å; L317-K321 HydrophobicContact CG-CG 4.41Å; L317-K321 WeakPolarHBondContact O-CA 3.47Å; L317-K321 VanDerWaalsContact O-CB 3.29Å; L317-K321 WeakPolarHBondContact O-CB 3.39Å; L317-K321 PolarHBondContact O-N 3.34Å; L317-L322 HydrophobicContact CD2-CD1 4.22Å; L317-L322 HydrophobicContact CD2-CG 4.26Å; L317-L322 PolarHBondContact O-N 2.92Å
318F93.1Very high96Very high34 Ų3452.4 Ų52.415%0.14926%0.255CS..Iπ-helixtrans-58.8-46.1177.9-88.1-127000111L314 T315 L322 R323 I324 H331L314-F318 HydrophobicContact CB-CD2 4.48Å; L314-F318 HydrophobicContact CB-CE2 4.49Å; L314-F318 VanDerWaalsContact O-CD2 3.29Å; L314-F318 WeakPolarHBondContact O-CD2 3.25Å; L314-F318 PolarHBondContact O-N 2.81Å; T315-F318 PolarHBondContact O-N 3.4Å; F318-L322 HydrophobicContact CD1-CD1 4.21Å; F318-L322 HydrophobicContact CD2-CD1 3.79Å; F318-L322 HydrophobicContact CE1-CD1 4.26Å; F318-L322 HydrophobicContact CE2-CD1 3.84Å; F318-L322 HydrophobicContact CG-CD1 3.98Å; F318-L322 HydrophobicContact CZ-CD1 4.09Å; F318-L322 CarbonylContact O-C 3.45Å; F318-L322 WeakPolarHBondContact O-CA 3.4Å; F318-L322 WeakPolarHBondContact O-CB 3.3Å; F318-L322 PolarHBondContact O-N 3.43Å; F318-L322 VanDerWaalsContact O-N 3.13Å; F318-R323 PolarHBondContact O-N 3.24Å; F318-I324 CarbonylContact C-O 3.59Å; F318-I324 HydrophobicContact CD1-CB 4.29Å; F318-I324 HydrophobicContact CD1-CD1 4.27Å; F318-I324 HydrophobicContact CD1-CG2 4.43Å; F318-I324 PolarHBondContact O-N 2.85Å; F318-H331 AromaticContact CE1-CD2 3.91Å; F318-H331 AromaticContact CE1-NE2 3.9Å; F318-H331 AromaticContact CZ-CD2 3.99Å; F318-H331 AromaticContact CZ-CE1 3.59Å; F318-H331 AromaticContact CZ-NE2 3.49Å; F318-H331 WeakPolarHBondContact CZ-NE2 3.48Å
319T91.5Very high96Very high17 Ų1752.5 Ų52.510%0.10426%0.256CS..Iπ-helixtrans-65.4-44.5-179.1-57.30000112.1T315 L317 I324 H325T315-T319 PolarHBondContact O-N 2.95Å; T315-T319 VanDerWaalsContact O-N 3.1Å; T315-T319 PolarHBondContact O-OG1 3.45Å; L317-T319 VanDerWaalsContact C-N 3.33Å; L317-T319 PolarHBondContact O-N 3.34Å; T319-I324 VanDerWaalsContact CA-O 3.25Å; T319-I324 WeakPolarHBondContact CA-O 3.29Å; T319-I324 PolarHBondContact N-O 3.15Å; T319-H325 HydrophobicContact CG2-CB 4.42Å
320T89.4Confident96Very high56 Ų5650 Ų5034%0.34424%0.243SC..Iπ-helixtrans-90.5-28.7-170.360.10000114.8R195 P316 L317R195-T320 PolarHBondContact NH2-O 3.35Å; P316-T320 WeakPolarHBondContact O-CB 3.36Å; P316-T320 WeakPolarHBondContact O-CG2 3.37Å; P316-T320 PolarHBondContact O-N 2.86Å; P316-T320 PolarHBondContact O-OG1 3.45Å; L317-T320 PolarHBondContact O-N 3.34Å
321K92.9Very high96Very high160 Ų16050.4 Ų50.470%0.69625%0.245SC*.Iπ-helixtrans-109.5-45.3-175.9-58.6-64.2-175173.70112.8L317L317-K321 HydrophobicContact CG-CG 4.41Å; L317-K321 WeakPolarHBondContact O-CA 3.47Å; L317-K321 VanDerWaalsContact O-CB 3.29Å; L317-K321 WeakPolarHBondContact O-CB 3.39Å; L317-K321 PolarHBondContact O-N 3.34Å
322L94.1Very high96Very high93 Ų9349.4 Ų49.449%0.48724%0.241SC..Iπ-helixtrans-89.6-7.9-177.3-56-178.4000113.4L317 F318 I324L317-L322 HydrophobicContact CD2-CD1 4.22Å; L317-L322 HydrophobicContact CD2-CG 4.26Å; L317-L322 PolarHBondContact O-N 2.92Å; F318-L322 HydrophobicContact CD1-CD1 4.21Å; F318-L322 HydrophobicContact CD2-CD1 3.79Å; F318-L322 HydrophobicContact CE1-CD1 4.26Å; F318-L322 HydrophobicContact CE2-CD1 3.84Å; F318-L322 HydrophobicContact CG-CD1 3.98Å; F318-L322 HydrophobicContact CZ-CD1 4.09Å; F318-L322 CarbonylContact O-C 3.45Å; F318-L322 WeakPolarHBondContact O-CA 3.4Å; F318-L322 WeakPolarHBondContact O-CB 3.3Å; F318-L322 PolarHBondContact O-N 3.43Å; F318-L322 VanDerWaalsContact O-N 3.13Å; L322-I324 HydrophobicContact CB-CD1 4.31Å; L322-I324 HydrophobicContact CB-CG1 4.39Å; L322-I324 PolarHBondContact O-N 2.99Å
323R96.3Very high96.1Very high166 Ų16646.4 Ų46.463%0.62623%0.228SC*.  trans56.440.6-176.6-59.1-177.5177.9176.8-0.4112.1Y190 F318Y190-R323 WeakPolarHBondContact CB-O 3.33Å; Y190-R323 HydrophobicContact CD1-CB 3.84Å; Y190-R323 HydrophobicContact CD1-CG 4.22Å; Y190-R323 HydrophobicContact CD2-CB 3.77Å; Y190-R323 WeakPolarHBondContact CD2-O 3.29Å; Y190-R323 HydrophobicContact CE1-CB 3.9Å; Y190-R323 HydrophobicContact CE1-CG 3.86Å; Y190-R323 HydrophobicContact CE2-CB 3.82Å; Y190-R323 HydrophobicContact CE2-CG 4.34Å; Y190-R323 HydrophobicContact CG-CB 3.75Å; Y190-R323 VanDerWaalsContact CG-O 3.3Å; F318-R323 PolarHBondContact O-N 3.24Å
324I97.3Very high96.2Very high33 Ų3341 Ų4117%0.16921%0.205CC..  trans-118109.8172.2-59.1171.1000106.4L183 A186 F318 T319 L322L183-I324 HydrophobicContact CB-CG2 4.27Å; L183-I324 HydrophobicContact CD2-CG2 3.67Å; A186-I324 HydrophobicContact CB-CG2 4.36Å; F318-I324 CarbonylContact C-O 3.59Å; F318-I324 HydrophobicContact CD1-CB 4.29Å; F318-I324 HydrophobicContact CD1-CD1 4.27Å; F318-I324 HydrophobicContact CD1-CG2 4.43Å; F318-I324 PolarHBondContact O-N 2.85Å; T319-I324 VanDerWaalsContact CA-O 3.25Å; T319-I324 WeakPolarHBondContact CA-O 3.29Å; T319-I324 PolarHBondContact N-O 3.15Å; L322-I324 HydrophobicContact CB-CD1 4.31Å; L322-I324 HydrophobicContact CB-CG1 4.39Å; L322-I324 PolarHBondContact O-N 2.99Å
325H97.3Very high96.2Very high11 Ų1138.2 Ų38.25%0.05119%0.19CC..  trans-98.7103.1179.3-170.9179.6000108.5K135 Y190 E201 T319 Y397K135-H325 PolarHBondContact NZ-O 3.19Å; Y190-H325 HydrophobicContact CD2-CB 4.48Å; E201-H325 VanDerWaalsContact CD-NE2 3.29Å; E201-H325 IonicContact OE1-CD2 3.77Å; E201-H325 IonicContact OE1-CE1 2.58Å; E201-H325 PolarHBondContact OE1-CE1 2.94Å; E201-H325 IonicContact OE1-NE2 3.96Å; E201-H325 PolarHBondContact OE1-NE2 3.18Å; E201-H325 IonicContact OE2-CE1 3.61Å; E201-H325 PolarHBondContact OE2-CE1 3.47Å; E201-H325 IonicContact OE2-NE2 2.81Å; E201-H325 PolarHBondContact OE2-NE2 2.99Å; E201-H325 VanDerWaalsContact OE2-NE2 3.09Å; T319-H325 HydrophobicContact CG2-CB 4.42Å; H325-Y397 PolarHBondContact CE1-OH 3.44Å; H325-Y397 PolarHBondContact NE2-OH 3.44Å
326D97.9Very high96.3Very high7 Ų738.4 Ų38.44%0.03719%0.19CC..  trans-99.6106-178.2179.11000109.8L183 G329 V330 H331L183-D326 HydrophobicContact CD2-CB 3.79Å; D326-G329 VanDerWaalsContact CG-CA 3.42Å; D326-G329 WeakPolarHBondContact OD1-CA 3.41Å; D326-G329 PolarHBondContact OD1-N 3.36Å; D326-G329 WeakPolarHBondContact OD2-CA 3.23Å; D326-V330 VanDerWaalsContact CG-N 3.31Å; D326-V330 PolarHBondContact OD1-N 3.38Å; D326-V330 PolarHBondContact OD2-N 3.04Å; D326-H331 WeakPolarHBondContact OD2-CB 3.29Å; D326-H331 PolarHBondContact OD2-N 3.24Å
327T98.3Very high96.6Very high14 Ų1435.3 Ų35.39%0.08617%0.17CC..SBendtrans-66.7-50.8-170.9-57.80000112.2F71 L72 G130 A131 L133 K135 G329 Y397F71-T327 HydrophobicContact CZ-CG2 4.31Å; L72-T327 HydrophobicContact CD1-CG2 4.12Å; G130-T327 WeakPolarHBondContact O-CB 3.38Å; A131-T327 PolarHBondContact O-N 2.98Å; L133-T327 HydrophobicContact CB-CG2 3.98Å; L133-T327 HydrophobicContact CD2-CG2 4.26Å; L133-T327 HydrophobicContact CG-CG2 4.39Å; L133-T327 WeakPolarHBondContact O-CB 3.45Å; L133-T327 WeakPolarHBondContact O-CG2 3.33Å; L133-T327 PolarHBondContact O-OG1 2.83Å; K135-T327 WeakPolarHBondContact CE-OG1 3.44Å; K135-T327 PolarHBondContact NZ-OG1 3.34Å; T327-G329 VanDerWaalsContact C-N 3.33Å; T327-Y397 HydrophobicContact CG2-CD1 4.38Å; T327-Y397 HydrophobicContact CG2-CE1 3.71Å
328C98.3Very high96.8Very high13 Ų1331.6 Ų31.69%0.08815%0.15CC..SBendtrans-86.4-5.4-179.1-64.30000113G130 L133 Y311 V330G130-C328 VanDerWaalsContact CA-SG 3.56Å; G130-C328 WeakPolarHBondContact O-CB 3.37Å; G130-C328 PolarHBondContact O-N 2.85Å; G130-C328 PolarHBondContact O-SG 2.77Å; G130-C328 VanDerWaalsContact O-SG 3.39Å; L133-C328 WeakPolarHBondContact CD2-SG 3.46Å; Y311-C328 PolarHBondContact OH-O 3.36Å; C328-V330 VanDerWaalsContact C-N 3.33Å; C328-V330 HydrophobicContact CB-CG1 3.81Å
329G98.3Very high97.1Very high2 Ų231.5 Ų31.52%0.02115%0.152CC..  trans6638-171.400000111.9Y311 D326 T327 H331 N332 L333Y311-G329 PolarHBondContact OH-O 3.47Å; D326-G329 VanDerWaalsContact CG-CA 3.42Å; D326-G329 WeakPolarHBondContact OD1-CA 3.41Å; D326-G329 PolarHBondContact OD1-N 3.36Å; D326-G329 WeakPolarHBondContact OD2-CA 3.23Å; T327-G329 VanDerWaalsContact C-N 3.33Å; G329-H331 PolarHBondContact O-N 3.09Å; G329-H331 VanDerWaalsContact O-N 3.13Å; G329-N332 WeakPolarHBondContact O-CB 3.34Å; G329-N332 PolarHBondContact O-N 3.23Å; G329-L333 PolarHBondContact O-N 3.33Å
330V98.7Very high97.4Very high5 Ų532.1 Ų32.13%0.0316%0.156CC..Hα-helixtrans-60.5-23.6-179.8-530000112I127 A131 A179 D326 C328 N332 H334 S335I127-V330 HydrophobicContact CG2-CB 4.34Å; I127-V330 WeakPolarHBondContact O-CG1 3.43Å; A131-V330 HydrophobicContact CB-CG2 3.79Å; A179-V330 HydrophobicContact CB-CG2 4.38Å; D326-V330 VanDerWaalsContact CG-N 3.31Å; D326-V330 PolarHBondContact OD1-N 3.38Å; D326-V330 PolarHBondContact OD2-N 3.04Å; C328-V330 VanDerWaalsContact C-N 3.33Å; C328-V330 HydrophobicContact CB-CG1 3.81Å; V330-N332 VanDerWaalsContact C-N 3.25Å; V330-N332 PolarHBondContact O-N 2.91Å; V330-H334 WeakPolarHBondContact O-CA 3.26Å; V330-H334 WeakPolarHBondContact O-CB 3.24Å; V330-H334 PolarHBondContact O-N 2.79Å; V330-S335 PolarHBondContact O-N 2.93Å
331H98.6Very high97.8Very high10 Ų1029.5 Ų29.55%0.04614%0.14CC..Iπ-helixtrans-56.4-41.8168.4-178.2-106.8000112.1L183 F318 D326 G329 S335 L336L183-H331 HydrophobicContact CD1-CB 3.79Å; L183-H331 HydrophobicContact CD2-CB 4.21Å; F318-H331 AromaticContact CE1-CD2 3.91Å; F318-H331 AromaticContact CE1-NE2 3.9Å; F318-H331 AromaticContact CZ-CD2 3.99Å; F318-H331 AromaticContact CZ-CE1 3.59Å; F318-H331 AromaticContact CZ-NE2 3.49Å; F318-H331 WeakPolarHBondContact CZ-NE2 3.48Å; D326-H331 WeakPolarHBondContact OD2-CB 3.29Å; D326-H331 PolarHBondContact OD2-N 3.24Å; G329-H331 PolarHBondContact O-N 3.09Å; G329-H331 VanDerWaalsContact O-N 3.13Å; H331-S335 VanDerWaalsContact O-CB 3.31Å; H331-S335 WeakPolarHBondContact O-CB 3.29Å; H331-S335 PolarHBondContact O-N 3.04Å; H331-L336 VanDerWaalsContact CE1-CG 3.45Å; H331-L336 WeakPolarHBondContact CE1-CG 3.21Å; H331-L336 PolarHBondContact O-N 2.9Å
332N98.7Very high98.1Very high0 Ų021.9 Ų21.90%011%0.107CC..Iπ-helixtrans-83.9-26.8-172-48.9-46000112.7S307 G310 Y311 T315 G329 V330 P337S307-N332 WeakPolarHBondContact CA-O 3.49Å; S307-N332 WeakPolarHBondContact CB-O 3.27Å; S307-N332 PolarHBondContact OG-O 3.31Å; G310-N332 VanDerWaalsContact CA-OD1 3.24Å; G310-N332 WeakPolarHBondContact CA-OD1 3.22Å; G310-N332 PolarHBondContact O-OD1 3.05Å; Y311-N332 WeakPolarHBondContact CA-ND2 3.35Å; Y311-N332 HydrophobicContact CD1-CB 4.48Å; Y311-N332 WeakPolarHBondContact CD1-ND2 3.44Å; Y311-N332 HydrophobicContact CD2-CB 3.58Å; Y311-N332 HydrophobicContact CE1-CB 4.43Å; Y311-N332 HydrophobicContact CE2-CB 3.5Å; Y311-N332 VanDerWaalsContact CE2-CB 3.5Å; Y311-N332 HydrophobicContact CG-CB 4.06Å; Y311-N332 PolarHBondContact N-ND2 2.9Å; T315-N332 PolarHBondContact OG1-ND2 2.96Å; G329-N332 WeakPolarHBondContact O-CB 3.34Å; G329-N332 PolarHBondContact O-N 3.23Å; V330-N332 VanDerWaalsContact C-N 3.25Å; V330-N332 PolarHBondContact O-N 2.91Å; N332-P337 VanDerWaalsContact O-CD 3.29Å; N332-P337 WeakPolarHBondContact O-CD 3.32Å; N332-P337 VanDerWaalsContact O-CG 3.32Å; N332-P337 WeakPolarHBondContact O-CG 3.32Å
333L98.7Very high98.3Very high2 Ų221.9 Ų21.91%0.0111%0.107CC..Iπ-helixtrans-92.9-42.3176.9172.154000112.4N274 L277 A278 V281 G329 P337N274-L333 HydrophobicContact CB-CD2 4.25Å; N274-L333 WeakPolarHBondContact O-CD1 3.27Å; L277-L333 HydrophobicContact CB-CD1 3.62Å; L277-L333 HydrophobicContact CB-CD2 4.39Å; L277-L333 HydrophobicContact CD1-CD2 4.18Å; A278-L333 HydrophobicContact CB-CD1 4.23Å; V281-L333 HydrophobicContact CG2-CD1 4.27Å; G329-L333 PolarHBondContact O-N 3.33Å; L333-P337 WeakPolarHBondContact O-CB 3.47Å; L333-P337 VanDerWaalsContact O-CD 3.28Å; L333-P337 WeakPolarHBondContact O-CD 3.22Å; L333-P337 WeakPolarHBondContact O-CG 3.47Å
334H98.9Very high98.4Very high6 Ų614.8 Ų14.83%0.0288%0.083CC..Iπ-helixtrans-108.1-45.8-170.4-61.8-68.8000112.8F65 I127 H175 A179 V330 G338F65-H334 AromaticContact CE1-NE2 3.95Å; I127-H334 HydrophobicContact CG2-CB 3.79Å; H175-H334 HydrophobicContact CB-CB 4.23Å; H175-H334 AromaticContact CE1-ND1 3.85Å; H175-H334 AromaticContact ND1-CE1 3.86Å; H175-H334 AromaticContact ND1-ND1 3.11Å; H175-H334 PolarHBondContact ND1-ND1 3.29Å; H175-H334 VanDerWaalsContact ND1-ND1 3.11Å; A179-H334 HydrophobicContact CB-CB 3.73Å; V330-H334 WeakPolarHBondContact O-CA 3.26Å; V330-H334 WeakPolarHBondContact O-CB 3.24Å; V330-H334 PolarHBondContact O-N 2.79Å; H334-G338 VanDerWaalsContact O-CA 3.24Å; H334-G338 WeakPolarHBondContact O-CA 3.35Å; H334-G338 PolarHBondContact O-N 2.81Å
335S98.3Very high98.5Very high0 Ų013.2 Ų13.20%08%0.075CC..Iπ-helixtrans-69.6-60.6-177.2-179.90000112.7Y180 V330 H331 G338 V339Y180-S335 VanDerWaalsContact CE1-OG 3.31Å; Y180-S335 WeakPolarHBondContact CE1-OG 3.48Å; Y180-S335 WeakPolarHBondContact CE2-OG 3.21Å; Y180-S335 PolarHBondContact OH-OG 3.35Å; V330-S335 PolarHBondContact O-N 2.93Å; H331-S335 VanDerWaalsContact O-CB 3.31Å; H331-S335 WeakPolarHBondContact O-CB 3.29Å; H331-S335 PolarHBondContact O-N 3.04Å; S335-G338 PolarHBondContact O-N 3.34Å; S335-V339 WeakPolarHBondContact O-CG2 3.36Å; S335-V339 PolarHBondContact O-N 2.93Å
336L98.4Very high98.5Very high34 Ų3414.3 Ų14.318%0.1788%0.081CC..Hα-helixtrans-61.9-49.3-178.9-68.3172.3000111.6V306 L314 H331 G338 V339 V340V306-L336 HydrophobicContact CG1-CB 3.96Å; V306-L336 HydrophobicContact CG1-CD1 4.03Å; V306-L336 HydrophobicContact CG1-CG 4.49Å; L314-L336 HydrophobicContact CD1-CD1 3.67Å; H331-L336 VanDerWaalsContact CE1-CG 3.45Å; H331-L336 WeakPolarHBondContact CE1-CG 3.21Å; H331-L336 PolarHBondContact O-N 2.9Å; L336-G338 VanDerWaalsContact C-N 3.3Å; L336-G338 PolarHBondContact O-N 2.85Å; L336-V339 PolarHBondContact O-N 3.3Å; L336-V340 WeakPolarHBondContact O-CG2 3.37Å; L336-V340 PolarHBondContact O-N 2.87Å
337P98.9Very high98.5Very high0 Ų017.9 Ų17.90%010%0.103CC..Hα-helixtrans-65.7-31.9175.7-25.941.7000112.8A278 V281 A282 A303 N332 L333 V340 G341A278-P337 HydrophobicContact CB-CB 4.08Å; A278-P337 HydrophobicContact CB-CG 3.67Å; V281-P337 HydrophobicContact CB-CB 3.96Å; V281-P337 HydrophobicContact CG1-CB 3.79Å; A282-P337 WeakPolarHBondContact CA-O 3.29Å; A282-P337 HydrophobicContact CB-CB 4.15Å; A303-P337 HydrophobicContact CB-CB 4.45Å; N332-P337 VanDerWaalsContact O-CD 3.29Å; N332-P337 WeakPolarHBondContact O-CD 3.32Å; N332-P337 VanDerWaalsContact O-CG 3.32Å; N332-P337 WeakPolarHBondContact O-CG 3.32Å; L333-P337 WeakPolarHBondContact O-CB 3.47Å; L333-P337 VanDerWaalsContact O-CD 3.28Å; L333-P337 WeakPolarHBondContact O-CD 3.22Å; L333-P337 WeakPolarHBondContact O-CG 3.47Å; P337-V340 WeakPolarHBondContact O-CB 3.48Å; P337-V340 PolarHBondContact O-N 3.14Å; P337-G341 PolarHBondContact O-N 3.44Å
338G98.8Very high98.5Very high0 Ų017.4 Ų17.40%010%0.101CC..Hα-helixtrans-63.6-42.2174.200000112.5S171 H334 S335 L336 G341 G342S171-G338 WeakPolarHBondContact O-CA 3.44Å; H334-G338 VanDerWaalsContact O-CA 3.24Å; H334-G338 WeakPolarHBondContact O-CA 3.35Å; H334-G338 PolarHBondContact O-N 2.81Å; S335-G338 PolarHBondContact O-N 3.34Å; L336-G338 VanDerWaalsContact C-N 3.3Å; L336-G338 PolarHBondContact O-N 2.85Å; G338-G341 PolarHBondContact O-N 3.17Å; G338-G342 PolarHBondContact O-N 3.43Å
339V98.8Very high98.5Very high33 Ų3317.3 Ų17.320%0.210%0.1CC..Hα-helixtrans-65-43171.9172.70000111.2Y180 S335 L336 G341 G342 L343 I369Y180-V339 HydrophobicContact CE2-CG2 4Å; S335-V339 WeakPolarHBondContact O-CG2 3.36Å; S335-V339 PolarHBondContact O-N 2.93Å; L336-V339 PolarHBondContact O-N 3.3Å; V339-G341 PolarHBondContact O-N 3.3Å; V339-G342 PolarHBondContact O-N 3.12Å; V339-L343 HydrophobicContact CG1-CD1 4.05Å; V339-L343 HydrophobicContact CG1-CG 4.4Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 VanDerWaalsContact O-CG 3.29Å; V339-L343 WeakPolarHBondContact O-CG 3.27Å; V339-L343 PolarHBondContact O-N 3.3Å; V339-I369 HydrophobicContact CG2-CD1 3.99Å
340V98.8Very high98.4Very high30 Ų3020.2 Ų20.218%0.18212%0.123CC..Hα-helixtrans-56.7-41172.8171.10000110.4A282 I302 L336 P337 L343 A344A282-V340 HydrophobicContact CB-CB 4.4Å; A282-V340 HydrophobicContact CB-CG1 4.09Å; I302-V340 HydrophobicContact CG2-CG1 4.35Å; L336-V340 WeakPolarHBondContact O-CG2 3.37Å; L336-V340 PolarHBondContact O-N 2.87Å; P337-V340 WeakPolarHBondContact O-CB 3.48Å; P337-V340 PolarHBondContact O-N 3.14Å; V340-L343 PolarHBondContact O-N 3.34Å; V340-A344 VanDerWaalsContact O-CB 3.29Å; V340-A344 WeakPolarHBondContact O-CB 3.32Å; V340-A344 PolarHBondContact O-N 2.92Å
341G98.7Very high98.3Very high0 Ų027.3 Ų27.30%016%0.158CC..Hα-helixtrans-68.2-43.7177.900000114.4A282 T285 P337 G338 V339 L343 A344 G345A282-G341 WeakPolarHBondContact O-CA 3.26Å; T285-G341 WeakPolarHBondContact CB-O 3.38Å; P337-G341 PolarHBondContact O-N 3.44Å; G338-G341 PolarHBondContact O-N 3.17Å; V339-G341 PolarHBondContact O-N 3.3Å; G341-L343 VanDerWaalsContact C-N 3.31Å; G341-L343 PolarHBondContact O-N 3.34Å; G341-A344 PolarHBondContact O-N 3.2Å; G341-G345 PolarHBondContact O-N 2.9Å
342G98.6Very high98.2Very high0 Ų029.6 Ų29.60%019%0.185CC..Hα-helixtrans-59.1-42.8172.400000112.1G338 V339 G345 I346G338-G342 PolarHBondContact O-N 3.43Å; V339-G342 PolarHBondContact O-N 3.12Å; G342-G345 PolarHBondContact O-N 3.4Å; G342-I346 WeakPolarHBondContact O-CG1 3.36Å; G342-I346 PolarHBondContact O-N 3.08Å
343L98.6Very high98Very high94 Ų9430.5 Ų30.549%0.49219%0.192SC..Hα-helixtrans-66-41.5175.2-67.8174.9000112.3V339 V340 G341 G345 I346 V347 L365V339-L343 HydrophobicContact CG1-CD1 4.05Å; V339-L343 HydrophobicContact CG1-CG 4.4Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 VanDerWaalsContact O-CG 3.29Å; V339-L343 WeakPolarHBondContact O-CG 3.27Å; V339-L343 PolarHBondContact O-N 3.3Å; V340-L343 PolarHBondContact O-N 3.34Å; G341-L343 VanDerWaalsContact C-N 3.31Å; G341-L343 PolarHBondContact O-N 3.34Å; L343-G345 VanDerWaalsContact C-N 3.3Å; L343-G345 PolarHBondContact O-N 2.99Å; L343-I346 HydrophobicContact CD2-CD1 4.34Å; L343-I346 PolarHBondContact O-N 3.19Å; L343-V347 WeakPolarHBondContact O-CG2 3.45Å; L343-V347 PolarHBondContact O-N 2.8Å; L343-L365 HydrophobicContact CD2-CD2 4.46Å
344A98.4Very high97.6Very high16 Ų1632 Ų3213%0.13220%0.203CC..Hα-helixtrans-62-39.2174.800000111.4I299 V340 G341 V347 A348I299-A344 HydrophobicContact CD1-CB 3.82Å; I299-A344 HydrophobicContact CG1-CB 4.08Å; V340-A344 VanDerWaalsContact O-CB 3.29Å; V340-A344 WeakPolarHBondContact O-CB 3.32Å; V340-A344 PolarHBondContact O-N 2.92Å; G341-A344 PolarHBondContact O-N 3.2Å; A344-V347 PolarHBondContact O-N 3.32Å; A344-A348 VanDerWaalsContact O-CB 3.29Å; A344-A348 WeakPolarHBondContact O-CB 3.41Å; A344-A348 PolarHBondContact O-N 2.85Å
345G98.3Very high97.2Very high0 Ų040 Ų400%025%0.245CC..Hα-helixtrans-61.1-43.7172.200000113.2G341 G342 L343 A348 V349G341-G345 PolarHBondContact O-N 2.9Å; G342-G345 PolarHBondContact O-N 3.4Å; L343-G345 VanDerWaalsContact C-N 3.3Å; L343-G345 PolarHBondContact O-N 2.99Å; G345-A348 PolarHBondContact O-N 3.34Å; G345-V349 WeakPolarHBondContact O-CG2 3.29Å; G345-V349 PolarHBondContact O-N 3.14Å
346I98.4Very high96.8Very high34 Ų3441.5 Ų41.517%0.17426%0.255CS..Hα-helixtrans-61.5-45.6174.8-66.7161.3000110.7G342 L343 V349 A350 Q361 A362G342-I346 WeakPolarHBondContact O-CG1 3.36Å; G342-I346 PolarHBondContact O-N 3.08Å; L343-I346 HydrophobicContact CD2-CD1 4.34Å; L343-I346 PolarHBondContact O-N 3.19Å; I346-V349 PolarHBondContact O-N 3.06Å; I346-A350 WeakPolarHBondContact O-CB 3.32Å; I346-A350 PolarHBondContact O-N 3.3Å; I346-Q361 HydrophobicContact CG1-CB 3.62Å; I346-A362 HydrophobicContact CD1-CB 3.98Å
347V98.1Very high96.6Very high82 Ų8242.6 Ų42.650%0.49727%0.265SS..Hα-helixtrans-64.7-43178.1172.10000111.3L343 A344 V349 A350 M351L343-V347 WeakPolarHBondContact O-CG2 3.45Å; L343-V347 PolarHBondContact O-N 2.8Å; A344-V347 PolarHBondContact O-N 3.32Å; V347-V349 VanDerWaalsContact C-N 3.34Å; V347-V349 PolarHBondContact O-N 3.48Å; V347-A350 WeakPolarHBondContact O-CB 3.41Å; V347-A350 PolarHBondContact O-N 3.31Å; V347-A350 VanDerWaalsContact O-N 3.15Å; V347-M351 HydrophobicContact CG1-CG 4.43Å; V347-M351 HydrophobicContact CG1-SD 3.89Å; V347-M351 VanDerWaalsContact O-CG 3.3Å; V347-M351 WeakPolarHBondContact O-CG 3.31Å; V347-M351 PolarHBondContact O-N 3.04Å
348A97.7Very high96.6Very high4 Ų447.3 Ų47.33%0.03329%0.288CS..Hα-helixtrans-60.3-44.5177.600000111.3C286 M289 I291 A344 G345 M351 G352 A353C286-A348 HydrophobicContact CB-CB 4.11Å; M289-A348 HydrophobicContact SD-CB 3.72Å; I291-A348 HydrophobicContact CG2-CB 3.72Å; A344-A348 VanDerWaalsContact O-CB 3.29Å; A344-A348 WeakPolarHBondContact O-CB 3.41Å; A344-A348 PolarHBondContact O-N 2.85Å; G345-A348 PolarHBondContact O-N 3.34Å; A348-M351 PolarHBondContact O-N 3.45Å; A348-G352 PolarHBondContact O-N 3.06Å; A348-A353 HydrophobicContact CB-CB 4.08Å; A348-A353 WeakPolarHBondContact O-CB 3.4Å; A348-A353 PolarHBondContact O-N 2.98Å
349V97.3Very high96.5Very high12 Ų1250.3 Ų50.37%0.07331%0.313CS..Hα-helixtrans-61.5-44.5173170.60000111.3M289 G345 I346 V347 M351 G352 T356 M358 Q361M289-V349 HydrophobicContact CE-CG2 4.1Å; M289-V349 HydrophobicContact SD-CG2 4.17Å; G345-V349 WeakPolarHBondContact O-CG2 3.29Å; G345-V349 PolarHBondContact O-N 3.14Å; I346-V349 PolarHBondContact O-N 3.06Å; V347-V349 VanDerWaalsContact C-N 3.34Å; V347-V349 PolarHBondContact O-N 3.48Å; V349-M351 PolarHBondContact O-N 3.3Å; V349-G352 PolarHBondContact O-N 3.04Å; V349-T356 WeakPolarHBondContact CG1-O 3.42Å; V349-M358 HydrophobicContact CB-CG 4.3Å; V349-M358 HydrophobicContact CG1-CB 4.48Å; V349-M358 HydrophobicContact CG1-CG 3.66Å; V349-Q361 HydrophobicContact CG2-CG 4.01Å
350A97Very high96.4Very high62 Ų6252.1 Ų52.151%0.51232%0.321SS..Hα-helixtrans-59.1-31.417700000112.9I346 V347 G352 M358I346-A350 WeakPolarHBondContact O-CB 3.32Å; I346-A350 PolarHBondContact O-N 3.3Å; V347-A350 WeakPolarHBondContact O-CB 3.41Å; V347-A350 PolarHBondContact O-N 3.31Å; V347-A350 VanDerWaalsContact O-N 3.15Å; A350-G352 VanDerWaalsContact C-N 3.28Å; A350-M358 HydrophobicContact CB-CG 4.27Å; A350-M358 HydrophobicContact CB-SD 3.36Å; A350-M358 WeakPolarHBondContact CB-SD 3.38Å
351M96.6Very high96.4Very high154 Ų15450.7 Ų50.776%0.75931%0.312SS*.THydrogen-bonded Turntrans-84.33.3176.6-67.2177.166.700113.6V347 A348 V349V347-M351 HydrophobicContact CG1-CG 4.43Å; V347-M351 HydrophobicContact CG1-SD 3.89Å; V347-M351 VanDerWaalsContact O-CG 3.3Å; V347-M351 WeakPolarHBondContact O-CG 3.31Å; V347-M351 PolarHBondContact O-N 3.04Å; A348-M351 PolarHBondContact O-N 3.45Å; V349-M351 PolarHBondContact O-N 3.3Å
352G95.8Very high96.4Very high59 Ų5953 Ų5361%0.60833%0.331SS*.THydrogen-bonded Turntrans78.618.2179.600000114.5A348 V349 A350 S354A348-G352 PolarHBondContact O-N 3.06Å; V349-G352 PolarHBondContact O-N 3.04Å; A350-G352 VanDerWaalsContact C-N 3.28Å; G352-S354 PolarHBondContact O-N 3.21Å
353A94.3Very high96.4Very high18 Ų1854.7 Ų54.715%0.14935%0.345CS..SBendtrans-75.1-11.9178.500000113.5M289 A290 I291 A348M289-A353 HydrophobicContact CB-CB 4.13Å; A290-A353 HydrophobicContact CB-CB 4.4Å; A290-A353 PolarHBondContact N-O 3.38Å; A290-A353 VanDerWaalsContact N-O 3.08Å; I291-A353 HydrophobicContact CG2-CB 4.22Å; A348-A353 HydrophobicContact CB-CB 4.08Å; A348-A353 WeakPolarHBondContact O-CB 3.4Å; A348-A353 PolarHBondContact O-N 2.98Å
354S91.8Very high96.4Very high34 Ų3450.2 Ų50.224%0.23832%0.321CS..SBendtrans-154.2155.6174.4174.60000110.3G352 T356G352-S354 PolarHBondContact O-N 3.21Å; S354-T356 VanDerWaalsContact C-N 3.31Å; S354-T356 PolarHBondContact OG-N 3.3Å; S354-T356 PolarHBondContact OG-OG1 3.15Å
355N89.6Confident96.4Very high173 Ų17350.2 Ų50.293%0.92532%0.319SS*.SBendtrans-86.85.1179.4-66.3-28.8000113.7
356T90Very high96.4Very high33 Ų3352.3 Ų52.320%0.20234%0.341CS..SBendtrans-65.5159.2175.7-54.60000111.3K164 V349 S354 Q361K164-T356 WeakPolarHBondContact O-CG2 3.37Å; V349-T356 WeakPolarHBondContact CG1-O 3.42Å; S354-T356 VanDerWaalsContact C-N 3.31Å; S354-T356 PolarHBondContact OG-N 3.3Å; S354-T356 PolarHBondContact OG-OG1 3.15Å; T356-Q361 HydrophobicContact CG2-CG 3.98Å
357S95.2Very high96.4Very high57 Ų5751.7 Ų51.740%0.39934%0.339SS..  trans-80130.1173.4169.60000111.9A359 M360 Q361S357-A359 PolarHBondContact O-N 3.44Å; S357-A359 PolarHBondContact OG-N 3.37Å; S357-M360 PolarHBondContact O-N 2.94Å; S357-M360 VanDerWaalsContact O-N 3.1Å; S357-M360 PolarHBondContact OG-N 3.39Å; S357-Q361 PolarHBondContact O-N 3.15Å
358M96.9Very high96.5Very high98 Ų9847.8 Ų47.848%0.48332%0.316SS..Hα-helixtrans-55.9-40.6172.3-67.4-174.1-68.600112V349 A350 M360 Q361 A362V349-M358 HydrophobicContact CB-CG 4.3Å; V349-M358 HydrophobicContact CG1-CB 4.48Å; V349-M358 HydrophobicContact CG1-CG 3.66Å; A350-M358 HydrophobicContact CB-CG 4.27Å; A350-M358 HydrophobicContact CB-SD 3.36Å; A350-M358 WeakPolarHBondContact CB-SD 3.38Å; M358-M360 VanDerWaalsContact C-N 3.29Å; M358-M360 PolarHBondContact O-N 3.42Å; M358-Q361 PolarHBondContact O-N 2.83Å; M358-A362 PolarHBondContact O-N 3.02Å
359A97.6Very high96.5Very high63 Ų6349.6 Ų49.652%0.52132%0.324SS..Hα-helixtrans-65.8-36.2179.500000111.3S357 A362 A363S357-A359 PolarHBondContact O-N 3.44Å; S357-A359 PolarHBondContact OG-N 3.37Å; A359-A362 PolarHBondContact O-N 3.18Å; A359-A363 WeakPolarHBondContact O-CB 3.36Å; A359-A363 PolarHBondContact O-N 3.48Å
360M97.8Very high96.6Very high72 Ų7250.7 Ų50.736%0.35534%0.338SS..Hα-helixtrans-72.8-35.4176.1-66.1-59121.300112.3F163 S357 M358 A363 A364F163-M360 HydrophobicContact CB-CB 4.24Å; F163-M360 HydrophobicContact CB-SD 4.19Å; F163-M360 HydrophobicContact CD1-SD 3.93Å; F163-M360 HydrophobicContact CG-SD 4.41Å; F163-M360 VanDerWaalsContact O-CB 3.27Å; F163-M360 WeakPolarHBondContact O-CB 3.39Å; F163-M360 WeakPolarHBondContact O-CG 3.46Å; S357-M360 PolarHBondContact O-N 2.94Å; S357-M360 VanDerWaalsContact O-N 3.1Å; S357-M360 PolarHBondContact OG-N 3.39Å; M358-M360 VanDerWaalsContact C-N 3.29Å; M358-M360 PolarHBondContact O-N 3.42Å; M360-A363 PolarHBondContact O-N 2.92Å; M360-A364 WeakPolarHBondContact O-CB 3.27Å; M360-A364 PolarHBondContact O-N 3.17Å
361Q98Very high96.7Very high0 Ų048.9 Ų48.90%032%0.321CS..Hα-helixtrans-62-43.1170.4-68.8-66.156.600111.8S166 I346 V349 T356 S357 M358 A364 L365S166-Q361 PolarHBondContact O-NE2 3Å; S166-Q361 PolarHBondContact O-OE1 2.59Å; I346-Q361 HydrophobicContact CG1-CB 3.62Å; V349-Q361 HydrophobicContact CG2-CG 4.01Å; T356-Q361 HydrophobicContact CG2-CG 3.98Å; S357-Q361 PolarHBondContact O-N 3.15Å; M358-Q361 PolarHBondContact O-N 2.83Å; Q361-A364 PolarHBondContact O-N 2.92Å; Q361-L365 PolarHBondContact O-N 3.26Å
362A98.4Very high96.8Very high49 Ų4941.6 Ų41.641%0.40529%0.285SS..Hα-helixtrans-64.7-40.6175.200000112.2I346 M358 A359 A364 L365 G366I346-A362 HydrophobicContact CD1-CB 3.98Å; M358-A362 PolarHBondContact O-N 3.02Å; A359-A362 PolarHBondContact O-N 3.18Å; A362-A364 VanDerWaalsContact C-N 3.35Å; A362-L365 PolarHBondContact O-N 3.46Å; A362-G366 PolarHBondContact O-N 3.19Å
363A98.4Very high96.9Very high34 Ų3441.3 Ų41.328%0.28127%0.271SS..Hα-helixtrans-62.3-41.5174.800000111.8F163 A359 M360 G366 S367F163-A363 HydrophobicContact CD1-CB 4.31Å; F163-A363 HydrophobicContact CD2-CB 4.29Å; F163-A363 HydrophobicContact CE1-CB 4.25Å; F163-A363 HydrophobicContact CE2-CB 4.22Å; F163-A363 HydrophobicContact CG-CB 4.34Å; F163-A363 HydrophobicContact CZ-CB 4.21Å; A359-A363 WeakPolarHBondContact O-CB 3.36Å; A359-A363 PolarHBondContact O-N 3.48Å; M360-A363 PolarHBondContact O-N 2.92Å; A363-G366 PolarHBondContact O-N 3.3Å; A363-S367 WeakPolarHBondContact O-CB 3.37Å; A363-S367 PolarHBondContact O-N 3.32Å; A363-S367 PolarHBondContact O-OG 2.87Å
364A98.6Very high97.1Very high0 Ų044.3 Ų44.30%029%0.287CS..Hα-helixtrans-63.5-43.9176.800000112.8V159 F163 A165 M172 M360 Q361 A362 S367 S368V159-A364 HydrophobicContact CB-CB 4.3Å; V159-A364 HydrophobicContact CG1-CB 3.85Å; V159-A364 HydrophobicContact CG2-CB 3.78Å; F163-A364 HydrophobicContact CD2-CB 4.14Å; A165-A364 HydrophobicContact CB-CB 3.44Å; A165-A364 VanDerWaalsContact CB-CB 3.44Å; M172-A364 HydrophobicContact CE-CB 3.82Å; M172-A364 HydrophobicContact SD-CB 4.26Å; M360-A364 WeakPolarHBondContact O-CB 3.27Å; M360-A364 PolarHBondContact O-N 3.17Å; Q361-A364 PolarHBondContact O-N 2.92Å; A362-A364 VanDerWaalsContact C-N 3.35Å; A364-S367 PolarHBondContact O-OG 2.94Å; A364-S368 VanDerWaalsContact O-CB 3.31Å; A364-S368 WeakPolarHBondContact O-CB 3.39Å; A364-S368 PolarHBondContact O-N 3.22Å; A364-S368 PolarHBondContact O-OG 3.14Å
365L98.8Very high97.5Very high16 Ų1642.7 Ų42.78%0.08428%0.276CS..Hα-helixtrans-61.5-48.1174.5179.758.5000110.8M172 L343 Q361 A362 S368 I369M172-L365 HydrophobicContact CB-CD1 4.44Å; M172-L365 HydrophobicContact CG-CB 4.46Å; M172-L365 HydrophobicContact CG-CD1 4.01Å; M172-L365 HydrophobicContact SD-CB 3.65Å; M172-L365 HydrophobicContact SD-CD1 4.3Å; L343-L365 HydrophobicContact CD2-CD2 4.46Å; Q361-L365 PolarHBondContact O-N 3.26Å; A362-L365 PolarHBondContact O-N 3.46Å; L365-S368 PolarHBondContact O-N 3.22Å; L365-I369 HydrophobicContact CD1-CD1 3.94Å; L365-I369 HydrophobicContact CD1-CG1 4.42Å; L365-I369 HydrophobicContact CG-CD1 4.19Å; L365-I369 WeakPolarHBondContact O-CG1 3.48Å; L365-I369 PolarHBondContact O-N 3.05Å; L365-I369 VanDerWaalsContact O-N 3.14Å
366G98.7Very high97.9Very high44 Ų4434.4 Ų34.445%0.45423%0.232SC..Hα-helixtrans-61.9-43.5179.400000113.2A362 A363 S368 G370A362-G366 PolarHBondContact O-N 3.19Å; A363-G366 PolarHBondContact O-N 3.3Å; G366-S368 VanDerWaalsContact C-N 3.35Å; G366-G370 PolarHBondContact O-N 3.48Å
367S98.5Very high98.3Very high21 Ų2136.3 Ų36.315%0.14724%0.241CC..Hα-helixtrans-66.6-37.4177.7710000111.9N155 F163 A363 A364 G370 T371N155-S367 PolarHBondContact OD1-O 3.4Å; N155-S367 PolarHBondContact OD1-OG 3.1Å; F163-S367 WeakPolarHBondContact CE2-OG 3.15Å; A363-S367 WeakPolarHBondContact O-CB 3.37Å; A363-S367 PolarHBondContact O-N 3.32Å; A363-S367 PolarHBondContact O-OG 2.87Å; A364-S367 PolarHBondContact O-OG 2.94Å; S367-G370 PolarHBondContact O-N 3.27Å; S367-T371 WeakPolarHBondContact O-CB 3.25Å; S367-T371 PolarHBondContact O-N 3.32Å; S367-T371 PolarHBondContact O-OG1 3.39Å
368S98.8Very high98.5Very high0 Ų038.4 Ų38.40%025%0.245CC..Hα-helixtrans-64.7-47.1-179.9-60.20000110.9N155 M172 F177 A364 L365 G366 A372N155-S368 WeakPolarHBondContact ND2-CA 2.99Å; N155-S368 WeakPolarHBondContact ND2-CB 3.23Å; N155-S368 PolarHBondContact ND2-OG 2.92Å; N155-S368 WeakPolarHBondContact OD1-CA 3.46Å; N155-S368 PolarHBondContact OD1-N 3.33Å; N155-S368 PolarHBondContact OD1-OG 3.23Å; M172-S368 WeakPolarHBondContact O-CB 3.27Å; F177-S368 WeakPolarHBondContact CD2-O 3.31Å; A364-S368 VanDerWaalsContact O-CB 3.31Å; A364-S368 WeakPolarHBondContact O-CB 3.39Å; A364-S368 PolarHBondContact O-N 3.22Å; A364-S368 PolarHBondContact O-OG 3.14Å; L365-S368 PolarHBondContact O-N 3.22Å; G366-S368 VanDerWaalsContact C-N 3.35Å; S368-A372 WeakPolarHBondContact O-CB 3.45Å; S368-A372 PolarHBondContact O-N 3.08Å; S368-A372 VanDerWaalsContact O-N 3.09Å
369I98.9Very high98.6Very high42 Ų4233.8 Ų33.822%0.21522%0.223CC..Hα-helixtrans-66.9-45.6175.5-60.2172.3000110.9Y180 V339 L365 A372 V373Y180-I369 HydrophobicContact CD2-CB 4.25Å; Y180-I369 HydrophobicContact CD2-CD1 4.38Å; Y180-I369 HydrophobicContact CD2-CG1 3.76Å; Y180-I369 HydrophobicContact CD2-CG2 3.86Å; Y180-I369 HydrophobicContact CE2-CB 4.49Å; Y180-I369 HydrophobicContact CE2-CD1 3.85Å; Y180-I369 HydrophobicContact CE2-CG1 3.76Å; Y180-I369 HydrophobicContact CE2-CG2 4.02Å; Y180-I369 HydrophobicContact CG-CG2 4.14Å; V339-I369 HydrophobicContact CG2-CD1 3.99Å; L365-I369 HydrophobicContact CD1-CD1 3.94Å; L365-I369 HydrophobicContact CD1-CG1 4.42Å; L365-I369 HydrophobicContact CG-CD1 4.19Å; L365-I369 WeakPolarHBondContact O-CG1 3.48Å; L365-I369 PolarHBondContact O-N 3.05Å; L365-I369 VanDerWaalsContact O-N 3.14Å; I369-A372 PolarHBondContact O-N 3.22Å; I369-V373 HydrophobicContact CG2-CG2 4.44Å; I369-V373 WeakPolarHBondContact O-CG2 3.47Å; I369-V373 PolarHBondContact O-N 3.38Å
370G98.7Very high98.6Very high35 Ų3530.8 Ų30.836%0.36120%0.198SC..Hα-helixtrans-62.4-47.6-17800000112.9G366 S367 V373 V374G366-G370 PolarHBondContact O-N 3.48Å; S367-G370 PolarHBondContact O-N 3.27Å; G370-V373 PolarHBondContact O-N 3.31Å; G370-V374 WeakPolarHBondContact O-CG2 3.37Å; G370-V374 PolarHBondContact O-N 3.1Å; G370-V374 VanDerWaalsContact O-N 3.07Å
371T98.7Very high98.7Very high25 Ų2532.3 Ų32.315%0.15321%0.207CC..Hα-helixtrans-64.9-42.1178.2-51.60000110.8F151 N155 F177 S367 V374 G375F151-T371 HydrophobicContact CB-CG2 4.38Å; F151-T371 HydrophobicContact CD1-CG2 4.12Å; N155-T371 HydrophobicContact CB-CG2 4.18Å; F177-T371 HydrophobicContact CE2-CG2 4.09Å; S367-T371 WeakPolarHBondContact O-CB 3.25Å; S367-T371 PolarHBondContact O-N 3.32Å; S367-T371 PolarHBondContact O-OG1 3.39Å; T371-V374 PolarHBondContact O-N 3.26Å; T371-G375 PolarHBondContact O-N 2.88Å
372A98.9Very high98.7Very high0 Ų035.5 Ų35.50%022%0.223CC..Hα-helixtrans-59.3-48176.500000112.6F177 F181 S368 I369 G376F177-A372 HydrophobicContact CB-CB 4.39Å; F177-A372 HydrophobicContact CD2-CB 3.7Å; F177-A372 HydrophobicContact CE2-CB 4.03Å; F177-A372 HydrophobicContact CG-CB 4Å; F177-A372 WeakPolarHBondContact O-CB 3.38Å; F181-A372 WeakPolarHBondContact CA-O 3.24Å; F181-A372 HydrophobicContact CB-CB 4.1Å; F181-A372 WeakPolarHBondContact CD2-O 2.96Å; S368-A372 WeakPolarHBondContact O-CB 3.45Å; S368-A372 PolarHBondContact O-N 3.08Å; S368-A372 VanDerWaalsContact O-N 3.09Å; I369-A372 PolarHBondContact O-N 3.22Å; A372-G376 WeakPolarHBondContact O-CA 3.44Å; A372-G376 PolarHBondContact O-N 2.93Å
373V98.9Very high98.7Very high54 Ų5433.2 Ų33.233%0.32720%0.204SC..Hα-helixtrans-63.9-46.6179.4171.20000110.8I369 G370 G376 L377I369-V373 HydrophobicContact CG2-CG2 4.44Å; I369-V373 WeakPolarHBondContact O-CG2 3.47Å; I369-V373 PolarHBondContact O-N 3.38Å; G370-V373 PolarHBondContact O-N 3.31Å; V373-G376 PolarHBondContact O-N 3.46Å; V373-L377 HydrophobicContact CG1-CD1 3.91Å; V373-L377 HydrophobicContact CG1-CG 4.34Å; V373-L377 WeakPolarHBondContact O-CB 3.28Å; V373-L377 WeakPolarHBondContact O-CG 3.21Å; V373-L377 PolarHBondContact O-N 3.44Å
374V98.8Very high98.7Very high80 Ų8037.3 Ų37.349%0.48522%0.215SC..Hα-helixtrans-62.2-50.7179.1172.30000111G370 T371 G376 L377 M378G370-V374 WeakPolarHBondContact O-CG2 3.37Å; G370-V374 PolarHBondContact O-N 3.1Å; G370-V374 VanDerWaalsContact O-N 3.07Å; T371-V374 PolarHBondContact O-N 3.26Å; V374-G376 VanDerWaalsContact C-N 3.35Å; V374-G376 PolarHBondContact O-N 2.84Å; V374-L377 PolarHBondContact O-N 2.74Å; V374-M378 HydrophobicContact CG1-SD 4.12Å; V374-M378 WeakPolarHBondContact O-CG 3.19Å; V374-M378 PolarHBondContact O-N 2.92Å
375G98.8Very high98.6Very high0 Ų041.2 Ų41.20%024%0.236CC..Hα-helixtrans-62.3-40.6179.200000112.8T371 M378 T379T371-G375 PolarHBondContact O-N 2.88Å; G375-M378 PolarHBondContact O-N 3.43Å; G375-T379 VanDerWaalsContact O-CB 3.24Å; G375-T379 WeakPolarHBondContact O-CB 3.38Å; G375-T379 PolarHBondContact O-N 2.98Å; G375-T379 PolarHBondContact O-OG1 2.84Å
376G98.9Very high98.4Very high0 Ų045.8 Ų45.80%027%0.267CS..Hα-helixtrans-69.2-37.2178.400000112.8F181 V185 A372 V373 V374 G380F181-G376 VanDerWaalsContact CD2-N 3.32Å; F181-G376 VanDerWaalsContact CE2-N 3.32Å; V185-G376 VanDerWaalsContact CG2-O 3.26Å; V185-G376 WeakPolarHBondContact CG2-O 3.47Å; A372-G376 WeakPolarHBondContact O-CA 3.44Å; A372-G376 PolarHBondContact O-N 2.93Å; V373-G376 PolarHBondContact O-N 3.46Å; V374-G376 VanDerWaalsContact C-N 3.35Å; V374-G376 PolarHBondContact O-N 2.84Å; G376-G380 PolarHBondContact O-N 2.9Å
377L98.8Very high98.2Very high73 Ų7349.2 Ų49.238%0.38227%0.274SS..Hα-helixtrans-64.3-47.1172.6-71.9172.6000111.2A184 I188 V373 V374 G380 L381A184-L377 HydrophobicContact CB-CD2 4.35Å; A184-L377 HydrophobicContact CB-CG 4.2Å; I188-L377 HydrophobicContact CD1-CD2 3.83Å; I188-L377 HydrophobicContact CG1-CD2 3.83Å; V373-L377 HydrophobicContact CG1-CD1 3.91Å; V373-L377 HydrophobicContact CG1-CG 4.34Å; V373-L377 WeakPolarHBondContact O-CB 3.28Å; V373-L377 WeakPolarHBondContact O-CG 3.21Å; V373-L377 PolarHBondContact O-N 3.44Å; V374-L377 PolarHBondContact O-N 2.74Å; L377-G380 PolarHBondContact O-N 3.45Å; L377-L381 VanDerWaalsContact O-CG 3.31Å; L377-L381 WeakPolarHBondContact O-CG 3.38Å; L377-L381 PolarHBondContact O-N 2.95Å
378M98.8Very high98.1Very high101 Ų10150.5 Ų50.550%0.49828%0.276SS..Hα-helixtrans-60.4-47.6177.3-71.9177.862.400111.5F151 V374 G375 L381 I382F151-M378 HydrophobicContact CE1-SD 4.48Å; F151-M378 HydrophobicContact CZ-CE 4.23Å; F151-M378 HydrophobicContact CZ-SD 3.95Å; V374-M378 HydrophobicContact CG1-SD 4.12Å; V374-M378 WeakPolarHBondContact O-CG 3.19Å; V374-M378 PolarHBondContact O-N 2.92Å; G375-M378 PolarHBondContact O-N 3.43Å; M378-L381 PolarHBondContact O-N 3.22Å; M378-I382 PolarHBondContact O-N 3.22Å
379T98.9Very high97.9Very high1 Ų152.2 Ų52.21%0.00629%0.293CS..Hα-helixtrans-63.3-46178.5-610000110.9M144 L147 F181 V185 G375 L381 I382 L383M144-T379 HydrophobicContact CB-CG2 4.42Å; M144-T379 HydrophobicContact CG-CG2 3.93Å; L147-T379 HydrophobicContact CB-CG2 4.31Å; L147-T379 HydrophobicContact CD1-CG2 3.93Å; F181-T379 HydrophobicContact CE1-CG2 4.12Å; F181-T379 HydrophobicContact CZ-CG2 3.94Å; F181-T379 VanDerWaalsContact CZ-OG1 3.29Å; F181-T379 WeakPolarHBondContact CZ-OG1 3.45Å; V185-T379 HydrophobicContact CG2-CG2 4.24Å; G375-T379 VanDerWaalsContact O-CB 3.24Å; G375-T379 WeakPolarHBondContact O-CB 3.38Å; G375-T379 PolarHBondContact O-N 2.98Å; G375-T379 PolarHBondContact O-OG1 2.84Å; T379-L381 VanDerWaalsContact C-N 3.28Å; T379-L381 PolarHBondContact O-N 3.37Å; T379-I382 WeakPolarHBondContact O-CB 3.41Å; T379-I382 PolarHBondContact O-N 3.01Å; T379-I382 VanDerWaalsContact O-N 3.09Å; T379-L383 HydrophobicContact CG2-CD1 3.92Å; T379-L383 HydrophobicContact CG2-CG 4.11Å; T379-L383 VanDerWaalsContact O-CG 3.31Å; T379-L383 WeakPolarHBondContact O-CG 3.49Å; T379-L383 PolarHBondContact O-N 2.97Å
380G98.8Very high97.8Very high0 Ų052.7 Ų52.70%029%0.294CS..Hα-helixtrans-56.5-39.9176.500000113I188 G376 L377 L383 K384I188-G380 WeakPolarHBondContact CG2-O 3.43Å; G376-G380 PolarHBondContact O-N 2.9Å; L377-G380 PolarHBondContact O-N 3.45Å; G380-L383 PolarHBondContact O-N 3.32Å; G380-K384 WeakPolarHBondContact O-CB 3.25Å; G380-K384 PolarHBondContact O-N 3.1Å
381L98.7Very high97.7Very high104 Ų10451.4 Ų51.455%0.54528%0.28SS..Hα-helixtrans-63.7-41.3176.8-71.7169.8000111.9I188 L377 M378 T379 K384I188-L381 HydrophobicContact CD1-CD2 4.3Å; I188-L381 HydrophobicContact CG2-CD2 4.14Å; I188-L381 HydrophobicContact CG2-CG 4.41Å; L377-L381 VanDerWaalsContact O-CG 3.31Å; L377-L381 WeakPolarHBondContact O-CG 3.38Å; L377-L381 PolarHBondContact O-N 2.95Å; M378-L381 PolarHBondContact O-N 3.22Å; T379-L381 VanDerWaalsContact C-N 3.28Å; T379-L381 PolarHBondContact O-N 3.37Å; L381-K384 PolarHBondContact O-N 3.3Å
382I98.6Very high97.6Very high66 Ų6653 Ų5334%0.33829%0.292SS..Hα-helixtrans-64.2-47.9174.7-64.4166.4000109.9I143 L147 M378 T379 K384 L385 W388I143-I382 HydrophobicContact CG2-CG2 4.2Å; L147-I382 HydrophobicContact CD1-CD1 3.71Å; M378-I382 PolarHBondContact O-N 3.22Å; T379-I382 WeakPolarHBondContact O-CB 3.41Å; T379-I382 PolarHBondContact O-N 3.01Å; T379-I382 VanDerWaalsContact O-N 3.09Å; I382-K384 PolarHBondContact O-N 3.19Å; I382-L385 WeakPolarHBondContact O-CG 3.31Å; I382-L385 PolarHBondContact O-N 2.99Å; I382-W388 HydrophobicContact CG2-CZ2 4.45Å; I382-W388 PolarHBondContact O-NE1 3.14Å
383L98.6Very high97.4Very high1 Ų155.3 Ų55.31%0.00530%0.304CS..Hα-helixtrans-67.6-19.2-178.9-63-173.8000113.4Q140 I143 M144 V185 L189 T379 G380 L385 W388Q140-L383 HydrophobicContact CB-CD2 3.95Å; Q140-L383 HydrophobicContact CG-CD2 4.19Å; Q140-L383 PolarHBondContact NE2-O 3.17Å; Q140-L383 WeakPolarHBondContact O-CD2 3.47Å; I143-L383 HydrophobicContact CB-CD2 3.86Å; I143-L383 HydrophobicContact CG2-CD2 3.71Å; M144-L383 HydrophobicContact CB-CD1 4Å; M144-L383 HydrophobicContact CG-CD1 4.13Å; M144-L383 HydrophobicContact SD-CD1 4.26Å; V185-L383 HydrophobicContact CG1-CD1 3.95Å; L189-L383 HydrophobicContact CD1-CB 4.19Å; L189-L383 HydrophobicContact CD2-CB 4.19Å; T379-L383 HydrophobicContact CG2-CD1 3.92Å; T379-L383 HydrophobicContact CG2-CG 4.11Å; T379-L383 VanDerWaalsContact O-CG 3.31Å; T379-L383 WeakPolarHBondContact O-CG 3.49Å; T379-L383 PolarHBondContact O-N 2.97Å; G380-L383 PolarHBondContact O-N 3.32Å; L383-L385 VanDerWaalsContact C-N 3.27Å; L383-L385 PolarHBondContact O-N 3.44Å; L383-W388 VanDerWaalsContact O-CD1 3.24Å
384K98Very high97.3Very high120 Ų12060.6 Ų60.652%0.52233%0.325SS..THydrogen-bonded Turntrans-72.6-19.9178.1-169.8167.6-173.1157.20113.4I188 L189 G380 L381 I382I188-K384 HydrophobicContact CG2-CB 4.29Å; I188-K384 HydrophobicContact CG2-CD 3.9Å; I188-K384 PolarHBondContact O-NZ 3.24Å; I188-K384 VanDerWaalsContact O-NZ 3.08Å; L189-K384 HydrophobicContact CD2-CB 3.88Å; L189-K384 HydrophobicContact CD2-CG 4.43Å; G380-K384 WeakPolarHBondContact O-CB 3.25Å; G380-K384 PolarHBondContact O-N 3.1Å; L381-K384 PolarHBondContact O-N 3.3Å; I382-K384 PolarHBondContact O-N 3.19Å
385L97.2Very high97.2Very high83 Ų8360.7 Ų60.744%0.43532%0.323SS..SBendtrans-58.4138.4-179.4-61172.8000110.8I382 L383 L387 W388 Q390I382-L385 WeakPolarHBondContact O-CG 3.31Å; I382-L385 PolarHBondContact O-N 2.99Å; L383-L385 VanDerWaalsContact C-N 3.27Å; L383-L385 PolarHBondContact O-N 3.44Å; L385-L387 HydrophobicContact CB-CD1 4.49Å; L385-L387 PolarHBondContact O-N 3.02Å; L385-W388 HydrophobicContact CB-CZ2 4.22Å; L385-W388 HydrophobicContact CD1-CZ2 4.06Å; L385-W388 PolarHBondContact O-NE1 3.47Å; L385-Q390 PolarHBondContact O-NE2 3.45Å
386P93.9Very high97.2Very high112 Ų11260.7 Ų60.773%0.72732%0.323SS*.THydrogen-bonded Turntrans-8040.6-17434.7-37.6000113.2
387L94.8Very high97.2Very high116 Ų11660.8 Ų60.861%0.60732%0.324SS*.THydrogen-bonded Turntrans-117.5-9.9-172.1-59.2174.1000113L385L385-L387 HydrophobicContact CB-CD1 4.49Å; L385-L387 PolarHBondContact O-N 3.02Å
388W95.9Very high97.1Very high48 Ų4858.4 Ų58.418%0.18231%0.311CS..SBendtrans-99.32.7-164.3-44.6125.5000114.2S137 T139 Q140 I143 I382 L383 L385 Q390S137-W388 WeakPolarHBondContact CB-O 3.02Å; S137-W388 PolarHBondContact OG-O 3.02Å; T139-W388 HydrophobicContact CG2-CE3 4.27Å; Q140-W388 HydrophobicContact CG-CB 3.4Å; Q140-W388 HydrophobicContact CG-CG 3.89Å; I143-W388 HydrophobicContact CD1-CD2 3.94Å; I143-W388 HydrophobicContact CD1-CE3 3.77Å; I143-W388 HydrophobicContact CD1-CH2 4.22Å; I143-W388 HydrophobicContact CD1-CZ2 4.36Å; I143-W388 HydrophobicContact CD1-CZ3 3.93Å; I382-W388 HydrophobicContact CG2-CZ2 4.45Å; I382-W388 PolarHBondContact O-NE1 3.14Å; L383-W388 VanDerWaalsContact O-CD1 3.24Å; L385-W388 HydrophobicContact CB-CZ2 4.22Å; L385-W388 HydrophobicContact CD1-CZ2 4.06Å; L385-W388 PolarHBondContact O-NE1 3.47Å; W388-Q390 VanDerWaalsContact C-N 3.31Å; W388-Q390 PolarHBondContact O-N 3.37Å
389G94.8Very high97.1Very high36 Ų3654 Ų5437%0.37129%0.29SS..  trans69.428.3-179.700000113.6S137 Y402S137-G389 WeakPolarHBondContact CB-O 3.47Å; G389-Y402 PolarHBondContact O-OH 3.12Å
390Q95.9Very high97Very high51 Ų5157 Ų5724%0.23831%0.311CS..PPolyproline II helixtrans-57.1148170.461.4-92.650.600111.3L385 W388L385-Q390 PolarHBondContact O-NE2 3.45Å; W388-Q390 VanDerWaalsContact C-N 3.31Å; W388-Q390 PolarHBondContact O-N 3.37Å
391P96.6Very high96.9Very high9 Ų959.7 Ų59.76%0.05833%0.327CS..PPolyproline II helixtrans-70.1156.5178.231.4-33.3000110.7K135 R191 N395 V401 Y402K135-P391 WeakPolarHBondContact O-CD 3.44Å; R191-P391 VanDerWaalsContact CZ-O 3.31Å; R191-P391 PolarHBondContact NH1-O 3.41Å; R191-P391 PolarHBondContact NH2-O 2.67Å; P391-N395 HydrophobicContact CB-CB 4.24Å; P391-V401 HydrophobicContact CB-CG1 4.48Å; P391-Y402 VanDerWaalsContact CD-OH 3.27Å; P391-Y402 WeakPolarHBondContact CD-OH 3.45Å
392S96.4Very high96.8Very high58 Ų5857.3 Ų57.341%0.40631%0.311SS..PPolyproline II helixtrans-69162.7161.758.80000110.1Q394 N395 C396S392-Q394 PolarHBondContact O-N 2.77Å; S392-N395 PolarHBondContact O-N 3.4Å; S392-N395 PolarHBondContact OG-ND2 2.72Å; S392-N395 VanDerWaalsContact OG-ND2 3.13Å; S392-C396 PolarHBondContact O-N 3.4Å; S392-C396 PolarHBondContact O-SG 2.64Å; S392-C396 VanDerWaalsContact O-SG 3.35Å
393D96.6Very high96.8Very high48 Ų4858.8 Ų58.826%0.25731%0.313SS..G310 helixtrans-57.7-33.7-179.2-71.39.7000112.6R191 G193 L194 H198 N395R191-D393 VanDerWaalsContact CD-OD1 3.32Å; R191-D393 WeakPolarHBondContact CD-OD1 3.4Å; R191-D393 WeakPolarHBondContact CG-OD1 3.5Å; R191-D393 IonicContact CZ-OD1 3.37Å; R191-D393 IonicContact NE-OD1 3.21Å; R191-D393 IonicContact NH1-OD1 3.17Å; R191-D393 PolarHBondContact NH1-OD1 2.89Å; G193-D393 WeakPolarHBondContact CA-OD2 3.42Å; G193-D393 PolarHBondContact N-OD2 2.96Å; L194-D393 HydrophobicContact CD2-CB 4.16Å; L194-D393 WeakPolarHBondContact CD2-O 3.32Å; H198-D393 PolarHBondContact CD2-O 3.28Å; H198-D393 VanDerWaalsContact CD2-O 3.29Å; H198-D393 PolarHBondContact NE2-O 3.14Å; D393-N395 VanDerWaalsContact C-N 3.29Å; D393-N395 PolarHBondContact O-N 3.28Å
394Q96.1Very high96.7Very high165 Ų16568.6 Ų68.677%0.77136%0.355SS*.G310 helixtrans-72.4-20.6178.1-64.3173.41.100114H198 S392H198-Q394 PolarHBondContact NE2-O 2.95Å; S392-Q394 PolarHBondContact O-N 2.77Å
395N96.9Very high96.5Very high83 Ų8365 Ų6544%0.44434%0.343SS..G310 helixtrans-108.312.5-175.2-68.8-27.6000111.7P391 S392 D393 V401P391-N395 HydrophobicContact CB-CB 4.24Å; S392-N395 PolarHBondContact O-N 3.4Å; S392-N395 PolarHBondContact OG-ND2 2.72Å; S392-N395 VanDerWaalsContact OG-ND2 3.13Å; D393-N395 VanDerWaalsContact C-N 3.29Å; D393-N395 PolarHBondContact O-N 3.28Å; N395-V401 HydrophobicContact CB-CG2 3.87Å; N395-V401 WeakPolarHBondContact O-CG2 3.41Å
396C98.3Very high96.2Very high0 Ų064.6 Ų64.60%035%0.346CS..THydrogen-bonded Turntrans-69152.5173.8-690000110.3G134 L194 H198 S392 D398G134-C396 WeakPolarHBondContact O-CA 3.15Å; G134-C396 WeakPolarHBondContact O-CB 3.37Å; L194-C396 HydrophobicContact CD1-CB 4.37Å; H198-C396 PolarHBondContact CE1-O 3.44Å; S392-C396 PolarHBondContact O-N 3.4Å; S392-C396 PolarHBondContact O-SG 2.64Å; S392-C396 VanDerWaalsContact O-SG 3.35Å; C396-D398 PolarHBondContact O-N 2.83Å
397Y98.1Very high95.5Very high1 Ų169.8 Ų69.80%0.00436%0.357CS..THydrogen-bonded Turntrans58.729.4176.9-39.7-86.9000114.5L72 K74 Y75 L133 G134 K135 L194 H198 E201 H325 T327L72-Y397 HydrophobicContact CD1-CD1 3.83Å; L72-Y397 HydrophobicContact CD2-CD1 4.02Å; K74-Y397 CarbonylContact C-O 3.59Å; Y75-Y397 VanDerWaalsContact CD2-C 3.47Å; L133-Y397 WeakPolarHBondContact O-CE1 3.47Å; G134-Y397 PolarHBondContact O-N 3.23Å; K135-Y397 HydrophobicContact CG-CE1 4.38Å; K135-Y397 HydrophobicContact CG-CE2 4.47Å; L194-Y397 HydrophobicContact CD1-CE2 4.19Å; H198-Y397 HydrophobicContact CB-CD2 3.92Å; H198-Y397 HydrophobicContact CB-CE2 3.79Å; H198-Y397 AromaticContact CG-CD2 3.76Å; H198-Y397 AromaticContact ND1-CD2 3.62Å; E201-Y397 HydrophobicContact CB-CD1 4.35Å; E201-Y397 HydrophobicContact CB-CD2 4.03Å; E201-Y397 HydrophobicContact CB-CE1 4.24Å; E201-Y397 HydrophobicContact CB-CE2 3.93Å; E201-Y397 HydrophobicContact CB-CG 4.24Å; E201-Y397 HydrophobicContact CG-CD1 4.37Å; E201-Y397 HydrophobicContact CG-CE1 3.92Å; E201-Y397 HydrophobicContact CG-CE2 4.31Å; E201-Y397 PolarHBondContact OE1-OH 2.99Å; E201-Y397 PolarHBondContact OE2-OH 3.38Å; H325-Y397 PolarHBondContact CE1-OH 3.44Å; H325-Y397 PolarHBondContact NE2-OH 3.44Å; T327-Y397 HydrophobicContact CG2-CD1 4.38Å; T327-Y397 HydrophobicContact CG2-CE1 3.71Å
398D97.8Very high94.6Very high23 Ų2370.2 Ų70.212%0.12336%0.364CS..  trans-127.4121.6175.1-160.6-43.1000112.7K74 C396 S400 V401 R409K74-D398 CarbonylContact O-C 3.5Å; K74-D398 WeakPolarHBondContact O-CA 3.22Å; C396-D398 PolarHBondContact O-N 2.83Å; D398-S400 PolarHBondContact O-N 2.73Å; D398-S400 VanDerWaalsContact OD1-CB 3.28Å; D398-S400 WeakPolarHBondContact OD1-CB 3.3Å; D398-S400 PolarHBondContact OD1-N 3.47Å; D398-S400 PolarHBondContact OD1-OG 3.24Å; D398-V401 WeakPolarHBondContact O-CG2 3.22Å; D398-V401 PolarHBondContact O-N 2.94Å; D398-R409 IonicContact OD1-CZ 3.31Å; D398-R409 IonicContact OD1-NH1 2.94Å; D398-R409 PolarHBondContact OD1-NH1 3.03Å; D398-R409 VanDerWaalsContact OD1-NH1 3.12Å; D398-R409 IonicContact OD1-NH2 3.88Å; D398-R409 PolarHBondContact OD1-NH2 3.38Å; D398-R409 IonicContact OD2-NH1 3.6Å
399D98Very high93.1Very high10 Ų1075.3 Ų75.35%0.05338%0.384CS..G310 helixtrans-61.3-26.4177.6-76.8-35.2000113.5K74 Y75 G76 F77 S78 V401 Y402 W403 V405K74-D399 VanDerWaalsContact O-CG 3.29Å; K74-D399 PolarHBondContact O-N 3Å; Y75-D399 WeakPolarHBondContact CA-OD1 3.48Å; Y75-D399 WeakPolarHBondContact CA-OD2 3.5Å; G76-D399 PolarHBondContact N-OD2 3.28Å; F77-D399 HydrophobicContact CB-CB 4.34Å; F77-D399 PolarHBondContact N-OD2 3.02Å; S78-D399 WeakPolarHBondContact CB-OD1 2.94Å; S78-D399 PolarHBondContact N-OD1 3.16Å; S78-D399 PolarHBondContact OG-OD1 3.17Å; D399-V401 PolarHBondContact O-N 3.19Å; D399-Y402 PolarHBondContact O-N 3.3Å; D399-Y402 VanDerWaalsContact O-N 3.07Å; D399-W403 HydrophobicContact CB-CB 4.48Å; D399-W403 WeakPolarHBondContact O-CB 3.48Å; D399-W403 VanDerWaalsContact O-CD1 3.32Å; D399-W403 PolarHBondContact O-N 2.77Å; D399-V405 HydrophobicContact CB-CG1 3.92Å
400S96.9Very high93Very high64 Ų6477.3 Ų77.345%0.44838%0.384SS..G310 helixtrans-62.8-16.2-17860.60000113.7D398D398-S400 PolarHBondContact O-N 2.73Å; D398-S400 VanDerWaalsContact OD1-CB 3.28Å; D398-S400 WeakPolarHBondContact OD1-CB 3.3Å; D398-S400 PolarHBondContact OD1-N 3.47Å; D398-S400 PolarHBondContact OD1-OG 3.24Å
401V97.1Very high92.9Very high55 Ų5578.7 Ų78.733%0.33339%0.392SS..G310 helixtrans-67-38.1175.1-176.30000111.5P391 N395 D398 D399P391-V401 HydrophobicContact CB-CG1 4.48Å; N395-V401 HydrophobicContact CB-CG2 3.87Å; N395-V401 WeakPolarHBondContact O-CG2 3.41Å; D398-V401 WeakPolarHBondContact O-CG2 3.22Å; D398-V401 PolarHBondContact O-N 2.94Å; D399-V401 PolarHBondContact O-N 3.19Å
402Y97.3Very high92.6Very high54 Ų5482.6 Ų82.621%0.21241%0.41CS..THydrogen-bonded Turntrans-119.3-17.4-172.3-58.2-51.4000114M1 S137 P138 G389 P391 D399M1-Y402 HydrophobicContact SD-CD1 3.53Å; M1-Y402 VanDerWaalsContact SD-CD1 3.53Å; M1-Y402 HydrophobicContact SD-CE1 3.22Å; M1-Y402 WeakPolarHBondContact SD-CE1 2.96Å; S137-Y402 WeakPolarHBondContact CA-OH 3.49Å; S137-Y402 VanDerWaalsContact CB-OH 3.24Å; S137-Y402 WeakPolarHBondContact CB-OH 3.44Å; P138-Y402 HydrophobicContact CG-CD2 4.39Å; P138-Y402 HydrophobicContact CG-CG 4.3Å; G389-Y402 PolarHBondContact O-OH 3.12Å; P391-Y402 VanDerWaalsContact CD-OH 3.27Å; P391-Y402 WeakPolarHBondContact CD-OH 3.45Å; D399-Y402 PolarHBondContact O-N 3.3Å; D399-Y402 VanDerWaalsContact O-N 3.07Å
403W97.5Very high92.4Very high97 Ų9784 Ų8437%0.36741%0.411SS..SBendtrans-119.9146.1-172.5-57.992.6000112.3F77 S78 D399 V405F77-W403 HydrophobicContact CB-CD2 3.97Å; F77-W403 HydrophobicContact CB-CG 3.98Å; F77-W403 HydrophobicContact CD2-CB 4.01Å; F77-W403 HydrophobicContact CD2-CD2 4.44Å; F77-W403 HydrophobicContact CD2-CG 4.16Å; S78-W403 VanDerWaalsContact OG-CD1 3.29Å; S78-W403 PolarHBondContact OG-NE1 3.27Å; D399-W403 HydrophobicContact CB-CB 4.48Å; D399-W403 WeakPolarHBondContact O-CB 3.48Å; D399-W403 VanDerWaalsContact O-CD1 3.32Å; D399-W403 PolarHBondContact O-N 2.77Å; W403-V405 HydrophobicContact CB-CG1 4.2Å; W403-V405 PolarHBondContact O-N 3.46Å; W403-V405 VanDerWaalsContact O-N 3.14Å
404K96.6Very high92.2Very high208 Ų20886.3 Ų86.390%0.90442%0.42SS*.  trans-74.2101.8162.2-176.3-179.7178.9-177.60108.2
405V94.6Very high91.9Very high43 Ų4381 Ų8126%0.26140%0.397SS..  trans-88.6149.7-179.2-63.90000112.6F77 D399 W403 R409F77-V405 HydrophobicContact CD2-CG1 4.38Å; F77-V405 HydrophobicContact CE2-CG1 4.33Å; D399-V405 HydrophobicContact CB-CG1 3.92Å; W403-V405 HydrophobicContact CB-CG1 4.2Å; W403-V405 PolarHBondContact O-N 3.46Å; W403-V405 VanDerWaalsContact O-N 3.14Å; V405-R409 VanDerWaalsContact CG1-NH2 3.28Å
406P90.3Very high91.6Very high76 Ų7680.9 Ų80.949%0.49439%0.394SS..  trans-58.9152.1172.3-23.234.1000112.3T408P406-T408 VanDerWaalsContact C-N 3.25Å; P406-T408 PolarHBondContact O-N 3.33Å
407K79.7Confident91Very high220 Ų22087.1 Ų87.196%0.95742%0.424SS*.SBendtrans-67.3-24.7-179.6-68.3-175.4178.8-178.70113.4
408T74.6Confident90.4Very high125 Ų12594.3 Ų94.377%0.76746%0.459SS*.  trans-116.1121.4176.347.10000108.2P406P406-T408 VanDerWaalsContact C-N 3.25Å; P406-T408 PolarHBondContact O-N 3.33Å
409R65.1Low89.8Confident156 Ų156100.7 Ų100.759%0.58949%0.489SS*.  trans-109.20176.4-75.6-172.5179.9176.1-0.5110D398 V405D398-R409 IonicContact OD1-CZ 3.31Å; D398-R409 IonicContact OD1-NH1 2.94Å; D398-R409 PolarHBondContact OD1-NH1 3.03Å; D398-R409 VanDerWaalsContact OD1-NH1 3.12Å; D398-R409 IonicContact OD1-NH2 3.88Å; D398-R409 PolarHBondContact OD1-NH2 3.38Å; D398-R409 IonicContact OD2-NH1 3.6Å; V405-R409 VanDerWaalsContact CG1-NH2 3.28Å

Retrieved 409 of 409 residues in 196.3 ms (Link to these results)

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