A0A096MWT6_PAPAN Loading...

CWH43-like N-terminal domain-containing protein

AlphaFold DB (A0A0D9QWQ6), UniProt , Accession A0A096MWT6, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 249 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
1M39.5Very low75Confident247 Ų247120.3 Ų120.3100%1.21762%0.623SS**  087.10-82.7172.6144.400107.5G3M1-G3 PolarHBondContact O-N 3.24Å; M1-G3 VanDerWaalsContact O-N 3.11Å
2D45.9Very low76.8Confident169 Ų169112.3 Ų112.390%0.90458%0.582SS**  trans-71.6102.9171-86.5-31000108K4D2-K4 PolarHBondContact O-N 3.29Å; D2-K4 VanDerWaalsContact O-N 3.08Å
3G50.1Low78.4Confident63 Ų63103.7 Ų103.765%0.64954%0.537SS*.  trans-55.1117.1170.600000108.1M1 K5M1-G3 PolarHBondContact O-N 3.24Å; M1-G3 VanDerWaalsContact O-N 3.11Å; G3-K5 VanDerWaalsContact C-N 3.34Å; G3-K5 PolarHBondContact O-N 3.43Å
4K60.2Low79.8Confident201 Ų201100.3 Ų100.387%0.87452%0.52SS*.  trans-55.298.5177.7-75.7179.2179175.10108.5D2 C6D2-K4 PolarHBondContact O-N 3.29Å; D2-K4 VanDerWaalsContact O-N 3.08Å; K4-C6 PolarHBondContact O-N 3.32Å
5K73.5Confident81Confident206 Ų20698.8 Ų98.890%0.89652%0.517SS*.  trans-68.6104.9175.3-70.4-176.1-180178.60107.3G3G3-K5 VanDerWaalsContact C-N 3.34Å; G3-K5 PolarHBondContact O-N 3.43Å
6C83.9Confident82.1Confident77 Ų7792.9 Ų92.952%0.5249%0.485SS..  trans-67.7135.5170-78.30000109.4K4 M10 R216K4-C6 PolarHBondContact O-N 3.32Å; C6-M10 HydrophobicContact CB-SD 3.74Å; C6-R216 HydrophobicContact CB-CB 4.45Å
7S92.6Very high83Confident18 Ų1888.6 Ų88.613%0.12646%0.464CS..  trans-66.6136.1175-179.90000111.6W9 M10 F215 R216 Y218S7-W9 PolarHBondContact O-N 3.33Å; S7-W9 VanDerWaalsContact O-N 3.11Å; S7-W9 PolarHBondContact OG-N 3.4Å; S7-M10 WeakPolarHBondContact O-CB 3.26Å; S7-M10 VanDerWaalsContact O-CG 3.23Å; S7-M10 WeakPolarHBondContact O-CG 3.11Å; S7-M10 PolarHBondContact O-N 3.09Å; S7-F215 WeakPolarHBondContact CB-O 3.32Å; S7-R216 WeakPolarHBondContact CB-O 3.35Å; S7-R216 PolarHBondContact N-O 3.08Å; S7-Y218 WeakPolarHBondContact CB-O 3.31Å; S7-Y218 PolarHBondContact OG-O 2.96Å
8V93Very high83.8Confident112 Ų11290.3 Ų90.368%0.67947%0.473SS*.G310 helixtrans-56.7-26.5174.7178.60000111.7M10 F11V8-M10 PolarHBondContact O-N 3.4Å; V8-F11 HydrophobicContact CG1-CD2 4.18Å; V8-F11 WeakPolarHBondContact O-CB 3.27Å; V8-F11 VanDerWaalsContact O-CD2 3.27Å; V8-F11 WeakPolarHBondContact O-CD2 3.23Å; V8-F11 PolarHBondContact O-N 3.33Å
9W94.4Very high84.6Confident73 Ų7390.4 Ų90.428%0.27747%0.47SS..G310 helixtrans-62.3-15.6177.5-67.3105.2000114S7 F11 L12 P13 L85 F215 Y220S7-W9 PolarHBondContact O-N 3.33Å; S7-W9 VanDerWaalsContact O-N 3.11Å; S7-W9 PolarHBondContact OG-N 3.4Å; W9-F11 PolarHBondContact O-N 3.02Å; W9-L12 HydrophobicContact CE3-CD2 4.38Å; W9-L12 PolarHBondContact O-N 3.13Å; W9-P13 WeakPolarHBondContact O-CD 3.23Å; W9-L85 HydrophobicContact CD2-CD1 4.39Å; W9-L85 HydrophobicContact CE3-CD1 3.55Å; W9-L85 HydrophobicContact CH2-CD1 4.4Å; W9-L85 HydrophobicContact CZ3-CD1 3.57Å; W9-F215 WeakPolarHBondContact O-CD2 3.28Å; W9-Y220 HydrophobicContact CB-CD2 3.99Å; W9-Y220 HydrophobicContact CB-CE2 4.1Å; W9-Y220 AromaticContact CD1-CD2 3.72Å; W9-Y220 AromaticContact CD2-CD2 3.62Å; W9-Y220 HydrophobicContact CD2-CD2 3.62Å; W9-Y220 HydrophobicContact CD2-CE2 4.46Å; W9-Y220 HydrophobicContact CD2-CG 4.46Å; W9-Y220 AromaticContact CE2-CD2 3.88Å; W9-Y220 HydrophobicContact CE3-CD2 4.19Å; W9-Y220 AromaticContact CG-CD2 3.5Å; W9-Y220 HydrophobicContact CG-CD2 3.5Å; W9-Y220 HydrophobicContact CG-CE2 4.12Å; W9-Y220 WeakPolarHBondContact CZ2-O 3.35Å; W9-Y220 AromaticContact NE1-CD2 3.92Å; W9-Y220 VanDerWaalsContact NE1-N 3.15Å; W9-Y220 PolarHBondContact NE1-O 2.89Å
10M95.5Very high85.3Confident41 Ų4186.1 Ų86.120%0.20245%0.447CS..G310 helixtrans-62.8-25.6170.776.8178.8-75.800113.3C6 S7 V8 P13 A212 R216C6-M10 HydrophobicContact CB-SD 3.74Å; S7-M10 WeakPolarHBondContact O-CB 3.26Å; S7-M10 VanDerWaalsContact O-CG 3.23Å; S7-M10 WeakPolarHBondContact O-CG 3.11Å; S7-M10 PolarHBondContact O-N 3.09Å; V8-M10 PolarHBondContact O-N 3.4Å; M10-P13 WeakPolarHBondContact O-CD 3.46Å; M10-P13 WeakPolarHBondContact O-CG 3.33Å; M10-A212 HydrophobicContact CB-CB 4.38Å; M10-A212 WeakPolarHBondContact CB-O 3.44Å; M10-A212 VanDerWaalsContact O-CB 3.28Å; M10-A212 WeakPolarHBondContact O-CB 3.19Å; M10-R216 HydrophobicContact CB-CB 3.91Å; M10-R216 HydrophobicContact SD-CB 4.04Å
11F96.2Very high85.9Confident116 Ų11683.4 Ų83.451%0.50944%0.436SS..Hα-helixtrans-74.3-26-179.7-67.1-67.1000112.6V8 W9 L14 V15V8-F11 HydrophobicContact CG1-CD2 4.18Å; V8-F11 WeakPolarHBondContact O-CB 3.27Å; V8-F11 VanDerWaalsContact O-CD2 3.27Å; V8-F11 WeakPolarHBondContact O-CD2 3.23Å; V8-F11 PolarHBondContact O-N 3.33Å; W9-F11 PolarHBondContact O-N 3.02Å; F11-L14 HydrophobicContact CD1-CD1 4.32Å; F11-L14 CarbonylContact O-C 3.54Å; F11-L14 PolarHBondContact O-N 3.29Å; F11-L14 VanDerWaalsContact O-N 3.08Å; F11-V15 WeakPolarHBondContact O-CB 3.43Å; F11-V15 WeakPolarHBondContact O-CG2 3.46Å; F11-V15 PolarHBondContact O-N 3.43Å
12L97.1Very high88.7Confident25 Ų2574.2 Ų74.213%0.13140%0.399CS..Hα-helixtrans-53.1-56.9-179.2175.369.7000113.1W9 L14 V15 F16 L78 V81 V82 L85 F215W9-L12 HydrophobicContact CE3-CD2 4.38Å; W9-L12 PolarHBondContact O-N 3.13Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 3.05Å; L12-V15 PolarHBondContact O-N 3.43Å; L12-F16 PolarHBondContact O-N 3.35Å; L12-L78 HydrophobicContact CD1-CD2 3.74Å; L12-V81 HydrophobicContact CD1-CG1 4.42Å; L12-V81 HydrophobicContact CD2-CB 4.39Å; L12-V81 HydrophobicContact CD2-CG1 3.68Å; L12-V82 HydrophobicContact CD2-CG2 3.81Å; L12-V82 HydrophobicContact CG-CG2 3.93Å; L12-L85 HydrophobicContact CD2-CD1 3.64Å; L12-F215 HydrophobicContact CD2-CE2 4.27Å
13P97.8Very high91.2Very high0 Ų066.4 Ų66.40%036%0.358CS..Hα-helixtrans-65.7-28.4176.723.2-33000113.4W9 M10 T17 F208 F211 A212 F215W9-P13 WeakPolarHBondContact O-CD 3.23Å; M10-P13 WeakPolarHBondContact O-CD 3.46Å; M10-P13 WeakPolarHBondContact O-CG 3.33Å; P13-T17 WeakPolarHBondContact O-CB 3.49Å; P13-T17 PolarHBondContact O-N 2.89Å; P13-T17 PolarHBondContact O-OG1 2.9Å; P13-T17 VanDerWaalsContact O-OG1 3.08Å; P13-F208 WeakPolarHBondContact CB-O 3.45Å; P13-F211 HydrophobicContact CB-CB 3.92Å; P13-F211 HydrophobicContact CG-CB 4.02Å; P13-A212 HydrophobicContact CG-CB 3.9Å; P13-A212 VanDerWaalsContact CG-N 3.29Å; P13-F215 HydrophobicContact CG-CD2 4.28Å
14L97.9Very high93.5Very high56 Ų5663.6 Ų63.629%0.29333%0.328SS..Hα-helixtrans-70.5-43.8176.5-61.4179000111.7F11 L12 T17 L18 A212F11-L14 HydrophobicContact CD1-CD1 4.32Å; F11-L14 CarbonylContact O-C 3.54Å; F11-L14 PolarHBondContact O-N 3.29Å; F11-L14 VanDerWaalsContact O-N 3.08Å; L12-L14 VanDerWaalsContact C-N 3.28Å; L12-L14 PolarHBondContact O-N 3.05Å; L14-T17 PolarHBondContact O-N 2.75Å; L14-L18 WeakPolarHBondContact O-CB 3.45Å; L14-L18 VanDerWaalsContact O-CG 3.27Å; L14-L18 WeakPolarHBondContact O-CG 3.39Å; L14-L18 PolarHBondContact O-N 2.61Å; L14-A212 HydrophobicContact CD1-CB 4.23Å; L14-A212 HydrophobicContact CD2-CB 3.78Å; L14-A212 HydrophobicContact CG-CB 3.78Å
15V97.8Very high95.3Very high78 Ų7858.2 Ų58.247%0.47330%0.303SS..Hα-helixtrans-60.9-47.8174.6170.30000109.3F11 L12 T17 L18 F19 L78F11-V15 WeakPolarHBondContact O-CB 3.43Å; F11-V15 WeakPolarHBondContact O-CG2 3.46Å; F11-V15 PolarHBondContact O-N 3.43Å; L12-V15 PolarHBondContact O-N 3.43Å; V15-T17 PolarHBondContact O-N 3.36Å; V15-L18 PolarHBondContact O-N 3.06Å; V15-F19 WeakPolarHBondContact O-CB 3.32Å; V15-F19 PolarHBondContact O-N 3.49Å; V15-L78 HydrophobicContact CG1-CD1 4.33Å
16F97.9Very high96.5Very high4 Ų452.7 Ų52.72%0.01828%0.282CS..Hα-helixtrans-51.4-53.6173.7168-98.2000112L12 T20 A75 L78 A79 L205 F208L12-F16 PolarHBondContact O-N 3.35Å; F16-T20 WeakPolarHBondContact O-CB 3.4Å; F16-T20 PolarHBondContact O-N 3.08Å; F16-T20 PolarHBondContact O-OG1 2.77Å; F16-A75 HydrophobicContact CD2-CB 4.31Å; F16-A75 HydrophobicContact CE2-CB 3.81Å; F16-A75 VanDerWaalsContact CE2-O 3.25Å; F16-A75 WeakPolarHBondContact CE2-O 3.48Å; F16-L78 HydrophobicContact CB-CB 4.12Å; F16-L78 HydrophobicContact CB-CD1 4.18Å; F16-L78 HydrophobicContact CD2-CB 3.85Å; F16-L78 HydrophobicContact CG-CB 4.43Å; F16-A79 HydrophobicContact CE2-CB 3.9Å; F16-A79 HydrophobicContact CZ-CB 4.32Å; F16-L205 HydrophobicContact CE1-CD2 3.9Å; F16-L205 HydrophobicContact CZ-CD2 4.13Å; F16-F208 HydrophobicContact CD1-CB 3.71Å; F16-F208 HydrophobicContact CD1-CD1 4.47Å; F16-F208 HydrophobicContact CD1-CG 4.17Å; F16-F208 HydrophobicContact CE1-CB 3.47Å; F16-F208 VanDerWaalsContact CE1-CB 3.47Å; F16-F208 HydrophobicContact CE1-CD1 4.01Å; F16-F208 AromaticContact CE1-CD2 3.98Å; F16-F208 HydrophobicContact CE1-CD2 3.98Å; F16-F208 AromaticContact CE1-CG 3.55Å; F16-F208 HydrophobicContact CE1-CG 3.55Å; F16-F208 HydrophobicContact CZ-CG 4.35Å
17T98.1Very high97.2Very high20 Ų2049 Ų4912%0.12326%0.257CS..Hα-helixtrans-63.9-49.2-177.5-68.50000112.5P13 L14 V15 S21 L205 G209P13-T17 WeakPolarHBondContact O-CB 3.49Å; P13-T17 PolarHBondContact O-N 2.89Å; P13-T17 PolarHBondContact O-OG1 2.9Å; P13-T17 VanDerWaalsContact O-OG1 3.08Å; L14-T17 PolarHBondContact O-N 2.75Å; V15-T17 PolarHBondContact O-N 3.36Å; T17-S21 WeakPolarHBondContact O-CB 3.45Å; T17-S21 PolarHBondContact O-N 3.41Å; T17-L205 HydrophobicContact CG2-CB 4.12Å; T17-L205 WeakPolarHBondContact CG2-O 3.42Å; T17-L205 PolarHBondContact OG1-O 3.14Å; T17-G209 WeakPolarHBondContact OG1-CA 3.3Å; T17-G209 PolarHBondContact OG1-N 3.3Å; T17-G209 VanDerWaalsContact OG1-N 3.15Å
18L97.8Very high97.5Very high120 Ų12048.9 Ų48.963%0.62825%0.254SS*.Hα-helixtrans-71.4-45.3-174.9-67.5174.3000111.8L14 V15 S21 A22L14-L18 WeakPolarHBondContact O-CB 3.45Å; L14-L18 VanDerWaalsContact O-CG 3.27Å; L14-L18 WeakPolarHBondContact O-CG 3.39Å; L14-L18 PolarHBondContact O-N 2.61Å; V15-L18 PolarHBondContact O-N 3.06Å; L18-S21 PolarHBondContact O-N 3.31Å; L18-A22 VanDerWaalsContact O-CB 3.25Å; L18-A22 WeakPolarHBondContact O-CB 3.24Å; L18-A22 PolarHBondContact O-N 2.95Å
19F97.7Very high97.7Very high92 Ų9248.7 Ų48.740%0.40424%0.244SC..Hα-helixtrans-61.9-48.3178.1177.2-94.1000111V15 A22 G23 V71 M74V15-F19 WeakPolarHBondContact O-CB 3.32Å; V15-F19 PolarHBondContact O-N 3.49Å; F19-A22 PolarHBondContact O-N 3.11Å; F19-G23 PolarHBondContact O-N 3.35Å; F19-V71 HydrophobicContact CE1-CG2 4.48Å; F19-M74 HydrophobicContact CD1-CB 4.45Å; F19-M74 HydrophobicContact CD1-CG 4.05Å; F19-M74 HydrophobicContact CE1-CB 3.68Å; F19-M74 HydrophobicContact CE1-CG 3.6Å; F19-M74 HydrophobicContact CZ-CB 4.29Å; F19-M74 HydrophobicContact CZ-CG 4.12Å
20T98.4Very high97.9Very high4 Ų446.9 Ų46.93%0.02524%0.24CC..Hα-helixtrans-65.5-43.4-179.3-49.20000111F16 G23 L24 V71 A75 L205F16-T20 WeakPolarHBondContact O-CB 3.4Å; F16-T20 PolarHBondContact O-N 3.08Å; F16-T20 PolarHBondContact O-OG1 2.77Å; T20-G23 PolarHBondContact O-N 3.05Å; T20-L24 HydrophobicContact CG2-CD1 4.16Å; T20-L24 HydrophobicContact CG2-CG 4.39Å; T20-L24 WeakPolarHBondContact O-CB 3.32Å; T20-L24 VanDerWaalsContact O-CG 3.25Å; T20-L24 WeakPolarHBondContact O-CG 3.48Å; T20-L24 PolarHBondContact O-N 2.98Å; T20-V71 HydrophobicContact CG2-CG1 4.14Å; T20-A75 HydrophobicContact CG2-CB 3.91Å; T20-A75 WeakPolarHBondContact OG1-CB 3.39Å; T20-L205 HydrophobicContact CG2-CD1 4.24Å; T20-L205 HydrophobicContact CG2-CD2 3.83Å
21S98.4Very high97.9Very high30 Ų3045 Ų4521%0.2123%0.231CC..Hα-helixtrans-61.7-50.3177.9-173.70000111.5T17 L18 G23 L24 W25 M202T17-S21 WeakPolarHBondContact O-CB 3.45Å; T17-S21 PolarHBondContact O-N 3.41Å; L18-S21 PolarHBondContact O-N 3.31Å; S21-G23 VanDerWaalsContact C-N 3.34Å; S21-G23 PolarHBondContact O-N 3.34Å; S21-L24 PolarHBondContact O-N 3.05Å; S21-W25 PolarHBondContact O-N 2.94Å; S21-M202 PolarHBondContact OG-SD 2.58Å
22A98.4Very high97.9Very high53 Ų5341 Ų4144%0.43822%0.216SC..Hα-helixtrans-60.2-45178.500000111.5L18 F19 L24 W25 I26L18-A22 VanDerWaalsContact O-CB 3.25Å; L18-A22 WeakPolarHBondContact O-CB 3.24Å; L18-A22 PolarHBondContact O-N 2.95Å; F19-A22 PolarHBondContact O-N 3.11Å; A22-L24 PolarHBondContact O-N 3.05Å; A22-W25 PolarHBondContact O-N 3.03Å; A22-I26 VanDerWaalsContact O-CG1 3.3Å; A22-I26 WeakPolarHBondContact O-CG1 3.49Å; A22-I26 PolarHBondContact O-N 3.03Å
23G98.4Very high97.8Very high5 Ų547 Ų475%0.05224%0.243CC..Hα-helixtrans-59-46.1177.600000113.1F19 T20 S21 W25 I26 V27F19-G23 PolarHBondContact O-N 3.35Å; T20-G23 PolarHBondContact O-N 3.05Å; S21-G23 VanDerWaalsContact C-N 3.34Å; S21-G23 PolarHBondContact O-N 3.34Å; G23-W25 PolarHBondContact O-N 3.31Å; G23-I26 WeakPolarHBondContact O-CB 3.35Å; G23-I26 PolarHBondContact O-N 3.22Å; G23-V27 WeakPolarHBondContact O-CG2 3.46Å; G23-V27 PolarHBondContact O-N 3.44Å
24L98.6Very high97.7Very high4 Ų450.5 Ų50.52%0.02126%0.262CS..Hα-helixtrans-65-39.4177.3-68.2177.8000112.3T20 S21 A22 I26 V27 Y28 I55 F68 V71 M72 W198 V201 L205T20-L24 HydrophobicContact CG2-CD1 4.16Å; T20-L24 HydrophobicContact CG2-CG 4.39Å; T20-L24 WeakPolarHBondContact O-CB 3.32Å; T20-L24 VanDerWaalsContact O-CG 3.25Å; T20-L24 WeakPolarHBondContact O-CG 3.48Å; T20-L24 PolarHBondContact O-N 2.98Å; S21-L24 PolarHBondContact O-N 3.05Å; A22-L24 PolarHBondContact O-N 3.05Å; L24-I26 VanDerWaalsContact C-N 3.34Å; L24-V27 WeakPolarHBondContact O-CB 3.35Å; L24-V27 PolarHBondContact O-N 3.44Å; L24-Y28 PolarHBondContact O-N 3.11Å; L24-I55 HydrophobicContact CD2-CG2 4.02Å; L24-F68 HydrophobicContact CD2-CD2 3.74Å; L24-F68 HydrophobicContact CD2-CE2 3.56Å; L24-V71 HydrophobicContact CD2-CG1 4.48Å; L24-V71 HydrophobicContact CG-CG1 4.44Å; L24-M72 HydrophobicContact CD2-SD 4.17Å; L24-W198 HydrophobicContact CB-CH2 4.37Å; L24-W198 HydrophobicContact CB-CZ3 4.33Å; L24-W198 WeakPolarHBondContact O-CH2 3.5Å; L24-V201 HydrophobicContact CD1-CG1 3.62Å; L24-L205 HydrophobicContact CD1-CD1 4.45Å
25W98.5Very high97.4Very high88 Ų8852.8 Ų52.833%0.33327%0.274SS..Hα-helixtrans-64.8-37.9174.2-79.8113.3000112.4S21 A22 G23 Y28 F29 L40 W198 M202S21-W25 PolarHBondContact O-N 2.94Å; A22-W25 PolarHBondContact O-N 3.03Å; G23-W25 PolarHBondContact O-N 3.31Å; W25-Y28 AromaticContact CE3-CD1 3.8Å; W25-Y28 HydrophobicContact CE3-CD1 3.8Å; W25-Y28 HydrophobicContact CE3-CE1 4.37Å; W25-Y28 HydrophobicContact CE3-CG 4.28Å; W25-Y28 AromaticContact CZ3-CD1 3.93Å; W25-Y28 HydrophobicContact CZ3-CD1 3.93Å; W25-Y28 HydrophobicContact CZ3-CE1 4.1Å; W25-Y28 HydrophobicContact CZ3-CG 4.42Å; W25-Y28 WeakPolarHBondContact O-CB 3.03Å; W25-Y28 PolarHBondContact O-N 3.36Å; W25-F29 HydrophobicContact CB-CE2 4.28Å; W25-F29 HydrophobicContact CE3-CE2 4.25Å; W25-F29 HydrophobicContact CE3-CZ 4.37Å; W25-F29 WeakPolarHBondContact O-CD2 3.45Å; W25-F29 PolarHBondContact O-N 3.08Å; W25-L40 HydrophobicContact CH2-CD1 3.84Å; W25-L40 HydrophobicContact CZ3-CD1 3.85Å; W25-W198 AromaticContact CD2-CZ3 4Å; W25-W198 HydrophobicContact CD2-CZ3 4Å; W25-W198 HydrophobicContact CE3-CH2 4.43Å; W25-W198 HydrophobicContact CE3-CZ3 4.2Å; W25-W198 HydrophobicContact CG-CZ3 4.47Å; W25-W198 HydrophobicContact CH2-CE3 4.34Å; W25-W198 HydrophobicContact CH2-CZ3 4.49Å; W25-W198 HydrophobicContact CZ2-CE3 4.19Å; W25-W198 HydrophobicContact CZ2-CZ3 4.31Å; W25-W198 HydrophobicContact CZ3-CZ3 4.44Å; W25-M202 HydrophobicContact CZ2-CE 4.29Å; W25-M202 VanDerWaalsContact NE1-CE 3.29Å
26I98.4Very high97Very high90 Ų9053 Ų5346%0.46227%0.269SS..Hα-helixtrans-60.9-47.9173.2-69.8164.3000110.3A22 G23 L24 Y28 F29 I30 V67A22-I26 VanDerWaalsContact O-CG1 3.3Å; A22-I26 WeakPolarHBondContact O-CG1 3.49Å; A22-I26 PolarHBondContact O-N 3.03Å; G23-I26 WeakPolarHBondContact O-CB 3.35Å; G23-I26 PolarHBondContact O-N 3.22Å; L24-I26 VanDerWaalsContact C-N 3.34Å; I26-Y28 VanDerWaalsContact C-N 3.26Å; I26-Y28 PolarHBondContact O-N 3.33Å; I26-F29 PolarHBondContact O-N 3.01Å; I26-F29 VanDerWaalsContact O-N 3.15Å; I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.35Å; I26-I30 VanDerWaalsContact O-CG1 3.31Å; I26-I30 WeakPolarHBondContact O-CG1 3.49Å; I26-I30 PolarHBondContact O-N 2.83Å; I26-V67 HydrophobicContact CG2-CG1 4.26Å
27V98.4Very high96.9Very high1 Ų152.9 Ų52.91%0.00627%0.269CS..Hα-helixtrans-54.7-44.7175.1170.60000111G23 L24 A31 A58 A64 V67 F68G23-V27 WeakPolarHBondContact O-CG2 3.46Å; G23-V27 PolarHBondContact O-N 3.44Å; L24-V27 WeakPolarHBondContact O-CB 3.35Å; L24-V27 PolarHBondContact O-N 3.44Å; V27-A31 WeakPolarHBondContact O-CB 3.2Å; V27-A31 PolarHBondContact O-N 3.36Å; V27-A58 HydrophobicContact CG1-CB 4.05Å; V27-A64 HydrophobicContact CG1-CB 4.28Å; V27-V67 HydrophobicContact CG2-CB 3.99Å; V27-V67 HydrophobicContact CG2-CG1 3.83Å; V27-F68 HydrophobicContact CG1-CB 4.13Å; V27-F68 HydrophobicContact CG1-CD2 4.32Å; V27-F68 HydrophobicContact CG2-CB 3.85Å; V27-F68 HydrophobicContact CG2-CD2 4.43Å
28Y98.3Very high96.6Very high15 Ų1554.1 Ų54.16%0.05927%0.274CS..Hα-helixtrans-60.1-48.2175.9166.4-95.7000112.9L24 W25 I26 A31 V32 I37 P39 L40 P53 W198L24-Y28 PolarHBondContact O-N 3.11Å; W25-Y28 AromaticContact CE3-CD1 3.8Å; W25-Y28 HydrophobicContact CE3-CD1 3.8Å; W25-Y28 HydrophobicContact CE3-CE1 4.37Å; W25-Y28 HydrophobicContact CE3-CG 4.28Å; W25-Y28 AromaticContact CZ3-CD1 3.93Å; W25-Y28 HydrophobicContact CZ3-CD1 3.93Å; W25-Y28 HydrophobicContact CZ3-CE1 4.1Å; W25-Y28 HydrophobicContact CZ3-CG 4.42Å; W25-Y28 WeakPolarHBondContact O-CB 3.03Å; W25-Y28 PolarHBondContact O-N 3.36Å; I26-Y28 VanDerWaalsContact C-N 3.26Å; I26-Y28 PolarHBondContact O-N 3.33Å; Y28-A31 PolarHBondContact O-N 2.85Å; Y28-V32 HydrophobicContact CD1-CG2 4.48Å; Y28-V32 HydrophobicContact CD2-CG2 4.12Å; Y28-V32 HydrophobicContact CE1-CG2 4.06Å; Y28-V32 HydrophobicContact CE2-CG2 3.65Å; Y28-V32 WeakPolarHBondContact O-CG2 3.28Å; Y28-V32 PolarHBondContact O-N 3.48Å; Y28-I37 HydrophobicContact CD2-CD1 3.8Å; Y28-I37 HydrophobicContact CE2-CD1 4.18Å; Y28-P39 WeakPolarHBondContact OH-CA 3.22Å; Y28-L40 HydrophobicContact CD2-CD1 4.36Å; Y28-L40 HydrophobicContact CE2-CB 4.44Å; Y28-L40 HydrophobicContact CE2-CD1 3.86Å; Y28-L40 HydrophobicContact CE2-CG 3.77Å; Y28-L40 PolarHBondContact OH-N 2.95Å; Y28-P53 HydrophobicContact CD2-CB 4.48Å; Y28-P53 HydrophobicContact CE2-CB 4.05Å; Y28-W198 AromaticContact CD2-CZ2 3.87Å; Y28-W198 HydrophobicContact CD2-CZ2 3.87Å; Y28-W198 HydrophobicContact CG-CH2 4.24Å; Y28-W198 HydrophobicContact CG-CZ2 4.01Å
29F98.1Very high96.4Very high108 Ų10850.4 Ų50.447%0.47426%0.257SS..Hα-helixtrans-65.1-41.3-178.7-72.2-60.4000111.8W25 I26 A31 V32 E33W25-F29 HydrophobicContact CB-CE2 4.28Å; W25-F29 HydrophobicContact CE3-CE2 4.25Å; W25-F29 HydrophobicContact CE3-CZ 4.37Å; W25-F29 WeakPolarHBondContact O-CD2 3.45Å; W25-F29 PolarHBondContact O-N 3.08Å; I26-F29 PolarHBondContact O-N 3.01Å; I26-F29 VanDerWaalsContact O-N 3.15Å; F29-A31 PolarHBondContact O-N 3.34Å; F29-V32 PolarHBondContact O-N 3.32Å; F29-E33 WeakPolarHBondContact O-CB 3.37Å; F29-E33 WeakPolarHBondContact O-CG 3.33Å; F29-E33 PolarHBondContact O-N 3.3Å
30I97.8Very high96.2Very high35 Ų3547.3 Ų47.318%0.17925%0.245CC..Hα-helixtrans-57.3-50.5173.2-64.6167.7000110I26 V32 E33 D34 P63 A64 V67I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.35Å; I26-I30 VanDerWaalsContact O-CG1 3.31Å; I26-I30 WeakPolarHBondContact O-CG1 3.49Å; I26-I30 PolarHBondContact O-N 2.83Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 3.33Å; I30-E33 PolarHBondContact O-N 3.28Å; I30-D34 WeakPolarHBondContact O-CB 3.36Å; I30-D34 PolarHBondContact O-N 2.97Å; I30-P63 HydrophobicContact CG2-CG 3.96Å; I30-A64 HydrophobicContact CB-CB 4.18Å; I30-A64 HydrophobicContact CG2-CB 3.77Å; I30-V67 HydrophobicContact CD1-CG2 4.12Å
31A96.6Very high95.7Very high1 Ų153.8 Ų53.81%0.00828%0.279CS..Hα-helixtrans-65-29.1-178.600000113.7V27 Y28 F29 K36 I37 A58V27-A31 WeakPolarHBondContact O-CB 3.2Å; V27-A31 PolarHBondContact O-N 3.36Å; Y28-A31 PolarHBondContact O-N 2.85Å; F29-A31 PolarHBondContact O-N 3.34Å; A31-K36 HydrophobicContact CB-CB 4.4Å; A31-K36 WeakPolarHBondContact O-CB 3.2Å; A31-K36 PolarHBondContact O-N 3.37Å; A31-I37 HydrophobicContact CB-CD1 3.7Å; A31-I37 HydrophobicContact CB-CG1 3.87Å; A31-I37 PolarHBondContact O-N 3.46Å; A31-A58 HydrophobicContact CB-CB 3.97Å
32V95.6Very high95.2Very high33 Ų3353.7 Ų53.720%0.228%0.278CS..Hα-helixtrans-73.8-44.1173.1168.80000111.1Y28 F29 I30 D34 D35 I37 P39Y28-V32 HydrophobicContact CD1-CG2 4.48Å; Y28-V32 HydrophobicContact CD2-CG2 4.12Å; Y28-V32 HydrophobicContact CE1-CG2 4.06Å; Y28-V32 HydrophobicContact CE2-CG2 3.65Å; Y28-V32 WeakPolarHBondContact O-CG2 3.28Å; Y28-V32 PolarHBondContact O-N 3.48Å; F29-V32 PolarHBondContact O-N 3.32Å; I30-V32 VanDerWaalsContact C-N 3.27Å; I30-V32 PolarHBondContact O-N 3.33Å; V32-D34 VanDerWaalsContact C-N 3.34Å; V32-D35 PolarHBondContact O-N 3.12Å; V32-I37 HydrophobicContact CG2-CD1 4.11Å; V32-I37 HydrophobicContact CG2-CG1 3.82Å; V32-P39 HydrophobicContact CG1-CG 4.08Å
33E95.8Very high94.2Very high149 Ų14955 Ų5570%0.69629%0.29SS*.Hα-helixtrans-65-37.4178.5-74.2175.5-174.500112F29 I30 D35F29-E33 WeakPolarHBondContact O-CB 3.37Å; F29-E33 WeakPolarHBondContact O-CG 3.33Å; F29-E33 PolarHBondContact O-N 3.3Å; I30-E33 PolarHBondContact O-N 3.28Å; E33-D35 PolarHBondContact O-N 3.26Å
34D94.1Very high92.6Very high75 Ų7559.9 Ų59.940%0.40131%0.311SS..THydrogen-bonded Turntrans-80.911.2176-70.8-17.6000113.3I30 V32 K36 P63I30-D34 WeakPolarHBondContact O-CB 3.36Å; I30-D34 PolarHBondContact O-N 2.97Å; V32-D34 VanDerWaalsContact C-N 3.34Å; D34-K36 HydrophobicContact CB-CG 4.05Å; D34-K36 PolarHBondContact O-N 3.37Å; D34-K36 VanDerWaalsContact O-N 3.08Å; D34-P63 WeakPolarHBondContact OD2-CD 3.49Å
35D91.6Very high90.4Very high103 Ų10370.3 Ų70.355%0.55135%0.35SS*.THydrogen-bonded Turntrans59.519.4177-76.5-39.7000115.1V32 E33 K50V32-D35 PolarHBondContact O-N 3.12Å; E33-D35 PolarHBondContact O-N 3.26Å; D35-K50 WeakPolarHBondContact O-CD 3.36Å; D35-K50 WeakPolarHBondContact O-CE 3.44Å; D35-K50 IonicContact OD1-NZ 2.55Å; D35-K50 PolarHBondContact OD1-NZ 3.06Å
36K91.1Very high88.3Confident84 Ų8475.1 Ų75.137%0.36537%0.373SS..SBendtrans-76.8-36.3-178-61-61.9-171.1155.70113.6A31 D34 D61A31-K36 HydrophobicContact CB-CB 4.4Å; A31-K36 WeakPolarHBondContact O-CB 3.2Å; A31-K36 PolarHBondContact O-N 3.37Å; D34-K36 HydrophobicContact CB-CG 4.05Å; D34-K36 PolarHBondContact O-N 3.37Å; D34-K36 VanDerWaalsContact O-N 3.08Å; K36-D61 HydrophobicContact CD-CB 4.46Å; K36-D61 WeakPolarHBondContact CD-OD2 3.36Å; K36-D61 VanDerWaalsContact CE-OD2 3.32Å; K36-D61 WeakPolarHBondContact CE-OD2 3.47Å; K36-D61 IonicContact NZ-OD2 2.82Å; K36-D61 PolarHBondContact NZ-OD2 2.99Å
37I94Very high86Confident1 Ų177.3 Ų77.31%0.00539%0.393CS..BIsolated β-bridgetrans-130.5158.3-17863.8179.6000112.2Y28 A31 V32 H51 P53 I57 A58Y28-I37 HydrophobicContact CD2-CD1 3.8Å; Y28-I37 HydrophobicContact CE2-CD1 4.18Å; A31-I37 HydrophobicContact CB-CD1 3.7Å; A31-I37 HydrophobicContact CB-CG1 3.87Å; A31-I37 PolarHBondContact O-N 3.46Å; V32-I37 HydrophobicContact CG2-CD1 4.11Å; V32-I37 HydrophobicContact CG2-CG1 3.82Å; I37-H51 WeakPolarHBondContact CA-O 3.29Å; I37-P53 HydrophobicContact CB-CB 4.42Å; I37-P53 HydrophobicContact CD1-CB 3.93Å; I37-P53 HydrophobicContact CG1-CB 4.42Å; I37-I57 HydrophobicContact CG2-CB 4.26Å; I37-I57 HydrophobicContact CG2-CG2 3.67Å; I37-A58 HydrophobicContact CD1-CB 3.7Å
38L93.1Very high84.2Confident45 Ų4580.1 Ų80.124%0.23642%0.422CS..  trans-74.6143.4170.9-68.6172.7000111.4K50 H51 P53 M191L38-K50 HydrophobicContact CD2-CB 3.84Å; L38-K50 HydrophobicContact CD2-CD 4.2Å; L38-K50 HydrophobicContact CG-CB 3.83Å; L38-H51 PolarHBondContact N-O 2.9Å; L38-P53 WeakPolarHBondContact O-CB 3.29Å; L38-P53 VanDerWaalsContact O-CG 3.24Å; L38-P53 WeakPolarHBondContact O-CG 3.5Å; L38-M191 HydrophobicContact CB-SD 4.41Å; L38-M191 HydrophobicContact CD1-SD 4.01Å
39P93.8Very high82.4Confident43 Ų4386.1 Ų86.128%0.27946%0.461SS..  trans-57.5144.6170.1-26.133.8000112.8Y28 V32 N41 S42Y28-P39 WeakPolarHBondContact OH-CA 3.22Å; V32-P39 HydrophobicContact CG1-CG 4.08Å; P39-N41 VanDerWaalsContact CB-OD1 3.28Å; P39-N41 WeakPolarHBondContact CB-OD1 3.44Å; P39-N41 PolarHBondContact O-N 3.42Å; P39-N41 VanDerWaalsContact O-N 3.13Å; P39-S42 WeakPolarHBondContact CD-OG 3.44Å; P39-S42 WeakPolarHBondContact O-CB 3.27Å; P39-S42 PolarHBondContact O-N 2.86Å; P39-S42 PolarHBondContact O-OG 2.86Å
40L92Very high81.3Confident26 Ų2684.7 Ų84.714%0.13645%0.454CS..THydrogen-bonded Turntrans-55.7-31.8-179.3-84.8164.6000114.2W25 Y28 S42 P53 R195 W198W25-L40 HydrophobicContact CH2-CD1 3.84Å; W25-L40 HydrophobicContact CZ3-CD1 3.85Å; Y28-L40 HydrophobicContact CD2-CD1 4.36Å; Y28-L40 HydrophobicContact CE2-CB 4.44Å; Y28-L40 HydrophobicContact CE2-CD1 3.86Å; Y28-L40 HydrophobicContact CE2-CG 3.77Å; Y28-L40 PolarHBondContact OH-N 2.95Å; L40-S42 VanDerWaalsContact C-N 3.29Å; L40-S42 PolarHBondContact O-N 2.69Å; L40-P53 HydrophobicContact CD2-CB 4.26Å; L40-P53 HydrophobicContact CD2-CG 3.69Å; L40-P53 HydrophobicContact CG-CB 4.25Å; L40-P53 HydrophobicContact CG-CG 3.97Å; L40-R195 HydrophobicContact CD2-CG 3.98Å; L40-R195 VanDerWaalsContact O-CZ 3.29Å; L40-R195 PolarHBondContact O-NE 3.38Å; L40-R195 PolarHBondContact O-NH2 3.39Å; L40-W198 HydrophobicContact CD1-CD2 4.19Å; L40-W198 HydrophobicContact CD1-CG 4.15Å; L40-W198 HydrophobicContact CD2-CG 4.18Å
41N89.7Confident80.8Confident140 Ų14088.4 Ų88.475%0.74947%0.471SS*.THydrogen-bonded Turntrans-82.7-0.617964.9-12.9000114P39P39-N41 VanDerWaalsContact CB-OD1 3.28Å; P39-N41 WeakPolarHBondContact CB-OD1 3.44Å; P39-N41 PolarHBondContact O-N 3.42Å; P39-N41 VanDerWaalsContact O-N 3.13Å
42S86.6Confident80.6Confident28 Ų2889 Ų8920%0.19648%0.475CS..  trans-64.2140.4-178.9-58.30000112.2P39 L40 R195P39-S42 WeakPolarHBondContact CD-OG 3.44Å; P39-S42 WeakPolarHBondContact O-CB 3.27Å; P39-S42 PolarHBondContact O-N 2.86Å; P39-S42 PolarHBondContact O-OG 2.86Å; L40-S42 VanDerWaalsContact C-N 3.29Å; L40-S42 PolarHBondContact O-N 2.69Å; S42-R195 PolarHBondContact O-NH2 2.86Å
43A78Confident80.5Confident82 Ų8287.4 Ų87.468%0.67847%0.465SS*.  trans-74.7149.5167.700000110.2R45A43-R45 PolarHBondContact O-N 3.45Å
44E64.1Low80.6Confident107 Ų10780.8 Ų80.850%0.543%0.434SS..SBendtrans-59.86.4-176.2-79.3-174.7146.300116.4K46 I189 M191 Y192E44-K46 PolarHBondContact O-N 3.4Å; E44-I189 VanDerWaalsContact OE1-CG2 3.3Å; E44-I189 WeakPolarHBondContact OE1-CG2 3.24Å; E44-M191 HydrophobicContact CG-CB 3.78Å; E44-M191 HydrophobicContact CG-CG 3.95Å; E44-Y192 VanDerWaalsContact CD-CE2 3.44Å; E44-Y192 HydrophobicContact CG-CE2 4.19Å; E44-Y192 WeakPolarHBondContact OE1-CD2 3.4Å; E44-Y192 VanDerWaalsContact OE1-CE2 3.32Å; E44-Y192 WeakPolarHBondContact OE1-CE2 3.19Å
45R52.8Low80.7Confident222 Ų22277.9 Ų77.984%0.83842%0.418SS*.  trans-97.39.3-150.9-149.4-179.1174.3163.10.4116.6A43 P47A43-R45 PolarHBondContact O-N 3.45Å; R45-P47 WeakPolarHBondContact O-CD 3.34Å
46K54.1Low80.9Confident190 Ų19073.8 Ų73.883%0.82640%0.398SS*.  trans-118.696.2175.9-71.1-167.3179.1-177.30111.4E44 G48E44-K46 PolarHBondContact O-N 3.4Å; K46-G48 PolarHBondContact O-N 3.02Å
47P51.3Low81.1Confident135 Ų13571.4 Ų71.488%0.87739%0.389SS*.  trans-66.9120.5164.927.6-29.5000108R45R45-P47 WeakPolarHBondContact O-CD 3.34Å
48G59.8Low81.3Confident60 Ų6071.5 Ų71.562%0.61939%0.39SS*.SBendtrans124.4116.8170.200000113.7K46K46-G48 PolarHBondContact O-N 3.02Å
49V61.3Low81.4Confident142 Ų14269.4 Ų69.486%0.86138%0.379SS*.SBendtrans103.1-41.9159.8-166.20000117.2
50K74.1Confident81.6Confident77 Ų7768 Ų6834%0.33537%0.369SS..  trans-117.7142-171.6-65.3-174.5-177.5-1780114.4D35 L38D35-K50 WeakPolarHBondContact O-CD 3.36Å; D35-K50 WeakPolarHBondContact O-CE 3.44Å; D35-K50 IonicContact OD1-NZ 2.55Å; D35-K50 PolarHBondContact OD1-NZ 3.06Å; L38-K50 HydrophobicContact CD2-CB 3.84Å; L38-K50 HydrophobicContact CD2-CD 4.2Å; L38-K50 HydrophobicContact CG-CB 3.83Å
51H87.4Confident81.7Confident114 Ų11469.6 Ų69.653%0.52838%0.378SS..BIsolated β-bridgetrans-74.5152.1178.7-62.7-81.3000111.8I37 L38 I57I37-H51 WeakPolarHBondContact CA-O 3.29Å; L38-H51 PolarHBondContact N-O 2.9Å; H51-I57 HydrophobicContact CB-CD1 3.84Å; H51-I57 HydrophobicContact CB-CG2 3.77Å
52A91.8Very high82.1Confident12 Ų1267.1 Ų67.110%0.09937%0.369CS..  trans-61.2149.2168.100000110.2Y54 H190 M191 A194A52-Y54 HydrophobicContact CB-CD2 3.99Å; A52-Y54 HydrophobicContact CB-CE2 3.71Å; A52-Y54 PolarHBondContact O-N 2.78Å; A52-H190 HydrophobicContact CB-CB 3.9Å; A52-M191 HydrophobicContact CB-SD 3.74Å; A52-A194 HydrophobicContact CB-CB 4.28Å
53P95.1Very high82.6Confident0 Ų069.2 Ų69.20%038%0.382CS..  trans-77.558.5-17229.3-33.4000113.4Y28 I37 L38 L40 M191 A194 W198Y28-P53 HydrophobicContact CD2-CB 4.48Å; Y28-P53 HydrophobicContact CE2-CB 4.05Å; I37-P53 HydrophobicContact CB-CB 4.42Å; I37-P53 HydrophobicContact CD1-CB 3.93Å; I37-P53 HydrophobicContact CG1-CB 4.42Å; L38-P53 WeakPolarHBondContact O-CB 3.29Å; L38-P53 VanDerWaalsContact O-CG 3.24Å; L38-P53 WeakPolarHBondContact O-CG 3.5Å; L40-P53 HydrophobicContact CD2-CB 4.26Å; L40-P53 HydrophobicContact CD2-CG 3.69Å; L40-P53 HydrophobicContact CG-CB 4.25Å; L40-P53 HydrophobicContact CG-CG 3.97Å; P53-M191 VanDerWaalsContact CD-SD 3.6Å; P53-M191 HydrophobicContact CG-CE 4.1Å; P53-A194 HydrophobicContact CG-CB 4.2Å; P53-W198 PolarHBondContact O-NE1 3.05Å
54Y96.7Very high83.5Confident11 Ų1165.4 Ų65.44%0.04335%0.351CS..  trans-67.8144.1166.7-64.6-80.6000109.7A52 S56 I57 A58 Y181 M185 H190 A193 A194 Q197A52-Y54 HydrophobicContact CB-CD2 3.99Å; A52-Y54 HydrophobicContact CB-CE2 3.71Å; A52-Y54 PolarHBondContact O-N 2.78Å; Y54-S56 VanDerWaalsContact C-N 3.25Å; Y54-S56 PolarHBondContact O-N 3.4Å; Y54-I57 HydrophobicContact CD2-CD1 3.68Å; Y54-I57 HydrophobicContact CD2-CG1 4.42Å; Y54-I57 HydrophobicContact CG-CD1 4.38Å; Y54-I57 PolarHBondContact O-N 3.08Å; Y54-A58 WeakPolarHBondContact O-CB 3.49Å; Y54-A58 PolarHBondContact O-N 3.08Å; Y54-Y181 HydrophobicContact CD1-CE2 4.26Å; Y54-Y181 AromaticContact CE1-CE2 3.8Å; Y54-Y181 HydrophobicContact CE1-CE2 3.8Å; Y54-M185 HydrophobicContact CE1-SD 4.15Å; Y54-M185 PolarHBondContact OH-SD 3.37Å; Y54-H190 HydrophobicContact CE2-CB 4.11Å; Y54-H190 AromaticContact CE2-ND1 3.99Å; Y54-H190 AromaticContact CZ-ND1 3.89Å; Y54-H190 VanDerWaalsContact OH-CA 3.25Å; Y54-H190 WeakPolarHBondContact OH-CA 3.06Å; Y54-H190 WeakPolarHBondContact OH-CB 3.37Å; Y54-H190 PolarHBondContact OH-ND1 2.82Å; Y54-H190 PolarHBondContact OH-O 3.42Å; Y54-A193 HydrophobicContact CE1-CB 4Å; Y54-A193 WeakPolarHBondContact OH-CB 3.36Å; Y54-A194 HydrophobicContact CD1-CB 3.85Å; Y54-A194 HydrophobicContact CD2-CB 4.27Å; Y54-A194 HydrophobicContact CE1-CB 3.92Å; Y54-A194 HydrophobicContact CE2-CB 4.36Å; Y54-A194 HydrophobicContact CG-CB 4.05Å; Y54-Q197 VanDerWaalsContact CA-OE1 3.25Å
55I97.1Very high85.1Confident13 Ų1360.5 Ų60.57%0.06733%0.329CS..Hα-helixtrans-60.6-40177.6-67.7167000110.5L24 I57 A58 G59 F68 W198 V201L24-I55 HydrophobicContact CD2-CG2 4.02Å; I55-I57 VanDerWaalsContact C-N 3.32Å; I55-I57 PolarHBondContact O-N 3.13Å; I55-A58 PolarHBondContact O-N 3.23Å; I55-G59 PolarHBondContact O-N 3.16Å; I55-F68 HydrophobicContact CG2-CD2 4.5Å; I55-F68 HydrophobicContact CG2-CE2 3.64Å; I55-F68 HydrophobicContact CG2-CZ 4.23Å; I55-W198 HydrophobicContact CD1-CD2 3.87Å; I55-W198 HydrophobicContact CD1-CE3 4.05Å; I55-W198 HydrophobicContact CD1-CG 4.28Å; I55-W198 HydrophobicContact CD1-CH2 4.47Å; I55-W198 HydrophobicContact CD1-CZ2 4.32Å; I55-W198 HydrophobicContact CD1-CZ3 4.35Å; I55-W198 HydrophobicContact CG1-CD2 3.78Å; I55-W198 HydrophobicContact CG1-CE3 4.23Å; I55-W198 HydrophobicContact CG1-CG 4.3Å; I55-W198 HydrophobicContact CG1-CH2 3.98Å; I55-W198 HydrophobicContact CG1-CZ2 3.48Å; I55-W198 VanDerWaalsContact CG1-CZ2 3.48Å; I55-W198 HydrophobicContact CG1-CZ3 4.33Å; I55-V201 HydrophobicContact CD1-CB 3.93Å; I55-V201 HydrophobicContact CD1-CG1 4.25Å; I55-V201 HydrophobicContact CD1-CG2 3.6Å
56S94.6Very high87.3Confident18 Ų1853.5 Ų53.513%0.12631%0.313CS..Hα-helixtrans-62.2-38.3177.647.60000112.5Y54 D60 H129Y54-S56 VanDerWaalsContact C-N 3.25Å; Y54-S56 PolarHBondContact O-N 3.4Å; S56-D60 PolarHBondContact O-N 3.44Å; S56-H129 VanDerWaalsContact CB-NE2 3.35Å; S56-H129 WeakPolarHBondContact CB-NE2 3.35Å
57I95.9Very high89.4Confident34 Ų3446.7 Ų46.717%0.17429%0.287CS..Hα-helixtrans-75.5-36.8176.5-57.1-178.5000110.9I37 H51 Y54 I55 G59 D60 L122I37-I57 HydrophobicContact CG2-CB 4.26Å; I37-I57 HydrophobicContact CG2-CG2 3.67Å; H51-I57 HydrophobicContact CB-CD1 3.84Å; H51-I57 HydrophobicContact CB-CG2 3.77Å; Y54-I57 HydrophobicContact CD2-CD1 3.68Å; Y54-I57 HydrophobicContact CD2-CG1 4.42Å; Y54-I57 HydrophobicContact CG-CD1 4.38Å; Y54-I57 PolarHBondContact O-N 3.08Å; I55-I57 VanDerWaalsContact C-N 3.32Å; I55-I57 PolarHBondContact O-N 3.13Å; I57-G59 PolarHBondContact O-N 3.25Å; I57-D60 VanDerWaalsContact O-CB 3.29Å; I57-D60 WeakPolarHBondContact O-CB 3.28Å; I57-D60 PolarHBondContact O-N 3.4Å; I57-L122 HydrophobicContact CG1-CD2 4.38Å
58A97.1Very high91.6Very high2 Ų240.8 Ų40.82%0.01725%0.248CC..Hα-helixtrans-60.4-35.9175.600000112.1V27 A31 I37 Y54 I55 A64V27-A58 HydrophobicContact CG1-CB 4.05Å; A31-A58 HydrophobicContact CB-CB 3.97Å; I37-A58 HydrophobicContact CD1-CB 3.7Å; Y54-A58 WeakPolarHBondContact O-CB 3.49Å; Y54-A58 PolarHBondContact O-N 3.08Å; I55-A58 PolarHBondContact O-N 3.23Å; A58-A64 VanDerWaalsContact O-CB 3.22Å; A58-A64 WeakPolarHBondContact O-CB 3.25Å
59G96.9Very high93.4Very high2 Ų238.9 Ų38.92%0.02123%0.225CC..THydrogen-bonded Turntrans-93.317.6179.200000115I55 I57 S65I55-G59 PolarHBondContact O-N 3.16Å; I57-G59 PolarHBondContact O-N 3.25Å; G59-S65 WeakPolarHBondContact O-CA 3.27Å; G59-S65 WeakPolarHBondContact O-CB 3.19Å
60D96.6Very high95.2Very high12 Ų1238.5 Ų38.56%0.06421%0.214CC..THydrogen-bonded Turntrans-90.5-42.6-170.1-158.567.9000112.8S56 I57 S65 Q121 L122 T123S56-D60 PolarHBondContact O-N 3.44Å; I57-D60 VanDerWaalsContact O-CB 3.29Å; I57-D60 WeakPolarHBondContact O-CB 3.28Å; I57-D60 PolarHBondContact O-N 3.4Å; D60-S65 WeakPolarHBondContact O-CB 3.45Å; D60-Q121 WeakPolarHBondContact O-CG 3.36Å; D60-Q121 WeakPolarHBondContact OD1-CB 3.29Å; D60-L122 WeakPolarHBondContact OD1-CA 3.31Å; D60-L122 WeakPolarHBondContact OD1-CB 3.48Å; D60-L122 PolarHBondContact OD1-N 2.78Å; D60-T123 VanDerWaalsContact CG-OG1 3.3Å; D60-T123 PolarHBondContact OD1-N 3.44Å; D60-T123 VanDerWaalsContact OD1-N 3.08Å; D60-T123 PolarHBondContact OD1-OG1 2.95Å; D60-T123 VanDerWaalsContact OD2-CB 3.24Å; D60-T123 WeakPolarHBondContact OD2-CB 3.42Å; D60-T123 WeakPolarHBondContact OD2-CG2 3.42Å; D60-T123 PolarHBondContact OD2-OG1 3.37Å
61D95.8Very high96.4Very high60 Ų6035.1 Ų35.132%0.32120%0.2SC..SBendtrans-102.3145.2-178.7-77.3-47.3000113.2K36 A64 S65K36-D61 HydrophobicContact CD-CB 4.46Å; K36-D61 WeakPolarHBondContact CD-OD2 3.36Å; K36-D61 VanDerWaalsContact CE-OD2 3.32Å; K36-D61 WeakPolarHBondContact CE-OD2 3.47Å; K36-D61 IonicContact NZ-OD2 2.82Å; K36-D61 PolarHBondContact NZ-OD2 2.99Å; D61-A64 PolarHBondContact O-N 3.05Å; D61-A64 VanDerWaalsContact O-N 3.15Å; D61-S65 VanDerWaalsContact C-OG 3.29Å; D61-S65 PolarHBondContact O-N 2.91Å; D61-S65 PolarHBondContact O-OG 2.89Å
62P96.6Very high96.9Very high88 Ų8830.4 Ų30.457%0.57118%0.178SC*.THydrogen-bonded Turntrans-63.2147168.5-20.833000112.2S65P62-S65 WeakPolarHBondContact CA-OG 3.37Å; P62-S65 VanDerWaalsContact N-OG 3.16Å
63P96.8Very high97.2Very high72 Ų7232 Ų3247%0.46819%0.185SC..THydrogen-bonded Turncis-84.6-10333.8-34.2000114.2I30 D34 S65 C66 V67I30-P63 HydrophobicContact CG2-CG 3.96Å; D34-P63 WeakPolarHBondContact OD2-CD 3.49Å; P63-S65 VanDerWaalsContact C-N 3.31Å; P63-S65 PolarHBondContact O-N 3.44Å; P63-C66 WeakPolarHBondContact O-CB 3.43Å; P63-C66 PolarHBondContact O-N 2.82Å; P63-C66 VanDerWaalsContact O-N 3.16Å; P63-V67 PolarHBondContact O-N 3.02Å
64A97.6Very high97.4Very high3 Ų336.2 Ų36.23%0.02521%0.205CC..Hα-helixtrans-59.7-39.5-177.300000112.3V27 I30 A58 D61 C66 V67 F68V27-A64 HydrophobicContact CG1-CB 4.28Å; I30-A64 HydrophobicContact CB-CB 4.18Å; I30-A64 HydrophobicContact CG2-CB 3.77Å; A58-A64 VanDerWaalsContact O-CB 3.22Å; A58-A64 WeakPolarHBondContact O-CB 3.25Å; D61-A64 PolarHBondContact O-N 3.05Å; D61-A64 VanDerWaalsContact O-N 3.15Å; A64-C66 VanDerWaalsContact C-N 3.32Å; A64-C66 PolarHBondContact O-N 2.83Å; A64-V67 PolarHBondContact O-N 3.2Å; A64-F68 WeakPolarHBondContact O-CB 3.33Å; A64-F68 PolarHBondContact O-N 3.25Å
65S97.8Very high97.5Very high4 Ų435.7 Ų35.73%0.02820%0.203CC..Hα-helixtrans-63.1-33.9177.3680000113.7G59 D60 D61 P62 P63 F68 S69G59-S65 WeakPolarHBondContact O-CA 3.27Å; G59-S65 WeakPolarHBondContact O-CB 3.19Å; D60-S65 WeakPolarHBondContact O-CB 3.45Å; D61-S65 VanDerWaalsContact C-OG 3.29Å; D61-S65 PolarHBondContact O-N 2.91Å; D61-S65 PolarHBondContact O-OG 2.89Å; P62-S65 WeakPolarHBondContact CA-OG 3.37Å; P62-S65 VanDerWaalsContact N-OG 3.16Å; P63-S65 VanDerWaalsContact C-N 3.31Å; P63-S65 PolarHBondContact O-N 3.44Å; S65-F68 PolarHBondContact O-N 3.02Å; S65-S69 WeakPolarHBondContact O-CB 3.19Å; S65-S69 PolarHBondContact O-N 3.21Å
66C98Very high97.5Very high75 Ų7535.2 Ų35.251%0.50720%0.202SC..Hα-helixtrans-66.2-42.9175-58.40000111.2P63 A64 Q70P63-C66 WeakPolarHBondContact O-CB 3.43Å; P63-C66 PolarHBondContact O-N 2.82Å; P63-C66 VanDerWaalsContact O-N 3.16Å; A64-C66 VanDerWaalsContact C-N 3.32Å; A64-C66 PolarHBondContact O-N 2.83Å; C66-Q70 WeakPolarHBondContact O-CG 3.24Å; C66-Q70 PolarHBondContact O-N 3.04Å
67V98.3Very high97.7Very high47 Ų4740.3 Ų40.329%0.28522%0.222SC..Hα-helixtrans-66.9-43.7176.2-178.70000110.3I26 V27 I30 P63 A64 S69 Q70 V71I26-V67 HydrophobicContact CG2-CG1 4.26Å; V27-V67 HydrophobicContact CG2-CB 3.99Å; V27-V67 HydrophobicContact CG2-CG1 3.83Å; I30-V67 HydrophobicContact CD1-CG2 4.12Å; P63-V67 PolarHBondContact O-N 3.02Å; A64-V67 PolarHBondContact O-N 3.2Å; V67-S69 VanDerWaalsContact C-N 3.33Å; V67-S69 PolarHBondContact O-N 3.25Å; V67-Q70 PolarHBondContact O-N 3.34Å; V67-V71 HydrophobicContact CG1-CG2 4.21Å; V67-V71 WeakPolarHBondContact O-CB 3.46Å; V67-V71 VanDerWaalsContact O-CG2 3.24Å; V67-V71 WeakPolarHBondContact O-CG2 3.33Å; V67-V71 PolarHBondContact O-N 3.44Å
68F98.3Very high97.8Very high10 Ų1039.7 Ų39.74%0.04422%0.219CC..Hα-helixtrans-56.9-46.8176.5-175.9-112.1000111.5L24 V27 I55 A64 S65 Q70 V71 M72 L117L24-F68 HydrophobicContact CD2-CD2 3.74Å; L24-F68 HydrophobicContact CD2-CE2 3.56Å; V27-F68 HydrophobicContact CG1-CB 4.13Å; V27-F68 HydrophobicContact CG1-CD2 4.32Å; V27-F68 HydrophobicContact CG2-CB 3.85Å; V27-F68 HydrophobicContact CG2-CD2 4.43Å; I55-F68 HydrophobicContact CG2-CD2 4.5Å; I55-F68 HydrophobicContact CG2-CE2 3.64Å; I55-F68 HydrophobicContact CG2-CZ 4.23Å; A64-F68 WeakPolarHBondContact O-CB 3.33Å; A64-F68 PolarHBondContact O-N 3.25Å; S65-F68 PolarHBondContact O-N 3.02Å; F68-Q70 PolarHBondContact O-N 3.01Å; F68-V71 PolarHBondContact O-N 3.46Å; F68-M72 HydrophobicContact CD1-CG 4.23Å; F68-M72 HydrophobicContact CD2-CG 3.94Å; F68-M72 HydrophobicContact CE1-CG 3.95Å; F68-M72 HydrophobicContact CE2-CG 3.62Å; F68-M72 HydrophobicContact CE2-SD 3.87Å; F68-M72 HydrophobicContact CG-CG 4.23Å; F68-M72 HydrophobicContact CZ-CG 3.62Å; F68-M72 HydrophobicContact CZ-SD 4.1Å; F68-M72 WeakPolarHBondContact O-CB 3.48Å; F68-M72 VanDerWaalsContact O-CG 3.24Å; F68-M72 WeakPolarHBondContact O-CG 3.28Å; F68-M72 PolarHBondContact O-N 3.01Å; F68-L117 VanDerWaalsContact CE1-O 3.3Å; F68-L117 WeakPolarHBondContact CE1-O 3.45Å
69S98.4Very high97.9Very high20 Ų2039.6 Ų39.614%0.1422%0.218CC..Hα-helixtrans-56.4-49.4175.5-178.80000112.9S65 V67 V71 M72 N73 G118 N119S65-S69 WeakPolarHBondContact O-CB 3.19Å; S65-S69 PolarHBondContact O-N 3.21Å; V67-S69 VanDerWaalsContact C-N 3.33Å; V67-S69 PolarHBondContact O-N 3.25Å; S69-V71 PolarHBondContact O-N 3.32Å; S69-M72 PolarHBondContact O-N 3.31Å; S69-N73 VanDerWaalsContact O-CB 3.29Å; S69-N73 WeakPolarHBondContact O-CB 3.24Å; S69-N73 VanDerWaalsContact O-CG 3.3Å; S69-N73 PolarHBondContact O-N 3.05Å; S69-N73 PolarHBondContact O-ND2 2.85Å; S69-N73 PolarHBondContact OG-ND2 2.85Å; S69-G118 WeakPolarHBondContact CA-O 3.48Å; S69-G118 WeakPolarHBondContact CB-O 3.17Å; S69-G118 PolarHBondContact OG-O 2.64Å; S69-G118 VanDerWaalsContact OG-O 3.11Å; S69-N119 PolarHBondContact OG-OD1 3.36Å
70Q98.3Very high98Very high135 Ų13542.9 Ų42.963%0.63124%0.235SC*.Hα-helixtrans-61.3-44.9178.8-69-64.8-23.100111.8C66 V67 F68 M74C66-Q70 WeakPolarHBondContact O-CG 3.24Å; C66-Q70 PolarHBondContact O-N 3.04Å; V67-Q70 PolarHBondContact O-N 3.34Å; F68-Q70 PolarHBondContact O-N 3.01Å; Q70-M74 WeakPolarHBondContact O-CB 3.24Å; Q70-M74 PolarHBondContact O-N 3.23Å
71V98.5Very high98.1Very high6 Ų644.2 Ų44.24%0.03624%0.243CC..Hα-helixtrans-62.8-49.1179.5172.20000110.8F19 T20 L24 V67 F68 S69 M74 A75F19-V71 HydrophobicContact CE1-CG2 4.48Å; T20-V71 HydrophobicContact CG2-CG1 4.14Å; L24-V71 HydrophobicContact CD2-CG1 4.48Å; L24-V71 HydrophobicContact CG-CG1 4.44Å; V67-V71 HydrophobicContact CG1-CG2 4.21Å; V67-V71 WeakPolarHBondContact O-CB 3.46Å; V67-V71 VanDerWaalsContact O-CG2 3.24Å; V67-V71 WeakPolarHBondContact O-CG2 3.33Å; V67-V71 PolarHBondContact O-N 3.44Å; F68-V71 PolarHBondContact O-N 3.46Å; S69-V71 PolarHBondContact O-N 3.32Å; V71-M74 PolarHBondContact O-N 2.99Å; V71-A75 VanDerWaalsContact O-CB 3.24Å; V71-A75 WeakPolarHBondContact O-CB 3.36Å; V71-A75 PolarHBondContact O-N 3.38Å
72M98.4Very high98.2Very high14 Ų1441.4 Ų41.47%0.06923%0.228CC..Hα-helixtrans-68.3-38.9-177.3-68.2-54.1-64.300112.6L24 F68 S69 A75 A76 M114 L117L24-M72 HydrophobicContact CD2-SD 4.17Å; F68-M72 HydrophobicContact CD1-CG 4.23Å; F68-M72 HydrophobicContact CD2-CG 3.94Å; F68-M72 HydrophobicContact CE1-CG 3.95Å; F68-M72 HydrophobicContact CE2-CG 3.62Å; F68-M72 HydrophobicContact CE2-SD 3.87Å; F68-M72 HydrophobicContact CG-CG 4.23Å; F68-M72 HydrophobicContact CZ-CG 3.62Å; F68-M72 HydrophobicContact CZ-SD 4.1Å; F68-M72 WeakPolarHBondContact O-CB 3.48Å; F68-M72 VanDerWaalsContact O-CG 3.24Å; F68-M72 WeakPolarHBondContact O-CG 3.28Å; F68-M72 PolarHBondContact O-N 3.01Å; S69-M72 PolarHBondContact O-N 3.31Å; M72-A75 PolarHBondContact O-N 2.85Å; M72-A76 WeakPolarHBondContact O-CB 3.25Å; M72-A76 PolarHBondContact O-N 2.86Å; M72-M114 HydrophobicContact CE-CB 3.84Å; M72-M114 HydrophobicContact CE-CG 3.75Å; M72-M114 HydrophobicContact CE-SD 4.27Å; M72-L117 HydrophobicContact CE-CB 4.22Å; M72-L117 HydrophobicContact CE-CD1 4.16Å
73N98.7Very high98.3Very high47 Ų4737.3 Ų37.325%0.25120%0.202SC..Hα-helixtrans-67.4-41.8176.2-75.2-40.5000112.1S69 A76 F77 N119S69-N73 VanDerWaalsContact O-CB 3.29Å; S69-N73 WeakPolarHBondContact O-CB 3.24Å; S69-N73 VanDerWaalsContact O-CG 3.3Å; S69-N73 PolarHBondContact O-N 3.05Å; S69-N73 PolarHBondContact O-ND2 2.85Å; S69-N73 PolarHBondContact OG-ND2 2.85Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.46Å; N73-F77 PolarHBondContact O-N 3.47Å; N73-N119 PolarHBondContact ND2-ND2 3.3Å; N73-N119 PolarHBondContact ND2-OD1 2.9Å; N73-N119 PolarHBondContact OD1-ND2 3.5Å
74M98.5Very high98.3Very high87 Ų8737 Ų3743%0.42920%0.198SC..Hα-helixtrans-65.6-42174.5-176.860.266.900111.5F19 Q70 V71 A76 F77 L78F19-M74 HydrophobicContact CD1-CB 4.45Å; F19-M74 HydrophobicContact CD1-CG 4.05Å; F19-M74 HydrophobicContact CE1-CB 3.68Å; F19-M74 HydrophobicContact CE1-CG 3.6Å; F19-M74 HydrophobicContact CZ-CB 4.29Å; F19-M74 HydrophobicContact CZ-CG 4.12Å; Q70-M74 WeakPolarHBondContact O-CB 3.24Å; Q70-M74 PolarHBondContact O-N 3.23Å; V71-M74 PolarHBondContact O-N 2.99Å; M74-A76 VanDerWaalsContact C-N 3.33Å; M74-A76 PolarHBondContact O-N 2.7Å; M74-F77 PolarHBondContact O-N 3.27Å; M74-L78 HydrophobicContact CG-CD1 4.21Å; M74-L78 WeakPolarHBondContact O-CG 3.39Å; M74-L78 PolarHBondContact O-N 3.14Å; M74-L78 HydrophobicContact SD-CD1 4.48Å; M74-L78 HydrophobicContact SD-CG 4.4Å
75A98.6Very high98.3Very high0 Ų037.7 Ų37.70%020%0.202CC..Hα-helixtrans-59.2-44.8174.100000111.3F16 T20 V71 M72 F77 L78 A79 M114F16-A75 HydrophobicContact CD2-CB 4.31Å; F16-A75 HydrophobicContact CE2-CB 3.81Å; F16-A75 VanDerWaalsContact CE2-O 3.25Å; F16-A75 WeakPolarHBondContact CE2-O 3.48Å; T20-A75 HydrophobicContact CG2-CB 3.91Å; T20-A75 WeakPolarHBondContact OG1-CB 3.39Å; V71-A75 VanDerWaalsContact O-CB 3.24Å; V71-A75 WeakPolarHBondContact O-CB 3.36Å; V71-A75 PolarHBondContact O-N 3.38Å; M72-A75 PolarHBondContact O-N 2.85Å; A75-F77 PolarHBondContact O-N 2.91Å; A75-L78 PolarHBondContact O-N 2.98Å; A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.2Å; A75-A79 PolarHBondContact O-N 3.16Å; A75-M114 HydrophobicContact CB-SD 4.26Å
76A98.7Very high98.3Very high4 Ų437.6 Ų37.63%0.03320%0.201CC..Hα-helixtrans-57.4-47.2175.700000112.8M72 N73 M74 A79 L80 S111 M114 T115M72-A76 WeakPolarHBondContact O-CB 3.25Å; M72-A76 PolarHBondContact O-N 2.86Å; N73-A76 WeakPolarHBondContact O-CB 3.49Å; N73-A76 PolarHBondContact O-N 3.46Å; M74-A76 VanDerWaalsContact C-N 3.33Å; M74-A76 PolarHBondContact O-N 2.7Å; A76-A79 PolarHBondContact O-N 2.9Å; A76-L80 WeakPolarHBondContact O-CB 3.23Å; A76-L80 PolarHBondContact O-N 3.06Å; A76-S111 VanDerWaalsContact CB-O 3.27Å; A76-S111 WeakPolarHBondContact CB-O 3.28Å; A76-M114 HydrophobicContact CB-CB 3.9Å; A76-M114 HydrophobicContact CB-CE 4.46Å; A76-T115 HydrophobicContact CB-CG2 3.47Å; A76-T115 VanDerWaalsContact CB-CG2 3.47Å
77F98.6Very high98.3Very high125 Ų12536.2 Ų36.255%0.54819%0.186SC..Hα-helixtrans-60.9-49.7177.1174.9-107.8000111.9N73 M74 A75 A79 L80 V81N73-F77 PolarHBondContact O-N 3.47Å; M74-F77 PolarHBondContact O-N 3.27Å; A75-F77 PolarHBondContact O-N 2.91Å; F77-A79 PolarHBondContact O-N 3.5Å; F77-L80 WeakPolarHBondContact O-CB 3.45Å; F77-L80 PolarHBondContact O-N 3.44Å; F77-V81 HydrophobicContact CE1-CG2 4.16Å; F77-V81 HydrophobicContact CE2-CG2 4.14Å; F77-V81 HydrophobicContact CZ-CG2 3.92Å; F77-V81 WeakPolarHBondContact O-CG2 3.46Å; F77-V81 PolarHBondContact O-N 2.91Å
78L98.4Very high98.2Very high20 Ų2038 Ų3811%0.10519%0.194CC..Hα-helixtrans-64.7-38.3-179.5-67.3175.4000112.3L12 V15 F16 M74 A75 V81 V82L12-L78 HydrophobicContact CD1-CD2 3.74Å; V15-L78 HydrophobicContact CG1-CD1 4.33Å; F16-L78 HydrophobicContact CB-CB 4.12Å; F16-L78 HydrophobicContact CB-CD1 4.18Å; F16-L78 HydrophobicContact CD2-CB 3.85Å; F16-L78 HydrophobicContact CG-CB 4.43Å; M74-L78 HydrophobicContact CG-CD1 4.21Å; M74-L78 WeakPolarHBondContact O-CG 3.39Å; M74-L78 PolarHBondContact O-N 3.14Å; M74-L78 HydrophobicContact SD-CD1 4.48Å; M74-L78 HydrophobicContact SD-CG 4.4Å; A75-L78 PolarHBondContact O-N 2.98Å; L78-V81 PolarHBondContact O-N 3.26Å; L78-V82 WeakPolarHBondContact O-CG2 3.39Å; L78-V82 PolarHBondContact O-N 3.44Å
79A98.4Very high98.1Very high0 Ų037.7 Ų37.70%019%0.192CC..Hα-helixtrans-64.3-39.1174.900000112.1F16 A75 A76 F77 V82 A83 S111 M114F16-A79 HydrophobicContact CE2-CB 3.9Å; F16-A79 HydrophobicContact CZ-CB 4.32Å; A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.2Å; A75-A79 PolarHBondContact O-N 3.16Å; A76-A79 PolarHBondContact O-N 2.9Å; F77-A79 PolarHBondContact O-N 3.5Å; A79-V82 PolarHBondContact O-N 2.97Å; A79-A83 WeakPolarHBondContact O-CB 3.09Å; A79-A83 PolarHBondContact O-N 3.36Å; A79-S111 WeakPolarHBondContact CB-OG 2.97Å; A79-M114 HydrophobicContact CB-CE 3.47Å; A79-M114 VanDerWaalsContact CB-CE 3.47Å
80L98.5Very high98Very high72 Ų7236.8 Ų36.838%0.37719%0.185SC..Hα-helixtrans-62.6-44.2173.8-176.966.2000111.4A76 F77 V82 A83 V84 C108 S111A76-L80 WeakPolarHBondContact O-CB 3.23Å; A76-L80 PolarHBondContact O-N 3.06Å; F77-L80 WeakPolarHBondContact O-CB 3.45Å; F77-L80 PolarHBondContact O-N 3.44Å; L80-V82 PolarHBondContact O-N 2.87Å; L80-A83 VanDerWaalsContact O-CB 3.29Å; L80-A83 WeakPolarHBondContact O-CB 3.48Å; L80-A83 PolarHBondContact O-N 3.44Å; L80-A83 VanDerWaalsContact O-N 3.16Å; L80-V84 PolarHBondContact O-N 3.48Å; L80-C108 HydrophobicContact CD1-CB 4.33Å; L80-S111 PolarHBondContact N-OG 3.26Å
81V98.3Very high97.9Very high40 Ų4037 Ų3724%0.24219%0.185CC..Hα-helixtrans-61-45.9174.6178.80000110.4L12 F77 L78 A83 V84 L85L12-V81 HydrophobicContact CD1-CG1 4.42Å; L12-V81 HydrophobicContact CD2-CB 4.39Å; L12-V81 HydrophobicContact CD2-CG1 3.68Å; F77-V81 HydrophobicContact CE1-CG2 4.16Å; F77-V81 HydrophobicContact CE2-CG2 4.14Å; F77-V81 HydrophobicContact CZ-CG2 3.92Å; F77-V81 WeakPolarHBondContact O-CG2 3.46Å; F77-V81 PolarHBondContact O-N 2.91Å; L78-V81 PolarHBondContact O-N 3.26Å; V81-A83 VanDerWaalsContact C-N 3.27Å; V81-A83 PolarHBondContact O-N 3.06Å; V81-V84 PolarHBondContact O-N 3.29Å; V81-L85 HydrophobicContact CG1-CD1 3.9Å; V81-L85 HydrophobicContact CG1-CG 4.15Å; V81-L85 WeakPolarHBondContact O-CB 3.49Å; V81-L85 VanDerWaalsContact O-CG 3.3Å; V81-L85 WeakPolarHBondContact O-CG 3.37Å; V81-L85 PolarHBondContact O-N 2.92Å
82V98.3Very high97.7Very high0 Ų041.5 Ų41.50%021%0.214CC..Hα-helixtrans-57.5-40.9174.6169.30000111L12 L78 A79 L80 R86 L107 F211 F215L12-V82 HydrophobicContact CD2-CG2 3.81Å; L12-V82 HydrophobicContact CG-CG2 3.93Å; L78-V82 WeakPolarHBondContact O-CG2 3.39Å; L78-V82 PolarHBondContact O-N 3.44Å; A79-V82 PolarHBondContact O-N 2.97Å; L80-V82 PolarHBondContact O-N 2.87Å; V82-R86 WeakPolarHBondContact O-CB 3.28Å; V82-R86 PolarHBondContact O-N 3.08Å; V82-L107 HydrophobicContact CG1-CD2 4.47Å; V82-F211 HydrophobicContact CG1-CD2 4.08Å; V82-F211 HydrophobicContact CG1-CE2 4.46Å; V82-F211 HydrophobicContact CG1-CG 4.42Å; V82-F215 HydrophobicContact CG1-CZ 4.33Å; V82-F215 HydrophobicContact CG2-CE2 4.49Å
83A98.3Very high97.5Very high3 Ų346 Ų463%0.02523%0.233CC..Hα-helixtrans-59.2-51.4178.100000112.3A79 L80 V81 R86 F87 L104 L107A79-A83 WeakPolarHBondContact O-CB 3.09Å; A79-A83 PolarHBondContact O-N 3.36Å; L80-A83 VanDerWaalsContact O-CB 3.29Å; L80-A83 WeakPolarHBondContact O-CB 3.48Å; L80-A83 PolarHBondContact O-N 3.44Å; L80-A83 VanDerWaalsContact O-N 3.16Å; V81-A83 VanDerWaalsContact C-N 3.27Å; V81-A83 PolarHBondContact O-N 3.06Å; A83-R86 PolarHBondContact O-N 2.68Å; A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 PolarHBondContact O-N 3.42Å; A83-L104 HydrophobicContact CB-CD1 3.96Å; A83-L107 HydrophobicContact CB-CB 3.81Å; A83-L107 HydrophobicContact CB-CD2 3.53Å; A83-L107 HydrophobicContact CB-CG 3.62Å
84V98.1Very high97.2Very high65 Ų6545.1 Ų45.139%0.39423%0.229SC..Hα-helixtrans-64.2-48.5-179.1174.10000110.6L80 V81 R86 F87 I88 L104L80-V84 PolarHBondContact O-N 3.48Å; V81-V84 PolarHBondContact O-N 3.29Å; V84-R86 VanDerWaalsContact C-N 3.34Å; V84-R86 PolarHBondContact O-N 3.15Å; V84-F87 WeakPolarHBondContact O-CB 3.32Å; V84-F87 PolarHBondContact O-N 3.07Å; V84-I88 HydrophobicContact CG1-CD1 3.83Å; V84-I88 WeakPolarHBondContact O-CG1 3.28Å; V84-I88 PolarHBondContact O-N 3.48Å; V84-L104 HydrophobicContact CG2-CD1 4.42Å
85L97.6Very high96.8Very high18 Ų1849.7 Ų49.79%0.09425%0.254CS..Hα-helixtrans-63.3-42.4179.9-65.9-174000111.4W9 L12 V81 F87 I88 Q89 F215 Y220W9-L85 HydrophobicContact CD2-CD1 4.39Å; W9-L85 HydrophobicContact CE3-CD1 3.55Å; W9-L85 HydrophobicContact CH2-CD1 4.4Å; W9-L85 HydrophobicContact CZ3-CD1 3.57Å; L12-L85 HydrophobicContact CD2-CD1 3.64Å; V81-L85 HydrophobicContact CG1-CD1 3.9Å; V81-L85 HydrophobicContact CG1-CG 4.15Å; V81-L85 WeakPolarHBondContact O-CB 3.49Å; V81-L85 VanDerWaalsContact O-CG 3.3Å; V81-L85 WeakPolarHBondContact O-CG 3.37Å; V81-L85 PolarHBondContact O-N 2.92Å; L85-F87 VanDerWaalsContact C-N 3.34Å; L85-F87 PolarHBondContact O-N 2.87Å; L85-I88 PolarHBondContact O-N 2.99Å; L85-Q89 VanDerWaalsContact O-CB 3.32Å; L85-Q89 WeakPolarHBondContact O-CB 3.5Å; L85-Q89 PolarHBondContact O-N 3.11Å; L85-F215 HydrophobicContact CB-CE2 4.16Å; L85-F215 HydrophobicContact CB-CZ 3.99Å; L85-F215 HydrophobicContact CD1-CE2 4.4Å; L85-Y220 HydrophobicContact CB-CE1 4.15Å; L85-Y220 HydrophobicContact CB-CE2 4.12Å; L85-Y220 HydrophobicContact CD1-CD2 3.97Å; L85-Y220 HydrophobicContact CD1-CE2 4.09Å; L85-Y220 HydrophobicContact CD1-CG 4.46Å; L85-Y220 HydrophobicContact CD2-CD1 3.76Å; L85-Y220 HydrophobicContact CD2-CD2 4.06Å; L85-Y220 HydrophobicContact CD2-CE1 4.16Å; L85-Y220 HydrophobicContact CD2-CE2 4.44Å; L85-Y220 HydrophobicContact CD2-CG 3.71Å; L85-Y220 HydrophobicContact CG-CD2 4.42Å; L85-Y220 HydrophobicContact CG-CE2 4.45Å; L85-Y220 PolarHBondContact O-OH 3.33Å
86R97.6Very high96.3Very high1 Ų154.3 Ų54.30%0.00428%0.279CS..Hα-helixtrans-63.3-41.4176.8-176.657.7175176-3.7111.6V82 A83 V84 Q89 L90 T151 F211 E214 F215V82-R86 WeakPolarHBondContact O-CB 3.28Å; V82-R86 PolarHBondContact O-N 3.08Å; A83-R86 PolarHBondContact O-N 2.68Å; V84-R86 VanDerWaalsContact C-N 3.34Å; V84-R86 PolarHBondContact O-N 3.15Å; R86-Q89 WeakPolarHBondContact O-CB 3.37Å; R86-Q89 PolarHBondContact O-N 3.18Å; R86-L90 HydrophobicContact CG-CD1 4.28Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.03Å; R86-L90 VanDerWaalsContact O-N 3.12Å; R86-T151 PolarHBondContact NH2-OG1 3.33Å; R86-F211 HydrophobicContact CG-CD1 4.48Å; R86-F211 HydrophobicContact CG-CE1 4.03Å; R86-E214 IonicContact CZ-OE1 2.83Å; R86-E214 VanDerWaalsContact CZ-OE1 3.29Å; R86-E214 IonicContact CZ-OE2 3.14Å; R86-E214 VanDerWaalsContact CZ-OE2 3.31Å; R86-E214 IonicContact NH1-OE1 3.12Å; R86-E214 PolarHBondContact NH1-OE1 2.94Å; R86-E214 IonicContact NH1-OE2 2.72Å; R86-E214 PolarHBondContact NH1-OE2 3.13Å; R86-E214 VanDerWaalsContact NH1-OE2 3.14Å; R86-E214 VanDerWaalsContact NH2-CD 3.31Å; R86-E214 IonicContact NH2-OE1 3.29Å; R86-E214 PolarHBondContact NH2-OE1 3.49Å; R86-E214 IonicContact NH2-OE2 3.31Å; R86-E214 PolarHBondContact NH2-OE2 2.93Å; R86-F215 HydrophobicContact CB-CE1 4.28Å; R86-F215 HydrophobicContact CB-CZ 4.17Å
87F98Very high96.1Very high46 Ų4657.1 Ų57.120%0.20230%0.297CS..Hα-helixtrans-60-49175.2173.2-100.4000111.7A83 V84 L85 Q89 L90 K91 N100 I101 L104A83-F87 WeakPolarHBondContact O-CB 3.41Å; A83-F87 PolarHBondContact O-N 3.42Å; V84-F87 WeakPolarHBondContact O-CB 3.32Å; V84-F87 PolarHBondContact O-N 3.07Å; L85-F87 VanDerWaalsContact C-N 3.34Å; L85-F87 PolarHBondContact O-N 2.87Å; F87-Q89 VanDerWaalsContact C-N 3.33Å; F87-Q89 PolarHBondContact O-N 3.16Å; F87-L90 PolarHBondContact O-N 3.28Å; F87-K91 HydrophobicContact CE1-CD 4.43Å; F87-K91 WeakPolarHBondContact O-CB 3.3Å; F87-K91 PolarHBondContact O-N 3.02Å; F87-N100 HydrophobicContact CD2-CB 4.44Å; F87-N100 VanDerWaalsContact CD2-ND2 3.31Å; F87-N100 WeakPolarHBondContact CD2-ND2 3.3Å; F87-N100 PolarHBondContact O-ND2 3.44Å; F87-I101 HydrophobicContact CE2-CG1 3.86Å; F87-I101 HydrophobicContact CZ-CG1 4.44Å; F87-L104 HydrophobicContact CB-CB 4.13Å; F87-L104 HydrophobicContact CB-CD1 4.04Å; F87-L104 HydrophobicContact CB-CD2 4.17Å; F87-L104 HydrophobicContact CB-CG 4.34Å; F87-L104 HydrophobicContact CD1-CD2 4.02Å; F87-L104 HydrophobicContact CD2-CB 3.89Å; F87-L104 HydrophobicContact CD2-CD2 3.84Å; F87-L104 HydrophobicContact CD2-CG 4.43Å; F87-L104 HydrophobicContact CE1-CD2 4.37Å; F87-L104 HydrophobicContact CE2-CD2 4.22Å; F87-L104 HydrophobicContact CG-CB 4.2Å; F87-L104 HydrophobicContact CG-CD2 3.74Å; F87-L104 HydrophobicContact CG-CG 4.37Å; F87-L104 HydrophobicContact CZ-CD2 4.46Å
88I96.6Very high96Very high86 Ų8659.6 Ų59.644%0.44130%0.303SS..Hα-helixtrans-60.9-43.4177.8-67167.2000110.6V84 L85 L90 K91 P92V84-I88 HydrophobicContact CG1-CD1 3.83Å; V84-I88 WeakPolarHBondContact O-CG1 3.28Å; V84-I88 PolarHBondContact O-N 3.48Å; L85-I88 PolarHBondContact O-N 2.99Å; I88-L90 VanDerWaalsContact C-N 3.26Å; I88-L90 PolarHBondContact O-N 3Å; I88-K91 PolarHBondContact O-N 3.06Å; I88-P92 VanDerWaalsContact O-CD 3.24Å; I88-P92 WeakPolarHBondContact O-CD 3.35Å
89Q96.3Very high95.9Very high3 Ų361 Ų611%0.01431%0.31CS..Hα-helixtrans-56.4-41.1178.5-165.6-174.518.800112.7L85 R86 F87 I156 E214 F215 Y218 Y220L85-Q89 VanDerWaalsContact O-CB 3.32Å; L85-Q89 WeakPolarHBondContact O-CB 3.5Å; L85-Q89 PolarHBondContact O-N 3.11Å; R86-Q89 WeakPolarHBondContact O-CB 3.37Å; R86-Q89 PolarHBondContact O-N 3.18Å; F87-Q89 VanDerWaalsContact C-N 3.33Å; F87-Q89 PolarHBondContact O-N 3.16Å; Q89-I156 HydrophobicContact CG-CD1 4.43Å; Q89-E214 PolarHBondContact NE2-O 2.78Å; Q89-F215 VanDerWaalsContact OE1-CE1 3.23Å; Q89-Y218 HydrophobicContact CG-CD1 3.77Å; Q89-Y218 HydrophobicContact CG-CD2 3.88Å; Q89-Y218 HydrophobicContact CG-CE1 3.66Å; Q89-Y218 HydrophobicContact CG-CE2 3.81Å; Q89-Y218 HydrophobicContact CG-CG 3.85Å; Q89-Y220 HydrophobicContact CB-CE1 4.49Å; Q89-Y220 WeakPolarHBondContact CB-OH 3.32Å
90L96.4Very high95.9Very high0 Ų061.1 Ų61.10%031%0.311CS..Hα-helixtrans-89-24.4-175.3-66.6-176.4000113R86 F87 I88 P92 K93 V94 L150 V154 I156R86-L90 HydrophobicContact CG-CD1 4.28Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.03Å; R86-L90 VanDerWaalsContact O-N 3.12Å; F87-L90 PolarHBondContact O-N 3.28Å; I88-L90 VanDerWaalsContact C-N 3.26Å; I88-L90 PolarHBondContact O-N 3Å; L90-P92 VanDerWaalsContact C-CD 3.5Å; L90-K93 WeakPolarHBondContact O-CA 3.21Å; L90-K93 PolarHBondContact O-N 3.21Å; L90-V94 HydrophobicContact CB-CG1 4.18Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 3.34Å; L90-L150 HydrophobicContact CD1-CB 4.03Å; L90-L150 HydrophobicContact CD1-CD1 3.76Å; L90-L150 HydrophobicContact CD1-CD2 4.49Å; L90-L150 HydrophobicContact CD1-CG 4.31Å; L90-V154 HydrophobicContact CD2-CB 4.42Å; L90-V154 HydrophobicContact CD2-CG1 4.2Å; L90-V154 HydrophobicContact CD2-CG2 4.23Å; L90-I156 HydrophobicContact CD2-CD1 4.28Å
91K95.8Very high95.9Very high141 Ų14160.6 Ų60.661%0.61331%0.307SS*.THydrogen-bonded Turntrans-46.6-48.1-178.2-174.7179.9-179.7-176.80114F87 I88 K93 N100F87-K91 HydrophobicContact CE1-CD 4.43Å; F87-K91 WeakPolarHBondContact O-CB 3.3Å; F87-K91 PolarHBondContact O-N 3.02Å; I88-K91 PolarHBondContact O-N 3.06Å; K91-K93 VanDerWaalsContact C-N 3.28Å; K91-K93 PolarHBondContact O-N 3.37Å; K91-N100 PolarHBondContact N-ND2 2.98Å
92P94.8Very high95.9Very high99 Ų9961.4 Ų61.464%0.64332%0.315SS*.THydrogen-bonded Turntrans-80.1-4.918032.3-36.2000114.1I88 L90I88-P92 VanDerWaalsContact O-CD 3.24Å; I88-P92 WeakPolarHBondContact O-CD 3.35Å; L90-P92 VanDerWaalsContact C-CD 3.5Å
93K93.1Very high95.8Very high110 Ų11061.5 Ų61.548%0.47832%0.316SS..THydrogen-bonded Turntrans-111-17.4-173.3-58.7-53.9-172.679.20114.1L90 K91 V154L90-K93 WeakPolarHBondContact O-CA 3.21Å; L90-K93 PolarHBondContact O-N 3.21Å; K91-K93 VanDerWaalsContact C-N 3.28Å; K91-K93 PolarHBondContact O-N 3.37Å; K93-V154 HydrophobicContact CB-CG1 3.6Å; K93-V154 HydrophobicContact CB-CG2 4.48Å; K93-V154 HydrophobicContact CG-CG1 4.17Å
94V93.6Very high95.8Very high27 Ų2763.2 Ų63.216%0.16433%0.325CS..  trans-90.7128.6179.6-63.90000110.3L90 N100 L150 V154L90-V94 HydrophobicContact CB-CG1 4.18Å; L90-V94 WeakPolarHBondContact O-CG2 3.32Å; L90-V94 PolarHBondContact O-N 3.34Å; V94-N100 HydrophobicContact CG1-CB 4.38Å; V94-N100 HydrophobicContact CG2-CB 4.04Å; V94-L150 HydrophobicContact CG1-CD2 3.9Å; V94-V154 HydrophobicContact CG1-CG2 3.93Å
95L88.6Confident95.9Very high184 Ų18463.7 Ų63.796%0.96333%0.327SS*.SBendtrans-72.9-40.9173.9-65.6174.5000111.6
96N89.6Confident95.9Very high97 Ų9763 Ų6352%0.51932%0.324SS..SBendtrans-104.6115.9175.5-176.2-38.8000108.9W98N96-W98 VanDerWaalsContact C-N 3.32Å; N96-W98 PolarHBondContact O-N 3.18Å; N96-W98 WeakPolarHBondContact OD1-CB 3.4Å; N96-W98 PolarHBondContact OD1-N 3.35Å
97P93.9Very high96Very high63 Ų6363 Ų6341%0.40932%0.324SS..SBendtrans-74-22.7-173.830.4-35.8000113.1L99 N100 I101P97-L99 VanDerWaalsContact C-N 3.34Å; P97-L99 PolarHBondContact O-N 3.16Å; P97-N100 WeakPolarHBondContact O-CB 3.32Å; P97-N100 PolarHBondContact O-N 3.39Å; P97-I101 HydrophobicContact CB-CD1 4.07Å; P97-I101 WeakPolarHBondContact O-CG1 3.31Å; P97-I101 PolarHBondContact O-N 3.45Å
98W96.5Very high96Very high176 Ų17662.9 Ų62.967%0.66733%0.329SS*.Hα-helixtrans-59.8-42.1-170.4-64.1113.5000112.5N96 N100 I101 S102N96-W98 VanDerWaalsContact C-N 3.32Å; N96-W98 PolarHBondContact O-N 3.18Å; N96-W98 WeakPolarHBondContact OD1-CB 3.4Å; N96-W98 PolarHBondContact OD1-N 3.35Å; W98-N100 VanDerWaalsContact C-N 3.3Å; W98-N100 PolarHBondContact O-N 3.29Å; W98-I101 HydrophobicContact CE3-CD1 4.29Å; W98-I101 PolarHBondContact O-N 3.25Å; W98-S102 WeakPolarHBondContact O-CB 3.49Å; W98-S102 PolarHBondContact O-N 2.84Å; W98-S102 PolarHBondContact O-OG 2.94Å
99L96.1Very high96.1Very high51 Ų5161.7 Ų61.727%0.26732%0.322SS..Hα-helixtrans-65.4-34.6179.3-170.861.8000112.3P97 G103 I146 L150P97-L99 VanDerWaalsContact C-N 3.34Å; P97-L99 PolarHBondContact O-N 3.16Å; L99-G103 PolarHBondContact O-N 3.44Å; L99-G103 VanDerWaalsContact O-N 3.1Å; L99-I146 HydrophobicContact CD1-CB 4.35Å; L99-I146 HydrophobicContact CD1-CG1 4.04Å; L99-I146 HydrophobicContact CD1-CG2 3.82Å; L99-I146 HydrophobicContact CG-CG2 4.06Å; L99-I146 VanDerWaalsContact O-CG2 3.3Å; L99-I146 WeakPolarHBondContact O-CG2 3.32Å; L99-L150 HydrophobicContact CB-CD2 4.21Å; L99-L150 HydrophobicContact CD2-CD2 3.76Å; L99-L150 HydrophobicContact CD2-CG 3.92Å; L99-L150 HydrophobicContact CG-CD1 4.32Å; L99-L150 HydrophobicContact CG-CD2 3.89Å; L99-L150 HydrophobicContact CG-CG 3.96Å
100N97.7Very high96.2Very high2 Ų261.7 Ų61.71%0.01132%0.323CS..Hα-helixtrans-72.2-42.2175.3-169.730.8000111.4F87 K91 V94 P97 W98 G103 L104F87-N100 HydrophobicContact CD2-CB 4.44Å; F87-N100 VanDerWaalsContact CD2-ND2 3.31Å; F87-N100 WeakPolarHBondContact CD2-ND2 3.3Å; F87-N100 PolarHBondContact O-ND2 3.44Å; K91-N100 PolarHBondContact N-ND2 2.98Å; V94-N100 HydrophobicContact CG1-CB 4.38Å; V94-N100 HydrophobicContact CG2-CB 4.04Å; P97-N100 WeakPolarHBondContact O-CB 3.32Å; P97-N100 PolarHBondContact O-N 3.39Å; W98-N100 VanDerWaalsContact C-N 3.3Å; W98-N100 PolarHBondContact O-N 3.29Å; N100-G103 PolarHBondContact O-N 3.45Å; N100-L104 PolarHBondContact O-N 3.42Å
101I98.3Very high96.3Very high60 Ų6062 Ų6231%0.30833%0.325SS..Hα-helixtrans-61.1-46.9174.9-66.1167.3000110.4F87 P97 W98 G103 L104 V105F87-I101 HydrophobicContact CE2-CG1 3.86Å; F87-I101 HydrophobicContact CZ-CG1 4.44Å; P97-I101 HydrophobicContact CB-CD1 4.07Å; P97-I101 WeakPolarHBondContact O-CG1 3.31Å; P97-I101 PolarHBondContact O-N 3.45Å; W98-I101 HydrophobicContact CE3-CD1 4.29Å; W98-I101 PolarHBondContact O-N 3.25Å; I101-G103 VanDerWaalsContact C-N 3.28Å; I101-G103 PolarHBondContact O-N 2.87Å; I101-L104 WeakPolarHBondContact O-CB 3.4Å; I101-L104 PolarHBondContact O-N 3.47Å; I101-L104 VanDerWaalsContact O-N 3.14Å; I101-V105 HydrophobicContact CG2-CG2 4.34Å; I101-V105 WeakPolarHBondContact O-CG2 3.42Å; I101-V105 PolarHBondContact O-N 3.01Å
102S98.1Very high96.5Very high58 Ų5860.6 Ų60.641%0.40632%0.319SS..Hα-helixtrans-60.6-38.6176.6-610000111.8W98 V105 A106W98-S102 WeakPolarHBondContact O-CB 3.49Å; W98-S102 PolarHBondContact O-N 2.84Å; W98-S102 PolarHBondContact O-OG 2.94Å; S102-V105 PolarHBondContact O-N 3.36Å; S102-A106 WeakPolarHBondContact O-CB 3.36Å; S102-A106 PolarHBondContact O-N 3.08Å
103G97.8Very high96.6Very high1 Ų155.9 Ų55.91%0.0129%0.289CS..Hα-helixtrans-63.6-40.317400000113.2L99 N100 I101 L107L99-G103 PolarHBondContact O-N 3.44Å; L99-G103 VanDerWaalsContact O-N 3.1Å; N100-G103 PolarHBondContact O-N 3.45Å; I101-G103 VanDerWaalsContact C-N 3.28Å; I101-G103 PolarHBondContact O-N 2.87Å; G103-L107 WeakPolarHBondContact O-CB 3.47Å; G103-L107 PolarHBondContact O-N 2.79Å; G103-L107 VanDerWaalsContact O-N 3.16Å
104L98.6Very high96.9Very high40 Ų4051.6 Ų51.621%0.20927%0.271CS..Hα-helixtrans-62.8-53.6173.7174.663.8000111A83 V84 F87 N100 I101 A106 L107 C108A83-L104 HydrophobicContact CB-CD1 3.96Å; V84-L104 HydrophobicContact CG2-CD1 4.42Å; F87-L104 HydrophobicContact CB-CB 4.13Å; F87-L104 HydrophobicContact CB-CD1 4.04Å; F87-L104 HydrophobicContact CB-CD2 4.17Å; F87-L104 HydrophobicContact CB-CG 4.34Å; F87-L104 HydrophobicContact CD1-CD2 4.02Å; F87-L104 HydrophobicContact CD2-CB 3.89Å; F87-L104 HydrophobicContact CD2-CD2 3.84Å; F87-L104 HydrophobicContact CD2-CG 4.43Å; F87-L104 HydrophobicContact CE1-CD2 4.37Å; F87-L104 HydrophobicContact CE2-CD2 4.22Å; F87-L104 HydrophobicContact CG-CB 4.2Å; F87-L104 HydrophobicContact CG-CD2 3.74Å; F87-L104 HydrophobicContact CG-CG 4.37Å; F87-L104 HydrophobicContact CZ-CD2 4.46Å; N100-L104 PolarHBondContact O-N 3.42Å; I101-L104 WeakPolarHBondContact O-CB 3.4Å; I101-L104 PolarHBondContact O-N 3.47Å; I101-L104 VanDerWaalsContact O-N 3.14Å; L104-A106 PolarHBondContact O-N 2.65Å; L104-L107 PolarHBondContact O-N 2.66Å; L104-C108 PolarHBondContact O-N 3.28Å; L104-C108 PolarHBondContact O-SG 2.59Å
105V98.7Very high97.1Very high75 Ų7552.2 Ų52.246%0.45527%0.274SS..Hα-helixtrans-59.9-46.7-177.7172.80000111I101 S102 L107 C108 L109I101-V105 HydrophobicContact CG2-CG2 4.34Å; I101-V105 WeakPolarHBondContact O-CG2 3.42Å; I101-V105 PolarHBondContact O-N 3.01Å; S102-V105 PolarHBondContact O-N 3.36Å; V105-L107 VanDerWaalsContact C-N 3.32Å; V105-L107 PolarHBondContact O-N 3.04Å; V105-C108 PolarHBondContact O-N 2.79Å; V105-L109 HydrophobicContact CG1-CD1 4Å; V105-L109 HydrophobicContact CG1-CG 4.43Å; V105-L109 WeakPolarHBondContact O-CG 3.25Å; V105-L109 PolarHBondContact O-N 2.68Å
106A98.6Very high97.6Very high2 Ų244.4 Ų44.42%0.01723%0.234CC..Hα-helixtrans-59.7-43.1178.400000111.5S102 L104 L109 A110 F139 L142 T143S102-A106 WeakPolarHBondContact O-CB 3.36Å; S102-A106 PolarHBondContact O-N 3.08Å; L104-A106 PolarHBondContact O-N 2.65Å; A106-L109 PolarHBondContact O-N 2.73Å; A106-A110 WeakPolarHBondContact O-CB 3.49Å; A106-A110 PolarHBondContact O-N 2.91Å; A106-F139 HydrophobicContact CB-CB 4.35Å; A106-F139 HydrophobicContact CB-CD1 4.16Å; A106-F139 WeakPolarHBondContact O-CB 3.5Å; A106-L142 HydrophobicContact CB-CD2 4.24Å; A106-L142 HydrophobicContact CB-CG 4.48Å; A106-T143 VanDerWaalsContact CB-OG1 3.3Å; A106-T143 WeakPolarHBondContact CB-OG1 3.41Å
107L98.3Very high97.9Very high3 Ų340.4 Ų40.42%0.01621%0.212CC..Hα-helixtrans-72.8-31.5179.8-169.951.3000112.9V82 A83 G103 L104 V105 A110 S111 T143 F208V82-L107 HydrophobicContact CG1-CD2 4.47Å; A83-L107 HydrophobicContact CB-CB 3.81Å; A83-L107 HydrophobicContact CB-CD2 3.53Å; A83-L107 HydrophobicContact CB-CG 3.62Å; G103-L107 WeakPolarHBondContact O-CB 3.47Å; G103-L107 PolarHBondContact O-N 2.79Å; G103-L107 VanDerWaalsContact O-N 3.16Å; L104-L107 PolarHBondContact O-N 2.66Å; V105-L107 VanDerWaalsContact C-N 3.32Å; V105-L107 PolarHBondContact O-N 3.04Å; L107-A110 HydrophobicContact CD1-CB 4.43Å; L107-S111 WeakPolarHBondContact O-CB 3.46Å; L107-S111 PolarHBondContact O-N 2.9Å; L107-S111 PolarHBondContact O-OG 2.93Å; L107-T143 HydrophobicContact CB-CG2 4.02Å; L107-T143 HydrophobicContact CD1-CG2 4.24Å; L107-T143 HydrophobicContact CD2-CG2 4.29Å; L107-T143 HydrophobicContact CG-CG2 4.41Å; L107-T143 PolarHBondContact N-OG1 3.14Å; L107-F208 HydrophobicContact CD1-CE1 3.64Å; L107-F208 HydrophobicContact CD1-CZ 3.45Å; L107-F208 VanDerWaalsContact CD1-CZ 3.45Å; L107-F208 HydrophobicContact CD2-CE1 3.89Å; L107-F208 HydrophobicContact CD2-CZ 4.43Å; L107-F208 HydrophobicContact CG-CE1 4.44Å
108C98.8Very high98.1Very high43 Ų4337.5 Ų37.529%0.29119%0.194SC..Hα-helixtrans-62.7-46.1170-68.90000111.5L80 L104 V105 S111 F112L80-C108 HydrophobicContact CD1-CB 4.33Å; L104-C108 PolarHBondContact O-N 3.28Å; L104-C108 PolarHBondContact O-SG 2.59Å; V105-C108 PolarHBondContact O-N 2.79Å; C108-S111 WeakPolarHBondContact O-CB 3.28Å; C108-S111 PolarHBondContact O-N 3.11Å; C108-F112 PolarHBondContact O-N 3.43Å
109L98.8Very high98.1Very high60 Ų6032.4 Ų32.431%0.31418%0.18SC..Hα-helixtrans-64-41.5177.2-69.2173.3000111.9V105 A106 S111 F112 G113 F139V105-L109 HydrophobicContact CG1-CD1 4Å; V105-L109 HydrophobicContact CG1-CG 4.43Å; V105-L109 WeakPolarHBondContact O-CG 3.25Å; V105-L109 PolarHBondContact O-N 2.68Å; A106-L109 PolarHBondContact O-N 2.73Å; L109-S111 VanDerWaalsContact C-N 3.31Å; L109-S111 PolarHBondContact O-N 2.95Å; L109-F112 PolarHBondContact O-N 3.47Å; L109-G113 PolarHBondContact O-N 2.94Å; L109-F139 HydrophobicContact CB-CB 4.26Å; L109-F139 HydrophobicContact CB-CD1 4.48Å; L109-F139 HydrophobicContact CB-CD2 3.72Å; L109-F139 HydrophobicContact CB-CE2 4.18Å; L109-F139 HydrophobicContact CB-CG 3.91Å; L109-F139 HydrophobicContact CD1-CD1 4Å; L109-F139 HydrophobicContact CD1-CD2 4.03Å; L109-F139 HydrophobicContact CD1-CE1 3.69Å; L109-F139 HydrophobicContact CD1-CE2 3.74Å; L109-F139 HydrophobicContact CD1-CG 4.18Å; L109-F139 HydrophobicContact CD1-CZ 3.56Å
110A98.7Very high98.2Very high4 Ų433.5 Ų33.53%0.03318%0.182CC..Hα-helixtrans-63-38.7173.900000111.9A106 L107 G113 M114 F139A106-A110 WeakPolarHBondContact O-CB 3.49Å; A106-A110 PolarHBondContact O-N 2.91Å; L107-A110 HydrophobicContact CD1-CB 4.43Å; A110-G113 PolarHBondContact O-N 3.4Å; A110-M114 PolarHBondContact O-N 2.85Å; A110-F139 HydrophobicContact CB-CB 4.18Å
111S98.7Very high98.1Very high5 Ų535.6 Ų35.64%0.03519%0.192CC..Hα-helixtrans-65-42.8176.6-56.70000111.8A76 A79 L80 L107 C108 L109 G113 M114 T115A76-S111 VanDerWaalsContact CB-O 3.27Å; A76-S111 WeakPolarHBondContact CB-O 3.28Å; A79-S111 WeakPolarHBondContact CB-OG 2.97Å; L80-S111 PolarHBondContact N-OG 3.26Å; L107-S111 WeakPolarHBondContact O-CB 3.46Å; L107-S111 PolarHBondContact O-N 2.9Å; L107-S111 PolarHBondContact O-OG 2.93Å; C108-S111 WeakPolarHBondContact O-CB 3.28Å; C108-S111 PolarHBondContact O-N 3.11Å; L109-S111 VanDerWaalsContact C-N 3.31Å; L109-S111 PolarHBondContact O-N 2.95Å; S111-G113 VanDerWaalsContact C-N 3.33Å; S111-G113 PolarHBondContact O-N 3.42Å; S111-M114 WeakPolarHBondContact O-CB 3.17Å; S111-M114 PolarHBondContact O-N 3.38Å; S111-T115 PolarHBondContact O-N 3.48Å
112F98.7Very high97.9Very high112 Ų11234.8 Ų34.849%0.49119%0.188SC..Hα-helixtrans-62.9-40.2172.5179.3-116.9000111.9C108 L109 M114 T115 L116 L135C108-F112 PolarHBondContact O-N 3.43Å; L109-F112 PolarHBondContact O-N 3.47Å; F112-M114 VanDerWaalsContact C-N 3.27Å; F112-M114 PolarHBondContact O-N 2.58Å; F112-T115 PolarHBondContact O-N 2.7Å; F112-T115 PolarHBondContact O-OG1 3.38Å; F112-L116 HydrophobicContact CD1-CD1 4.43Å; F112-L116 HydrophobicContact CE1-CD1 3.89Å; F112-L116 HydrophobicContact CE1-CG 4.28Å; F112-L116 HydrophobicContact CE2-CD2 4.37Å; F112-L116 HydrophobicContact CZ-CD1 4.19Å; F112-L116 HydrophobicContact CZ-CD2 4.03Å; F112-L116 HydrophobicContact CZ-CG 4.18Å; F112-L116 PolarHBondContact O-N 3.17Å; F112-L116 VanDerWaalsContact O-N 3.1Å; F112-L135 HydrophobicContact CD1-CD1 3.74Å; F112-L135 HydrophobicContact CE1-CD1 4.14Å
113G98.7Very high97.8Very high0 Ų036.9 Ų36.90%020%0.199CC..Hα-helixtrans-54.6-42.1172.100000113L109 A110 S111 T115 L116 L117 T136L109-G113 PolarHBondContact O-N 2.94Å; A110-G113 PolarHBondContact O-N 3.4Å; S111-G113 VanDerWaalsContact C-N 3.33Å; S111-G113 PolarHBondContact O-N 3.42Å; G113-T115 VanDerWaalsContact C-N 3.32Å; G113-T115 PolarHBondContact O-N 3.28Å; G113-L116 PolarHBondContact O-N 3.48Å; G113-L116 VanDerWaalsContact O-N 3.14Å; G113-L117 PolarHBondContact O-N 3.31Å; G113-T136 WeakPolarHBondContact CA-OG1 3.44Å; G113-T136 PolarHBondContact O-OG1 3.29Å
114M98.5Very high97.6Very high20 Ų2042.7 Ų42.710%0.09923%0.23CC..Hα-helixtrans-64.6-35.6177.4-72-169.5-73.500112.2M72 A75 A76 A79 A110 S111 F112 L116 L117 G118 T136M72-M114 HydrophobicContact CE-CB 3.84Å; M72-M114 HydrophobicContact CE-CG 3.75Å; M72-M114 HydrophobicContact CE-SD 4.27Å; A75-M114 HydrophobicContact CB-SD 4.26Å; A76-M114 HydrophobicContact CB-CB 3.9Å; A76-M114 HydrophobicContact CB-CE 4.46Å; A79-M114 HydrophobicContact CB-CE 3.47Å; A79-M114 VanDerWaalsContact CB-CE 3.47Å; A110-M114 PolarHBondContact O-N 2.85Å; S111-M114 WeakPolarHBondContact O-CB 3.17Å; S111-M114 PolarHBondContact O-N 3.38Å; F112-M114 VanDerWaalsContact C-N 3.27Å; F112-M114 PolarHBondContact O-N 2.58Å; M114-L116 VanDerWaalsContact C-N 3.34Å; M114-L117 PolarHBondContact O-N 2.99Å; M114-G118 PolarHBondContact O-N 2.99Å; M114-T136 HydrophobicContact CG-CG2 3.57Å; M114-T136 PolarHBondContact N-OG1 3.07Å
115T98.5Very high97.5Very high40 Ų4043.4 Ų43.425%0.24523%0.234CC..Hα-helixtrans-66-36.9172.765.70000112A76 S111 F112 G113 G118 N119A76-T115 HydrophobicContact CB-CG2 3.47Å; A76-T115 VanDerWaalsContact CB-CG2 3.47Å; S111-T115 PolarHBondContact O-N 3.48Å; F112-T115 PolarHBondContact O-N 2.7Å; F112-T115 PolarHBondContact O-OG1 3.38Å; G113-T115 VanDerWaalsContact C-N 3.32Å; G113-T115 PolarHBondContact O-N 3.28Å; T115-G118 PolarHBondContact O-N 3.1Å; T115-N119 PolarHBondContact O-N 3.07Å; T115-N119 PolarHBondContact O-ND2 3.31Å
116L98.4Very high97.4Very high21 Ų2145.8 Ų45.811%0.1124%0.24CC..Hα-helixtrans-66-47.8175.9-64.8-178.6000110.7F112 G113 M114 G118 N119 F120 I128 V131 L135F112-L116 HydrophobicContact CD1-CD1 4.43Å; F112-L116 HydrophobicContact CE1-CD1 3.89Å; F112-L116 HydrophobicContact CE1-CG 4.28Å; F112-L116 HydrophobicContact CE2-CD2 4.37Å; F112-L116 HydrophobicContact CZ-CD1 4.19Å; F112-L116 HydrophobicContact CZ-CD2 4.03Å; F112-L116 HydrophobicContact CZ-CG 4.18Å; F112-L116 PolarHBondContact O-N 3.17Å; F112-L116 VanDerWaalsContact O-N 3.1Å; G113-L116 PolarHBondContact O-N 3.48Å; G113-L116 VanDerWaalsContact O-N 3.14Å; M114-L116 VanDerWaalsContact C-N 3.34Å; L116-G118 VanDerWaalsContact C-N 3.3Å; L116-G118 PolarHBondContact O-N 3.14Å; L116-N119 PolarHBondContact O-N 3.44Å; L116-N119 VanDerWaalsContact O-N 3.17Å; L116-F120 HydrophobicContact CB-CD2 4.43Å; L116-F120 HydrophobicContact CD2-CD2 3.98Å; L116-F120 HydrophobicContact CD2-CE2 3.72Å; L116-F120 WeakPolarHBondContact O-CB 3.4Å; L116-F120 WeakPolarHBondContact O-CD2 3.27Å; L116-F120 PolarHBondContact O-N 3.21Å; L116-I128 HydrophobicContact CD1-CG2 4.46Å; L116-I128 HydrophobicContact CD2-CG2 4.01Å; L116-V131 HydrophobicContact CD1-CG1 4.05Å; L116-L135 HydrophobicContact CD1-CD1 4.11Å
117L96.2Very high97.4Very high12 Ų1253.1 Ų53.16%0.06327%0.274CS..Hα-helixtrans-54.7-44.9176.2-77.8176.6000112.7F68 M72 G113 M114 N119 T133 T136 F137F68-L117 VanDerWaalsContact CE1-O 3.3Å; F68-L117 WeakPolarHBondContact CE1-O 3.45Å; M72-L117 HydrophobicContact CE-CB 4.22Å; M72-L117 HydrophobicContact CE-CD1 4.16Å; G113-L117 PolarHBondContact O-N 3.31Å; M114-L117 PolarHBondContact O-N 2.99Å; L117-N119 VanDerWaalsContact C-N 3.29Å; L117-N119 PolarHBondContact O-N 3.26Å; L117-T133 WeakPolarHBondContact CD2-OG1 3.38Å; L117-T136 HydrophobicContact CD1-CG2 4.02Å; L117-T136 WeakPolarHBondContact CD1-OG1 3.32Å; L117-F137 HydrophobicContact CD1-CE2 4.45Å
118G96.8Very high97.3Very high2 Ų255.6 Ų55.62%0.02129%0.286CS..Hα-helixtrans-68.2-24.3-17800000114.5S69 M114 T115 L116S69-G118 WeakPolarHBondContact CA-O 3.48Å; S69-G118 WeakPolarHBondContact CB-O 3.17Å; S69-G118 PolarHBondContact OG-O 2.64Å; S69-G118 VanDerWaalsContact OG-O 3.11Å; M114-G118 PolarHBondContact O-N 2.99Å; T115-G118 PolarHBondContact O-N 3.1Å; L116-G118 VanDerWaalsContact C-N 3.3Å; L116-G118 PolarHBondContact O-N 3.14Å
119N97.9Very high97.3Very high70 Ų7053.7 Ų53.737%0.37427%0.273SS..Hα-helixtrans-116.2-18.5-170-60.7-64.8000114.3S69 N73 T115 L116 L117 Q121S69-N119 PolarHBondContact OG-OD1 3.36Å; N73-N119 PolarHBondContact ND2-ND2 3.3Å; N73-N119 PolarHBondContact ND2-OD1 2.9Å; N73-N119 PolarHBondContact OD1-ND2 3.5Å; T115-N119 PolarHBondContact O-N 3.07Å; T115-N119 PolarHBondContact O-ND2 3.31Å; L116-N119 PolarHBondContact O-N 3.44Å; L116-N119 VanDerWaalsContact O-N 3.17Å; L117-N119 VanDerWaalsContact C-N 3.29Å; L117-N119 PolarHBondContact O-N 3.26Å; N119-Q121 PolarHBondContact O-OE1 3.47Å
120F97.4Very high97.2Very high73 Ų7354 Ų5432%0.3228%0.275SS..SBendtrans-111.699.5176.6-65-90.4000108.6L116 D125 I128 H129L116-F120 HydrophobicContact CB-CD2 4.43Å; L116-F120 HydrophobicContact CD2-CD2 3.98Å; L116-F120 HydrophobicContact CD2-CE2 3.72Å; L116-F120 WeakPolarHBondContact O-CB 3.4Å; L116-F120 WeakPolarHBondContact O-CD2 3.27Å; L116-F120 PolarHBondContact O-N 3.21Å; F120-D125 HydrophobicContact CD1-CB 4.23Å; F120-I128 HydrophobicContact CB-CB 4.3Å; F120-I128 HydrophobicContact CB-CG2 3.98Å; F120-I128 HydrophobicContact CD1-CB 3.99Å; F120-I128 HydrophobicContact CD1-CD1 3.93Å; F120-I128 HydrophobicContact CD1-CG2 3.73Å; F120-I128 HydrophobicContact CD2-CG2 3.51Å; F120-I128 HydrophobicContact CE1-CB 4.49Å; F120-I128 HydrophobicContact CE1-CD1 3.65Å; F120-I128 HydrophobicContact CE1-CG2 4.05Å; F120-I128 HydrophobicContact CE2-CG2 3.85Å; F120-I128 HydrophobicContact CG-CB 4.04Å; F120-I128 HydrophobicContact CG-CG2 3.44Å; F120-I128 VanDerWaalsContact CG-CG2 3.44Å; F120-I128 HydrophobicContact CZ-CD1 4.22Å; F120-I128 HydrophobicContact CZ-CG2 4.11Å; F120-H129 PolarHBondContact O-ND1 3.03Å
121Q96.3Very high97.1Very high47 Ų4757.2 Ų57.222%0.2229%0.294CS..  trans-64147.3176.5-63.284.3-3.200110.3D60 N119 T123 N124 D125D60-Q121 WeakPolarHBondContact O-CG 3.36Å; D60-Q121 WeakPolarHBondContact OD1-CB 3.29Å; N119-Q121 PolarHBondContact O-OE1 3.47Å; Q121-T123 VanDerWaalsContact C-N 3.32Å; Q121-T123 PolarHBondContact O-N 3.24Å; Q121-N124 HydrophobicContact CB-CB 4.25Å; Q121-N124 PolarHBondContact O-N 2.89Å; Q121-N124 PolarHBondContact OE1-ND2 3.36Å; Q121-D125 PolarHBondContact O-N 3.05Å
122L94.2Very high97.1Very high42 Ų4257 Ų5722%0.2229%0.292CS..THydrogen-bonded Turntrans-63.2-39.6-174177.265.3000111.4I57 D60 E126 H129I57-L122 HydrophobicContact CG1-CD2 4.38Å; D60-L122 WeakPolarHBondContact OD1-CA 3.31Å; D60-L122 WeakPolarHBondContact OD1-CB 3.48Å; D60-L122 PolarHBondContact OD1-N 2.78Å; L122-E126 HydrophobicContact CD1-CB 4.38Å; L122-E126 HydrophobicContact CD1-CG 4.02Å; L122-E126 WeakPolarHBondContact O-CA 3.41Å; L122-E126 PolarHBondContact O-N 3.5Å; L122-H129 HydrophobicContact CD1-CB 4.35Å
123T94.4Very high97.1Very high103 Ų10353.3 Ų53.363%0.63228%0.279SS*.THydrogen-bonded Turntrans-75.1-26.3178.852.50000113.9D60 Q121D60-T123 VanDerWaalsContact CG-OG1 3.3Å; D60-T123 PolarHBondContact OD1-N 3.44Å; D60-T123 VanDerWaalsContact OD1-N 3.08Å; D60-T123 PolarHBondContact OD1-OG1 2.95Å; D60-T123 VanDerWaalsContact OD2-CB 3.24Å; D60-T123 WeakPolarHBondContact OD2-CB 3.42Å; D60-T123 WeakPolarHBondContact OD2-CG2 3.42Å; D60-T123 PolarHBondContact OD2-OG1 3.37Å; Q121-T123 VanDerWaalsContact C-N 3.32Å; Q121-T123 PolarHBondContact O-N 3.24Å
124N95.2Very high97Very high123 Ų12357.1 Ų57.166%0.65831%0.306SS*.THydrogen-bonded Turntrans-82.9-44.1-179.3-73.2-22.3000112.2Q121Q121-N124 HydrophobicContact CB-CB 4.25Å; Q121-N124 PolarHBondContact O-N 2.89Å; Q121-N124 PolarHBondContact OE1-ND2 3.36Å
125D96.2Very high97Very high55 Ų5557.5 Ų57.529%0.29431%0.308SS..  trans-148.684.1-179.7-164.3-40.2000110.5F120 Q121 E127 I128 H129F120-D125 HydrophobicContact CD1-CB 4.23Å; Q121-D125 PolarHBondContact O-N 3.05Å; D125-E127 VanDerWaalsContact C-N 3.27Å; D125-E127 PolarHBondContact O-N 2.9Å; D125-E127 PolarHBondContact OD1-N 2.93Å; D125-I128 WeakPolarHBondContact OD1-CG1 3.22Å; D125-I128 PolarHBondContact OD1-N 3.47Å; D125-I128 VanDerWaalsContact OD2-CD1 3.32Å; D125-I128 WeakPolarHBondContact OD2-CD1 3.38Å; D125-H129 VanDerWaalsContact O-CB 3.24Å; D125-H129 WeakPolarHBondContact O-CB 3.46Å; D125-H129 PolarHBondContact O-N 3.22Å
126E96.2Very high97Very high125 Ų12556.4 Ų56.458%0.58430%0.301SS*.Hα-helixtrans-60.6-36.4-178.9176.6175.4-172.900112.3L122 H129 N130L122-E126 HydrophobicContact CD1-CB 4.38Å; L122-E126 HydrophobicContact CD1-CG 4.02Å; L122-E126 WeakPolarHBondContact O-CA 3.41Å; L122-E126 PolarHBondContact O-N 3.5Å; E126-H129 PolarHBondContact O-N 3.4Å; E126-N130 WeakPolarHBondContact CG-ND2 3.41Å; E126-N130 VanDerWaalsContact O-CB 3.24Å; E126-N130 WeakPolarHBondContact O-CB 3.34Å; E126-N130 PolarHBondContact O-N 3.22Å; E126-N130 PolarHBondContact O-ND2 2.9Å; E126-N130 PolarHBondContact OE1-ND2 2.91Å
127E97.6Very high97Very high156 Ų15657.3 Ų57.373%0.72931%0.305SS*.Hα-helixtrans-65.4-53.6-176.3-173.2178.5168.700110.5D125 H129 N130 V131D125-E127 VanDerWaalsContact C-N 3.27Å; D125-E127 PolarHBondContact O-N 2.9Å; D125-E127 PolarHBondContact OD1-N 2.93Å; E127-H129 VanDerWaalsContact C-N 3.31Å; E127-H129 PolarHBondContact O-N 2.9Å; E127-N130 PolarHBondContact O-N 3.27Å; E127-V131 WeakPolarHBondContact O-CG2 3.29Å; E127-V131 PolarHBondContact O-N 2.91Å
128I97.4Very high97Very high55 Ų5558.8 Ų58.828%0.28232%0.323SS..Hα-helixtrans-66.3-37.1179-61.3179.8000110.7L116 F120 D125 N130 V131 G132L116-I128 HydrophobicContact CD1-CG2 4.46Å; L116-I128 HydrophobicContact CD2-CG2 4.01Å; F120-I128 HydrophobicContact CB-CB 4.3Å; F120-I128 HydrophobicContact CB-CG2 3.98Å; F120-I128 HydrophobicContact CD1-CB 3.99Å; F120-I128 HydrophobicContact CD1-CD1 3.93Å; F120-I128 HydrophobicContact CD1-CG2 3.73Å; F120-I128 HydrophobicContact CD2-CG2 3.51Å; F120-I128 HydrophobicContact CE1-CB 4.49Å; F120-I128 HydrophobicContact CE1-CD1 3.65Å; F120-I128 HydrophobicContact CE1-CG2 4.05Å; F120-I128 HydrophobicContact CE2-CG2 3.85Å; F120-I128 HydrophobicContact CG-CB 4.04Å; F120-I128 HydrophobicContact CG-CG2 3.44Å; F120-I128 VanDerWaalsContact CG-CG2 3.44Å; F120-I128 HydrophobicContact CZ-CD1 4.22Å; F120-I128 HydrophobicContact CZ-CG2 4.11Å; D125-I128 WeakPolarHBondContact OD1-CG1 3.22Å; D125-I128 PolarHBondContact OD1-N 3.47Å; D125-I128 VanDerWaalsContact OD2-CD1 3.32Å; D125-I128 WeakPolarHBondContact OD2-CD1 3.38Å; I128-N130 VanDerWaalsContact C-N 3.34Å; I128-N130 PolarHBondContact O-N 3.16Å; I128-V131 PolarHBondContact O-N 3.39Å; I128-G132 PolarHBondContact O-N 2.99Å
129H97.5Very high97.1Very high3 Ų362 Ų621%0.01434%0.336CS..Hα-helixtrans-59.6-44.2174.7-171.595.4000112S56 F120 L122 D125 E126 E127 G132 T133S56-H129 VanDerWaalsContact CB-NE2 3.35Å; S56-H129 WeakPolarHBondContact CB-NE2 3.35Å; F120-H129 PolarHBondContact O-ND1 3.03Å; L122-H129 HydrophobicContact CD1-CB 4.35Å; D125-H129 VanDerWaalsContact O-CB 3.24Å; D125-H129 WeakPolarHBondContact O-CB 3.46Å; D125-H129 PolarHBondContact O-N 3.22Å; E126-H129 PolarHBondContact O-N 3.4Å; E127-H129 VanDerWaalsContact C-N 3.31Å; E127-H129 PolarHBondContact O-N 2.9Å; H129-G132 PolarHBondContact O-N 3.36Å; H129-T133 WeakPolarHBondContact O-CB 3.37Å; H129-T133 PolarHBondContact O-N 3.33Å; H129-T133 PolarHBondContact O-OG1 3.25Å
130N96.8Very high97.1Very high66 Ų6658.8 Ų58.835%0.35332%0.32SS..Hα-helixtrans-70.8-32.5179.2-76.3-26.6000112.5E126 E127 I128 T133 S134E126-N130 WeakPolarHBondContact CG-ND2 3.41Å; E126-N130 VanDerWaalsContact O-CB 3.24Å; E126-N130 WeakPolarHBondContact O-CB 3.34Å; E126-N130 PolarHBondContact O-N 3.22Å; E126-N130 PolarHBondContact O-ND2 2.9Å; E126-N130 PolarHBondContact OE1-ND2 2.91Å; E127-N130 PolarHBondContact O-N 3.27Å; I128-N130 VanDerWaalsContact C-N 3.34Å; I128-N130 PolarHBondContact O-N 3.16Å; N130-T133 WeakPolarHBondContact O-CB 3.15Å; N130-T133 PolarHBondContact O-N 3.15Å; N130-S134 WeakPolarHBondContact O-CB 3.4Å; N130-S134 PolarHBondContact O-N 3.36Å; N130-S134 PolarHBondContact O-OG 2.95Å
131V98.3Very high97.2Very high71 Ų7156.3 Ų56.343%0.4331%0.311SS..Hα-helixtrans-61.2-49.2167.41720000110L116 E127 I128 T133 S134 L135L116-V131 HydrophobicContact CD1-CG1 4.05Å; E127-V131 WeakPolarHBondContact O-CG2 3.29Å; E127-V131 PolarHBondContact O-N 2.91Å; I128-V131 PolarHBondContact O-N 3.39Å; V131-T133 VanDerWaalsContact C-N 3.32Å; V131-T133 PolarHBondContact O-N 3.33Å; V131-S134 PolarHBondContact O-N 3.1Å; V131-L135 HydrophobicContact CG1-CD1 4.11Å; V131-L135 HydrophobicContact CG1-CG 4.35Å; V131-L135 WeakPolarHBondContact O-CG 3.43Å; V131-L135 PolarHBondContact O-N 2.79Å
132G98.4Very high97.3Very high0 Ų058 Ų580%032%0.321CS..Hα-helixtrans-57.6-42.317600000113.4I128 H129 L135 T136I128-G132 PolarHBondContact O-N 2.99Å; H129-G132 PolarHBondContact O-N 3.36Å; G132-L135 PolarHBondContact O-N 2.99Å; G132-T136 WeakPolarHBondContact O-CB 3.36Å; G132-T136 PolarHBondContact O-N 2.94Å; G132-T136 PolarHBondContact O-OG1 3.5Å
133T97.2Very high97.5Very high35 Ų3556 Ų5622%0.21531%0.31CS..Hα-helixtrans-58.7-51.2174.4-610000110.8L117 H129 N130 V131 L135 T136 F137L117-T133 WeakPolarHBondContact CD2-OG1 3.38Å; H129-T133 WeakPolarHBondContact O-CB 3.37Å; H129-T133 PolarHBondContact O-N 3.33Å; H129-T133 PolarHBondContact O-OG1 3.25Å; N130-T133 WeakPolarHBondContact O-CB 3.15Å; N130-T133 PolarHBondContact O-N 3.15Å; V131-T133 VanDerWaalsContact C-N 3.32Å; V131-T133 PolarHBondContact O-N 3.33Å; T133-L135 VanDerWaalsContact C-N 3.35Å; T133-L135 PolarHBondContact O-N 2.96Å; T133-T136 PolarHBondContact O-N 3.27Å; T133-F137 HydrophobicContact CG2-CD2 3.66Å; T133-F137 HydrophobicContact CG2-CE2 4.01Å; T133-F137 VanDerWaalsContact O-CD2 3.29Å; T133-F137 WeakPolarHBondContact O-CD2 3.49Å; T133-F137 PolarHBondContact O-N 3.28Å
134S97.1Very high97.7Very high80 Ų8051.1 Ų51.156%0.55928%0.28SS*.Iπ-helixtrans-63-41.9-178.9-60.70000111.7N130 V131 G138N130-S134 WeakPolarHBondContact O-CB 3.4Å; N130-S134 PolarHBondContact O-N 3.36Å; N130-S134 PolarHBondContact O-OG 2.95Å; V131-S134 PolarHBondContact O-N 3.1Å; S134-G138 WeakPolarHBondContact O-CA 3.42Å; S134-G138 PolarHBondContact O-N 3.04Å
135L98.4Very high97.9Very high29 Ų2950.4 Ų50.415%0.15227%0.269CS..Iπ-helixtrans-64.2-49.7176.5-70.3-178.9000111.6F112 L116 V131 G132 T133 F139F112-L135 HydrophobicContact CD1-CD1 3.74Å; F112-L135 HydrophobicContact CE1-CD1 4.14Å; L116-L135 HydrophobicContact CD1-CD1 4.11Å; V131-L135 HydrophobicContact CG1-CD1 4.11Å; V131-L135 HydrophobicContact CG1-CG 4.35Å; V131-L135 WeakPolarHBondContact O-CG 3.43Å; V131-L135 PolarHBondContact O-N 2.79Å; G132-L135 PolarHBondContact O-N 2.99Å; T133-L135 VanDerWaalsContact C-N 3.35Å; T133-L135 PolarHBondContact O-N 2.96Å; L135-F139 HydrophobicContact CD2-CD2 3.7Å; L135-F139 HydrophobicContact CD2-CE2 3.54Å; L135-F139 WeakPolarHBondContact O-CB 3Å; L135-F139 PolarHBondContact O-N 2.93Å; L135-F139 VanDerWaalsContact O-N 3.13Å
136T98.4Very high98Very high16 Ų1648.5 Ų48.510%0.09826%0.258CS..Iπ-helixtrans-62.6-55.4-177.4-57.50000111.6G113 M114 L117 G132 T133 G140G113-T136 WeakPolarHBondContact CA-OG1 3.44Å; G113-T136 PolarHBondContact O-OG1 3.29Å; M114-T136 HydrophobicContact CG-CG2 3.57Å; M114-T136 PolarHBondContact N-OG1 3.07Å; L117-T136 HydrophobicContact CD1-CG2 4.02Å; L117-T136 WeakPolarHBondContact CD1-OG1 3.32Å; G132-T136 WeakPolarHBondContact O-CB 3.36Å; G132-T136 PolarHBondContact O-N 2.94Å; G132-T136 PolarHBondContact O-OG1 3.5Å; T133-T136 PolarHBondContact O-N 3.27Å; T136-G140 WeakPolarHBondContact O-CA 3.4Å; T136-G140 PolarHBondContact O-N 3.35Å
137F97.9Very high98.1Very high41 Ų4142.8 Ų42.818%0.1823%0.232CC..Iπ-helixtrans-82.9-36.5-173.2-64-62.4000112.6L117 T133 T141 L200 V201 F204L117-F137 HydrophobicContact CD1-CE2 4.45Å; T133-F137 HydrophobicContact CG2-CD2 3.66Å; T133-F137 HydrophobicContact CG2-CE2 4.01Å; T133-F137 VanDerWaalsContact O-CD2 3.29Å; T133-F137 WeakPolarHBondContact O-CD2 3.49Å; T133-F137 PolarHBondContact O-N 3.28Å; F137-T141 VanDerWaalsContact O-CB 3.29Å; F137-T141 WeakPolarHBondContact O-CB 3.3Å; F137-T141 PolarHBondContact O-N 2.75Å; F137-T141 PolarHBondContact O-OG1 3.32Å; F137-L200 HydrophobicContact CD1-CD2 4.03Å; F137-L200 HydrophobicContact CD1-CG 4.45Å; F137-L200 HydrophobicContact CE1-CD2 4.28Å; F137-V201 HydrophobicContact CE1-CG2 3.76Å; F137-V201 HydrophobicContact CZ-CG2 3.92Å; F137-F204 HydrophobicContact CD1-CD2 4.13Å; F137-F204 AromaticContact CD1-CE2 3.69Å; F137-F204 HydrophobicContact CD1-CE2 3.69Å; F137-F204 HydrophobicContact CE1-CD2 4.39Å; F137-F204 HydrophobicContact CE1-CE2 4.38Å
138G98Very high98.1Very high43 Ų4335.4 Ų35.444%0.44320%0.197SC..Iπ-helixtrans-66.3-61.1177.600000111.7S134 G140 T141 L142S134-G138 WeakPolarHBondContact O-CA 3.42Å; S134-G138 PolarHBondContact O-N 3.04Å; G138-G140 VanDerWaalsContact C-N 3.31Å; G138-G140 PolarHBondContact O-N 2.96Å; G138-T141 PolarHBondContact O-N 2.93Å; G138-L142 PolarHBondContact O-N 2.96Å; G138-L142 VanDerWaalsContact O-N 3.07Å
139F98.6Very high98.1Very high69 Ų6934.4 Ų34.430%0.30320%0.197SC..Iπ-helixtrans-71.2-26.2178.4-69.5-73000112.9A106 L109 A110 L135 L142 T143A106-F139 HydrophobicContact CB-CB 4.35Å; A106-F139 HydrophobicContact CB-CD1 4.16Å; A106-F139 WeakPolarHBondContact O-CB 3.5Å; L109-F139 HydrophobicContact CB-CB 4.26Å; L109-F139 HydrophobicContact CB-CD1 4.48Å; L109-F139 HydrophobicContact CB-CD2 3.72Å; L109-F139 HydrophobicContact CB-CE2 4.18Å; L109-F139 HydrophobicContact CB-CG 3.91Å; L109-F139 HydrophobicContact CD1-CD1 4Å; L109-F139 HydrophobicContact CD1-CD2 4.03Å; L109-F139 HydrophobicContact CD1-CE1 3.69Å; L109-F139 HydrophobicContact CD1-CE2 3.74Å; L109-F139 HydrophobicContact CD1-CG 4.18Å; L109-F139 HydrophobicContact CD1-CZ 3.56Å; A110-F139 HydrophobicContact CB-CB 4.18Å; L135-F139 HydrophobicContact CD2-CD2 3.7Å; L135-F139 HydrophobicContact CD2-CE2 3.54Å; L135-F139 WeakPolarHBondContact O-CB 3Å; L135-F139 PolarHBondContact O-N 2.93Å; L135-F139 VanDerWaalsContact O-N 3.13Å; F139-L142 HydrophobicContact CD1-CD2 4.08Å; F139-L142 HydrophobicContact CE1-CD2 4.45Å; F139-L142 PolarHBondContact O-N 3.48Å; F139-T143 WeakPolarHBondContact O-CB 3.24Å; F139-T143 PolarHBondContact O-N 3.39Å; F139-T143 PolarHBondContact O-OG1 3.15Å
140G98.5Very high98.1Very high3 Ų334.5 Ų34.53%0.03120%0.197CC..Hα-helixtrans-59.7-49.6168.200000111.7T136 G138 L142 T143 C144T136-G140 WeakPolarHBondContact O-CA 3.4Å; T136-G140 PolarHBondContact O-N 3.35Å; G138-G140 VanDerWaalsContact C-N 3.31Å; G138-G140 PolarHBondContact O-N 2.96Å; G140-L142 VanDerWaalsContact C-N 3.34Å; G140-L142 PolarHBondContact O-N 3.49Å; G140-T143 WeakPolarHBondContact O-CB 3.32Å; G140-T143 PolarHBondContact O-N 3.05Å; G140-C144 PolarHBondContact O-N 3.48Å; G140-C144 PolarHBondContact O-SG 3.03Å; G140-C144 VanDerWaalsContact O-SG 3.41Å
141T98.6Very high98.2Very high21 Ų2131.4 Ų31.413%0.12918%0.181CC..Hα-helixtrans-60.9-44.5178.1-58.90000111F137 G138 T143 C144 W145 I174 F204F137-T141 VanDerWaalsContact O-CB 3.29Å; F137-T141 WeakPolarHBondContact O-CB 3.3Å; F137-T141 PolarHBondContact O-N 2.75Å; F137-T141 PolarHBondContact O-OG1 3.32Å; G138-T141 PolarHBondContact O-N 2.93Å; T141-T143 VanDerWaalsContact C-N 3.31Å; T141-T143 PolarHBondContact O-N 2.89Å; T141-C144 WeakPolarHBondContact O-CB 3.5Å; T141-C144 PolarHBondContact O-N 3.38Å; T141-W145 PolarHBondContact O-N 2.88Å; T141-I174 HydrophobicContact CG2-CG2 4.16Å; T141-F204 WeakPolarHBondContact OG1-CZ 3.38Å
142L98.4Very high98.1Very high83 Ų8331.3 Ų31.344%0.43518%0.178SC..Hα-helixtrans-58.8-44.4175.8-179.460.9000111.4A106 G138 F139 G140 C144 W145 I146A106-L142 HydrophobicContact CB-CD2 4.24Å; A106-L142 HydrophobicContact CB-CG 4.48Å; G138-L142 PolarHBondContact O-N 2.96Å; G138-L142 VanDerWaalsContact O-N 3.07Å; F139-L142 HydrophobicContact CD1-CD2 4.08Å; F139-L142 HydrophobicContact CE1-CD2 4.45Å; F139-L142 PolarHBondContact O-N 3.48Å; G140-L142 VanDerWaalsContact C-N 3.34Å; G140-L142 PolarHBondContact O-N 3.49Å; L142-C144 VanDerWaalsContact C-N 3.33Å; L142-C144 PolarHBondContact O-N 2.91Å; L142-W145 PolarHBondContact O-N 3.45Å; L142-I146 HydrophobicContact CD1-CD1 3.99Å; L142-I146 HydrophobicContact CD1-CG1 4.29Å; L142-I146 HydrophobicContact CD2-CD1 4.38Å; L142-I146 HydrophobicContact CG-CD1 3.78Å; L142-I146 HydrophobicContact CG-CG1 4.45Å; L142-I146 WeakPolarHBondContact O-CG1 3.37Å; L142-I146 PolarHBondContact O-N 3.33Å
143T98.4Very high98Very high0 Ų039 Ų390%021%0.211CC..Hα-helixtrans-58.4-44.6176.3-610000111.2A106 L107 F139 G140 T141 W145 I146 Q147A106-T143 VanDerWaalsContact CB-OG1 3.3Å; A106-T143 WeakPolarHBondContact CB-OG1 3.41Å; L107-T143 HydrophobicContact CB-CG2 4.02Å; L107-T143 HydrophobicContact CD1-CG2 4.24Å; L107-T143 HydrophobicContact CD2-CG2 4.29Å; L107-T143 HydrophobicContact CG-CG2 4.41Å; L107-T143 PolarHBondContact N-OG1 3.14Å; F139-T143 WeakPolarHBondContact O-CB 3.24Å; F139-T143 PolarHBondContact O-N 3.39Å; F139-T143 PolarHBondContact O-OG1 3.15Å; G140-T143 WeakPolarHBondContact O-CB 3.32Å; G140-T143 PolarHBondContact O-N 3.05Å; T141-T143 VanDerWaalsContact C-N 3.31Å; T141-T143 PolarHBondContact O-N 2.89Å; T143-W145 VanDerWaalsContact C-N 3.32Å; T143-W145 PolarHBondContact O-N 3.29Å; T143-I146 PolarHBondContact O-N 3.12Å; T143-Q147 HydrophobicContact CG2-CG 3.87Å; T143-Q147 VanDerWaalsContact O-CB 3.28Å; T143-Q147 WeakPolarHBondContact O-CB 3.35Å; T143-Q147 VanDerWaalsContact O-CG 3.28Å; T143-Q147 WeakPolarHBondContact O-CG 3.22Å; T143-Q147 PolarHBondContact O-N 2.87Å
144C98.8Very high97.9Very high0 Ų038.7 Ų38.70%021%0.209CC..Hα-helixtrans-59.4-40.5178.9-710000112.4G140 T141 L142 A148 S171 I174 Y207G140-C144 PolarHBondContact O-N 3.48Å; G140-C144 PolarHBondContact O-SG 3.03Å; G140-C144 VanDerWaalsContact O-SG 3.41Å; T141-C144 WeakPolarHBondContact O-CB 3.5Å; T141-C144 PolarHBondContact O-N 3.38Å; L142-C144 VanDerWaalsContact C-N 3.33Å; L142-C144 PolarHBondContact O-N 2.91Å; C144-A148 VanDerWaalsContact O-CB 3.24Å; C144-A148 WeakPolarHBondContact O-CB 3.3Å; C144-A148 PolarHBondContact O-N 3.05Å; C144-S171 WeakPolarHBondContact CB-OG 3.45Å; C144-S171 PolarHBondContact O-OG 2.97Å; C144-I174 HydrophobicContact CB-CD1 4.43Å; C144-Y207 HydrophobicContact CB-CD2 3.98Å; C144-Y207 HydrophobicContact CB-CE1 4.32Å; C144-Y207 HydrophobicContact CB-CE2 3.67Å; C144-Y207 HydrophobicContact CB-CG 4.43Å; C144-Y207 PolarHBondContact O-OH 2.81Å
145W98.8Very high97.8Very high108 Ų10837.6 Ų37.641%0.40920%0.197SC..Hα-helixtrans-69.8-46.5175.6-78.6108.6000112.8T141 L142 T143 Q147 A148 A149 V168 A172 T175T141-W145 PolarHBondContact O-N 2.88Å; L142-W145 PolarHBondContact O-N 3.45Å; T143-W145 VanDerWaalsContact C-N 3.32Å; T143-W145 PolarHBondContact O-N 3.29Å; W145-Q147 PolarHBondContact O-N 2.72Å; W145-A148 PolarHBondContact O-N 3.34Å; W145-A149 PolarHBondContact O-N 3.03Å; W145-V168 HydrophobicContact CH2-CG1 4.44Å; W145-V168 HydrophobicContact CZ3-CG1 4.2Å; W145-A172 HydrophobicContact CH2-CB 4.34Å; W145-A172 HydrophobicContact CZ2-CB 4.31Å; W145-T175 PolarHBondContact NE1-OG1 3.26Å
146I98.3Very high97.6Very high15 Ų1536.6 Ų36.68%0.07719%0.192CC..Hα-helixtrans-58.2-48.5177.8-70.8172.9000110.7L99 L142 T143 A149 L150L99-I146 HydrophobicContact CD1-CB 4.35Å; L99-I146 HydrophobicContact CD1-CG1 4.04Å; L99-I146 HydrophobicContact CD1-CG2 3.82Å; L99-I146 HydrophobicContact CG-CG2 4.06Å; L99-I146 VanDerWaalsContact O-CG2 3.3Å; L99-I146 WeakPolarHBondContact O-CG2 3.32Å; L142-I146 HydrophobicContact CD1-CD1 3.99Å; L142-I146 HydrophobicContact CD1-CG1 4.29Å; L142-I146 HydrophobicContact CD2-CD1 4.38Å; L142-I146 HydrophobicContact CG-CD1 3.78Å; L142-I146 HydrophobicContact CG-CG1 4.45Å; L142-I146 WeakPolarHBondContact O-CG1 3.37Å; L142-I146 PolarHBondContact O-N 3.33Å; T143-I146 PolarHBondContact O-N 3.12Å; I146-A149 PolarHBondContact O-N 3.39Å; I146-L150 HydrophobicContact CG2-CD1 3.68Å; I146-L150 HydrophobicContact CG2-CG 4.39Å; I146-L150 WeakPolarHBondContact O-CB 3.37Å; I146-L150 WeakPolarHBondContact O-CG 3.43Å; I146-L150 PolarHBondContact O-N 3.12Å
147Q98.1Very high97.4Very high5 Ų543.2 Ų43.22%0.02322%0.219CC..Hα-helixtrans-70.3-33.6-177.1-68.7-66.4-25.900111.9T143 W145 L150 T151 Y207 F211T143-Q147 HydrophobicContact CG2-CG 3.87Å; T143-Q147 VanDerWaalsContact O-CB 3.28Å; T143-Q147 WeakPolarHBondContact O-CB 3.35Å; T143-Q147 VanDerWaalsContact O-CG 3.28Å; T143-Q147 WeakPolarHBondContact O-CG 3.22Å; T143-Q147 PolarHBondContact O-N 2.87Å; W145-Q147 PolarHBondContact O-N 2.72Å; Q147-L150 PolarHBondContact O-N 3.41Å; Q147-T151 WeakPolarHBondContact O-CB 3.33Å; Q147-T151 PolarHBondContact O-N 3.04Å; Q147-T151 PolarHBondContact O-OG1 2.63Å; Q147-Y207 HydrophobicContact CB-CE1 4.39Å; Q147-Y207 VanDerWaalsContact CB-OH 3.32Å; Q147-Y207 WeakPolarHBondContact CB-OH 3.33Å; Q147-F211 HydrophobicContact CB-CE1 4.29Å; Q147-F211 HydrophobicContact CB-CZ 3.92Å; Q147-F211 HydrophobicContact CG-CE1 4.31Å; Q147-F211 HydrophobicContact CG-CZ 3.85Å
148A98.3Very high97.2Very high0 Ų047.3 Ų47.30%024%0.243CC..Hα-helixtrans-63-46.3172.700000111C144 W145 T151 L152 R167 V168 Y207C144-A148 VanDerWaalsContact O-CB 3.24Å; C144-A148 WeakPolarHBondContact O-CB 3.3Å; C144-A148 PolarHBondContact O-N 3.05Å; W145-A148 PolarHBondContact O-N 3.34Å; A148-T151 WeakPolarHBondContact O-CB 3.33Å; A148-T151 PolarHBondContact O-N 3.29Å; A148-L152 PolarHBondContact O-N 2.9Å; A148-L152 VanDerWaalsContact O-N 3.12Å; A148-R167 HydrophobicContact CB-CB 3.89Å; A148-V168 HydrophobicContact CB-CG2 3.96Å; A148-Y207 PolarHBondContact N-OH 3.3Å
149A97.9Very high97Very high35 Ų3547.3 Ų47.329%0.28923%0.231SC..Hα-helixtrans-62.3-45.5176.700000112.1W145 I146 T151 L152 K153W145-A149 PolarHBondContact O-N 3.03Å; I146-A149 PolarHBondContact O-N 3.39Å; A149-T151 VanDerWaalsContact C-N 3.31Å; A149-T151 PolarHBondContact O-N 2.76Å; A149-L152 PolarHBondContact O-N 2.96Å; A149-K153 WeakPolarHBondContact O-CB 3.36Å; A149-K153 VanDerWaalsContact O-CG 3.32Å; A149-K153 WeakPolarHBondContact O-CG 3.35Å; A149-K153 PolarHBondContact O-N 3.29Å
150L97.6Very high96.8Very high4 Ų444 Ų442%0.02122%0.218CC..Hα-helixtrans-60.6-40.1176.3-74.4166.9000111.8L90 V94 L99 I146 Q147 K153 V154L90-L150 HydrophobicContact CD1-CB 4.03Å; L90-L150 HydrophobicContact CD1-CD1 3.76Å; L90-L150 HydrophobicContact CD1-CD2 4.49Å; L90-L150 HydrophobicContact CD1-CG 4.31Å; V94-L150 HydrophobicContact CG1-CD2 3.9Å; L99-L150 HydrophobicContact CB-CD2 4.21Å; L99-L150 HydrophobicContact CD2-CD2 3.76Å; L99-L150 HydrophobicContact CD2-CG 3.92Å; L99-L150 HydrophobicContact CG-CD1 4.32Å; L99-L150 HydrophobicContact CG-CD2 3.89Å; L99-L150 HydrophobicContact CG-CG 3.96Å; I146-L150 HydrophobicContact CG2-CD1 3.68Å; I146-L150 HydrophobicContact CG2-CG 4.39Å; I146-L150 WeakPolarHBondContact O-CB 3.37Å; I146-L150 WeakPolarHBondContact O-CG 3.43Å; I146-L150 PolarHBondContact O-N 3.12Å; Q147-L150 PolarHBondContact O-N 3.41Å; L150-K153 PolarHBondContact O-N 3.31Å; L150-V154 VanDerWaalsContact O-CB 3.28Å; L150-V154 WeakPolarHBondContact O-CB 3.32Å; L150-V154 WeakPolarHBondContact O-CG2 3.32Å; L150-V154 PolarHBondContact O-N 3.03Å
151T97.4Very high96.6Very high1 Ų153 Ų531%0.00625%0.25CS..Hα-helixtrans-63-45.7179.3-53.60000112R86 Q147 A148 A149 N155 G160 V163 R167R86-T151 PolarHBondContact NH2-OG1 3.33Å; Q147-T151 WeakPolarHBondContact O-CB 3.33Å; Q147-T151 PolarHBondContact O-N 3.04Å; Q147-T151 PolarHBondContact O-OG1 2.63Å; A148-T151 WeakPolarHBondContact O-CB 3.33Å; A148-T151 PolarHBondContact O-N 3.29Å; A149-T151 VanDerWaalsContact C-N 3.31Å; A149-T151 PolarHBondContact O-N 2.76Å; T151-N155 PolarHBondContact O-N 2.77Å; T151-N155 VanDerWaalsContact O-N 3.07Å; T151-G160 WeakPolarHBondContact O-CA 3.39Å; T151-V163 HydrophobicContact CG2-CB 3.91Å; T151-V163 HydrophobicContact CG2-CG1 3.97Å; T151-R167 PolarHBondContact OG1-NH1 3.22Å
152L97.3Very high96.5Very high70 Ų7059.6 Ų59.637%0.36628%0.277SS..Hα-helixtrans-66.3-41.6178.1-71.3168.5000111.5A148 A149 V168A148-L152 PolarHBondContact O-N 2.9Å; A148-L152 VanDerWaalsContact O-N 3.12Å; A149-L152 PolarHBondContact O-N 2.96Å; L152-V168 HydrophobicContact CD1-CG2 3.9Å
153K95.8Very high96.4Very high161 Ų16156.1 Ų56.170%0.726%0.26SS*.Hα-helixtrans-71-46.5-178.9-73.9-178.6177.8-175.20113.1A149 L150A149-K153 WeakPolarHBondContact O-CB 3.36Å; A149-K153 VanDerWaalsContact O-CG 3.32Å; A149-K153 WeakPolarHBondContact O-CG 3.35Å; A149-K153 PolarHBondContact O-N 3.29Å; L150-K153 PolarHBondContact O-N 3.31Å
154V95.6Very high96.4Very high29 Ų2956.1 Ų56.118%0.17626%0.26CS..Hα-helixtrans-78.4-29.8-174.9174.70000111.9L90 K93 V94 L150 I156L90-V154 HydrophobicContact CD2-CB 4.42Å; L90-V154 HydrophobicContact CD2-CG1 4.2Å; L90-V154 HydrophobicContact CD2-CG2 4.23Å; K93-V154 HydrophobicContact CB-CG1 3.6Å; K93-V154 HydrophobicContact CB-CG2 4.48Å; K93-V154 HydrophobicContact CG-CG1 4.17Å; V94-V154 HydrophobicContact CG1-CG2 3.93Å; L150-V154 VanDerWaalsContact O-CB 3.28Å; L150-V154 WeakPolarHBondContact O-CB 3.32Å; L150-V154 WeakPolarHBondContact O-CG2 3.32Å; L150-V154 PolarHBondContact O-N 3.03Å; V154-I156 VanDerWaalsContact C-N 3.34Å; V154-I156 HydrophobicContact CG1-CD1 4.41Å; V154-I156 HydrophobicContact CG1-CG1 3.7Å; V154-I156 PolarHBondContact O-N 2.91Å
155N95.5Very high96.3Very high57 Ų5760 Ų6031%0.30528%0.28SS..  trans49.250.2172.6-169.429.1000113.8T151 K157 N158 E159 G160T151-N155 PolarHBondContact O-N 2.77Å; T151-N155 VanDerWaalsContact O-N 3.07Å; N155-K157 PolarHBondContact O-N 3.37Å; N155-N158 PolarHBondContact ND2-OD1 3.44Å; N155-N158 PolarHBondContact O-N 3.45Å; N155-N158 VanDerWaalsContact OD1-C 3.23Å; N155-N158 VanDerWaalsContact OD1-CA 3.28Å; N155-N158 WeakPolarHBondContact OD1-CA 3.41Å; N155-E159 PolarHBondContact OD1-N 3.43Å; N155-G160 VanDerWaalsContact OD1-CA 3.23Å; N155-G160 WeakPolarHBondContact OD1-CA 3.39Å; N155-G160 PolarHBondContact OD1-N 2.88Å
156I94.1Very high96.3Very high8 Ų857.6 Ų57.64%0.04128%0.278CS..G310 helixtrans-51.8126-179-62.5-176.3000109.8Q89 L90 V154 N158 E159 E214 Y218Q89-I156 HydrophobicContact CG-CD1 4.43Å; L90-I156 HydrophobicContact CD2-CD1 4.28Å; V154-I156 VanDerWaalsContact C-N 3.34Å; V154-I156 HydrophobicContact CG1-CD1 4.41Å; V154-I156 HydrophobicContact CG1-CG1 3.7Å; V154-I156 PolarHBondContact O-N 2.91Å; I156-N158 PolarHBondContact O-N 2.97Å; I156-E159 PolarHBondContact O-N 2.98Å; I156-E214 HydrophobicContact CD1-CB 4.5Å; I156-E214 HydrophobicContact CD1-CG 4.5Å; I156-Y218 HydrophobicContact CD1-CE2 4Å; I156-Y218 HydrophobicContact CG2-CE2 3.87Å
157K93.3Very high96.3Very high154 Ų15456.9 Ų56.967%0.6727%0.274SS*.G310 helixtrans52.727179.1-61.6-67-173.8178.10114.1N155 E159 H217N155-K157 PolarHBondContact O-N 3.37Å; K157-E159 PolarHBondContact O-N 3.13Å; K157-H217 HydrophobicContact CG-CB 4.46Å
158N93.8Very high96.3Very high127 Ų12759 Ų5968%0.67929%0.287SS*.G310 helixtrans61.726.7-176.3-154.933.8000114.3N155 I156N155-N158 PolarHBondContact ND2-OD1 3.44Å; N155-N158 PolarHBondContact O-N 3.45Å; N155-N158 VanDerWaalsContact OD1-C 3.23Å; N155-N158 VanDerWaalsContact OD1-CA 3.28Å; N155-N158 WeakPolarHBondContact OD1-CA 3.41Å; I156-N158 PolarHBondContact O-N 2.97Å
159E93.9Very high96.3Very high43 Ų4363.9 Ų63.920%0.20131%0.312CS..  trans-106.85.5179.1-60.4-175.614100112.8N155 I156 K157 R161 K162 V163 R216 H217N155-E159 PolarHBondContact OD1-N 3.43Å; I156-E159 PolarHBondContact O-N 2.98Å; K157-E159 PolarHBondContact O-N 3.13Å; E159-R161 VanDerWaalsContact C-N 3.35Å; E159-R161 PolarHBondContact O-N 3.21Å; E159-K162 WeakPolarHBondContact O-CB 3Å; E159-K162 PolarHBondContact O-N 2.76Å; E159-V163 PolarHBondContact O-N 3.17Å; E159-R216 IonicContact OE1-NH2 2.86Å; E159-R216 PolarHBondContact OE1-NH2 3.27Å; E159-R216 IonicContact OE2-CZ 3.66Å; E159-R216 IonicContact OE2-NE 3.94Å; E159-R216 IonicContact OE2-NH2 2.69Å; E159-R216 PolarHBondContact OE2-NH2 2.92Å; E159-H217 IonicContact OE2-CD2 3.86Å; E159-H217 IonicContact OE2-CE1 3.61Å; E159-H217 IonicContact OE2-NE2 2.78Å; E159-H217 PolarHBondContact OE2-NE2 3.43Å
160G93.5Very high96.4Very high1 Ų163.8 Ų63.81%0.0131%0.307CS..Hα-helixtrans-55.4-42.8-175.900000113.5T151 N155 G164T151-G160 WeakPolarHBondContact O-CA 3.39Å; N155-G160 VanDerWaalsContact OD1-CA 3.23Å; N155-G160 WeakPolarHBondContact OD1-CA 3.39Å; N155-G160 PolarHBondContact OD1-N 2.88Å; G160-G164 WeakPolarHBondContact O-CA 3.29Å; G160-G164 PolarHBondContact O-N 3.26Å
161R95.8Very high96.4Very high190 Ų19063.6 Ų63.672%0.71731%0.306SS*.Hα-helixtrans-70-39.9175-68.6-177.774.7-177.33.1112.4E159 V163 I165E159-R161 VanDerWaalsContact C-N 3.35Å; E159-R161 PolarHBondContact O-N 3.21Å; R161-V163 VanDerWaalsContact C-N 3.29Å; R161-V163 PolarHBondContact O-N 2.98Å; R161-I165 HydrophobicContact CB-CD1 4.3Å; R161-I165 WeakPolarHBondContact O-CB 3.41Å; R161-I165 WeakPolarHBondContact O-CG1 3.34Å; R161-I165 PolarHBondContact O-N 3.43Å
162K95.6Very high96.5Very high160 Ų16065.7 Ų65.770%0.69632%0.323SS*.Hα-helixtrans-63.6-35.2-178.4-65.3-177.7180177.70112E159 P166E159-K162 WeakPolarHBondContact O-CB 3Å; E159-K162 PolarHBondContact O-N 2.76Å; K162-P166 WeakPolarHBondContact O-CD 3.49Å; K162-P166 VanDerWaalsContact O-CG 3.27Å; K162-P166 WeakPolarHBondContact O-CG 3.29Å
163V96.6Very high96.5Very high11 Ų1164.4 Ų64.47%0.06732%0.32CS..Hα-helixtrans-94.6-39.8178.1-175.10000111.8T151 E159 R161 P166 R167 V213T151-V163 HydrophobicContact CG2-CB 3.91Å; T151-V163 HydrophobicContact CG2-CG1 3.97Å; E159-V163 PolarHBondContact O-N 3.17Å; R161-V163 VanDerWaalsContact C-N 3.29Å; R161-V163 PolarHBondContact O-N 2.98Å; V163-P166 WeakPolarHBondContact O-CD 3.49Å; V163-R167 WeakPolarHBondContact O-CG 3.35Å; V163-R167 PolarHBondContact O-N 3.48Å; V163-R167 VanDerWaalsContact O-N 3.12Å; V163-V213 HydrophobicContact CG2-CB 4.08Å; V163-V213 HydrophobicContact CG2-CG1 3.36Å
164G97.4Very high96.7Very high0 Ų056.7 Ų56.70%029%0.286CS..Hα-helixtrans-68-38.8-175.300000113.6G160 R167 V168G160-G164 WeakPolarHBondContact O-CA 3.29Å; G160-G164 PolarHBondContact O-N 3.26Å; G164-R167 PolarHBondContact O-N 3.44Å; G164-V168 WeakPolarHBondContact O-CG2 3.32Å; G164-V168 PolarHBondContact O-N 3.44Å
165I97.7Very high96.8Very high82 Ų8257.6 Ų57.642%0.42129%0.292SS..Hα-helixtrans-63.2-51.5177.2-67.3168.8000111R161 R167 V168 I169R161-I165 HydrophobicContact CB-CD1 4.3Å; R161-I165 WeakPolarHBondContact O-CB 3.41Å; R161-I165 WeakPolarHBondContact O-CG1 3.34Å; R161-I165 PolarHBondContact O-N 3.43Å; I165-R167 VanDerWaalsContact C-N 3.26Å; I165-R167 PolarHBondContact O-N 2.82Å; I165-V168 PolarHBondContact O-N 3.38Å; I165-V168 VanDerWaalsContact O-N 3.12Å; I165-I169 HydrophobicContact CG2-CD1 3.96Å; I165-I169 WeakPolarHBondContact O-CG1 3.44Å; I165-I169 PolarHBondContact O-N 3.44Å
166P98.3Very high97Very high57 Ų5759.6 Ų59.637%0.3730%0.302SS..Hα-helixtrans-54.3-40.3171.9-28.835.1000113.5K162 V163 I169 L170K162-P166 WeakPolarHBondContact O-CD 3.49Å; K162-P166 VanDerWaalsContact O-CG 3.27Å; K162-P166 WeakPolarHBondContact O-CG 3.29Å; V163-P166 WeakPolarHBondContact O-CD 3.49Å; P166-I169 PolarHBondContact O-N 3.48Å; P166-L170 WeakPolarHBondContact O-CB 3.2Å; P166-L170 WeakPolarHBondContact O-CG 3.42Å; P166-L170 PolarHBondContact O-N 3.23Å
167R98.5Very high97.2Very high0 Ų060.2 Ų60.20%031%0.307CS..Hα-helixtrans-63.5-42175.7-78-176.4177.7168.211.6112.8A148 T151 V163 G164 I165 I169 L170 S171 Y207 T210 F211 E214A148-R167 HydrophobicContact CB-CB 3.89Å; T151-R167 PolarHBondContact OG1-NH1 3.22Å; V163-R167 WeakPolarHBondContact O-CG 3.35Å; V163-R167 PolarHBondContact O-N 3.48Å; V163-R167 VanDerWaalsContact O-N 3.12Å; G164-R167 PolarHBondContact O-N 3.44Å; I165-R167 VanDerWaalsContact C-N 3.26Å; I165-R167 PolarHBondContact O-N 2.82Å; R167-I169 VanDerWaalsContact C-N 3.35Å; R167-L170 PolarHBondContact O-N 3.2Å; R167-S171 WeakPolarHBondContact O-CB 3.46Å; R167-S171 PolarHBondContact O-N 3.31Å; R167-S171 PolarHBondContact O-OG 3.37Å; R167-Y207 HydrophobicContact CB-CD2 4.41Å; R167-Y207 HydrophobicContact CB-CE2 3.64Å; R167-Y207 HydrophobicContact CG-CD2 4.33Å; R167-Y207 HydrophobicContact CG-CE1 4.44Å; R167-Y207 HydrophobicContact CG-CE2 3.77Å; R167-Y207 WeakPolarHBondContact O-CE2 3.34Å; R167-T210 PolarHBondContact NE-OG1 3.44Å; R167-T210 VanDerWaalsContact NH2-C 3.33Å; R167-T210 PolarHBondContact NH2-O 2.94Å; R167-T210 VanDerWaalsContact NH2-O 3.16Å; R167-T210 PolarHBondContact NH2-OG1 3.3Å; R167-F211 VanDerWaalsContact NH2-CA 3.31Å; R167-F211 VanDerWaalsContact NH2-CD1 3.26Å; R167-E214 IonicContact CZ-OE2 2.79Å; R167-E214 IonicContact NH1-OE2 3.04Å; R167-E214 PolarHBondContact NH1-OE2 2.85Å; R167-E214 IonicContact NH2-OE2 2.66Å; R167-E214 PolarHBondContact NH2-OE2 2.84Å
168V98.8Very high97.4Very high50 Ų5054.5 Ų54.530%0.30329%0.285SS..Hα-helixtrans-62.8-43.9175.81700000110.8W145 A148 L152 G164 I165 S171 A172W145-V168 HydrophobicContact CH2-CG1 4.44Å; W145-V168 HydrophobicContact CZ3-CG1 4.2Å; A148-V168 HydrophobicContact CB-CG2 3.96Å; L152-V168 HydrophobicContact CD1-CG2 3.9Å; G164-V168 WeakPolarHBondContact O-CG2 3.32Å; G164-V168 PolarHBondContact O-N 3.44Å; I165-V168 PolarHBondContact O-N 3.38Å; I165-V168 VanDerWaalsContact O-N 3.12Å; V168-S171 PolarHBondContact O-N 3.24Å; V168-A172 WeakPolarHBondContact O-CB 3.45Å; V168-A172 PolarHBondContact O-N 2.99Å
169I98.6Very high97.6Very high101 Ų10152 Ų5252%0.51827%0.274SS..Hα-helixtrans-60-48.8176.6-65.9167.3000110I165 P166 R167 S171 A172 S173I165-I169 HydrophobicContact CG2-CD1 3.96Å; I165-I169 WeakPolarHBondContact O-CG1 3.44Å; I165-I169 PolarHBondContact O-N 3.44Å; P166-I169 PolarHBondContact O-N 3.48Å; R167-I169 VanDerWaalsContact C-N 3.35Å; I169-S171 PolarHBondContact O-N 3.02Å; I169-A172 PolarHBondContact O-N 2.89Å; I169-S173 PolarHBondContact O-N 3.19Å; I169-S173 PolarHBondContact O-OG 2.86Å; I169-S173 VanDerWaalsContact O-OG 3.11Å
170L98.6Very high97.8Very high34 Ų3453.1 Ų53.118%0.17828%0.281CS..Hα-helixtrans-62-42.5177.5-74.2168.7000112.3P166 R167 A172 S173 I174 Y207 T210P166-L170 WeakPolarHBondContact O-CB 3.2Å; P166-L170 WeakPolarHBondContact O-CG 3.42Å; P166-L170 PolarHBondContact O-N 3.23Å; R167-L170 PolarHBondContact O-N 3.2Å; L170-A172 VanDerWaalsContact C-N 3.33Å; L170-A172 PolarHBondContact O-N 2.9Å; L170-S173 PolarHBondContact O-N 3.31Å; L170-I174 WeakPolarHBondContact O-CB 3.4Å; L170-I174 WeakPolarHBondContact O-CD1 3.43Å; L170-I174 WeakPolarHBondContact O-CG1 3.43Å; L170-I174 PolarHBondContact O-N 3.45Å; L170-Y207 HydrophobicContact CB-CD2 3.81Å; L170-Y207 HydrophobicContact CD1-CD2 4.49Å; L170-T210 HydrophobicContact CD1-CG2 4.21Å
171S98.8Very high98Very high0 Ų055.4 Ų55.40%029%0.29CS..Hα-helixtrans-59.9-43174.9-62.70000111.8C144 R167 V168 I169 I174 T175 Y207C144-S171 WeakPolarHBondContact CB-OG 3.45Å; C144-S171 PolarHBondContact O-OG 2.97Å; R167-S171 WeakPolarHBondContact O-CB 3.46Å; R167-S171 PolarHBondContact O-N 3.31Å; R167-S171 PolarHBondContact O-OG 3.37Å; V168-S171 PolarHBondContact O-N 3.24Å; I169-S171 PolarHBondContact O-N 3.02Å; S171-I174 PolarHBondContact O-N 3.29Å; S171-T175 PolarHBondContact O-N 3.33Å; S171-T175 PolarHBondContact O-OG1 2.88Å; S171-T175 VanDerWaalsContact O-OG1 3.08Å; S171-Y207 WeakPolarHBondContact OG-CE2 3.41Å
172A98.7Very high98Very high44 Ų4452.8 Ų52.836%0.36428%0.284SS..Hα-helixtrans-65.4-42.8176.400000111.7W145 V168 I169 L170 T175 L176W145-A172 HydrophobicContact CH2-CB 4.34Å; W145-A172 HydrophobicContact CZ2-CB 4.31Å; V168-A172 WeakPolarHBondContact O-CB 3.45Å; V168-A172 PolarHBondContact O-N 2.99Å; I169-A172 PolarHBondContact O-N 2.89Å; L170-A172 VanDerWaalsContact C-N 3.33Å; L170-A172 PolarHBondContact O-N 2.9Å; A172-T175 PolarHBondContact O-N 2.92Å; A172-L176 WeakPolarHBondContact O-CB 3.42Å; A172-L176 PolarHBondContact O-N 3Å
173S98.7Very high98.1Very high43 Ų4349 Ų4930%0.30127%0.27SS..Hα-helixtrans-61.2-43.4174.2-62.20000112I169 L170 L176 C177I169-S173 PolarHBondContact O-N 3.19Å; I169-S173 PolarHBondContact O-OG 2.86Å; I169-S173 VanDerWaalsContact O-OG 3.11Å; L170-S173 PolarHBondContact O-N 3.31Å; S173-L176 PolarHBondContact O-N 3.25Å; S173-C177 WeakPolarHBondContact O-CB 2.92Å; S173-C177 PolarHBondContact O-N 3.47Å; S173-C177 PolarHBondContact O-SG 3.34Å
174I98.8Very high98.1Very high0 Ų049.7 Ų49.70%027%0.274CS..Hα-helixtrans-59-52175-73.8163.7000110.2T141 C144 L170 S171 L176 C177 V178 L200 C203 F204 Y207T141-I174 HydrophobicContact CG2-CG2 4.16Å; C144-I174 HydrophobicContact CB-CD1 4.43Å; L170-I174 WeakPolarHBondContact O-CB 3.4Å; L170-I174 WeakPolarHBondContact O-CD1 3.43Å; L170-I174 WeakPolarHBondContact O-CG1 3.43Å; L170-I174 PolarHBondContact O-N 3.45Å; S171-I174 PolarHBondContact O-N 3.29Å; I174-L176 VanDerWaalsContact C-N 3.31Å; I174-L176 PolarHBondContact O-N 2.94Å; I174-C177 PolarHBondContact O-N 3.25Å; I174-V178 WeakPolarHBondContact O-CG2 3.24Å; I174-V178 PolarHBondContact O-N 3.03Å; I174-L200 HydrophobicContact CB-CD1 4.19Å; I174-L200 HydrophobicContact CG1-CD1 4.45Å; I174-L200 HydrophobicContact CG2-CD1 3.73Å; I174-L200 WeakPolarHBondContact O-CD1 3.42Å; I174-C203 HydrophobicContact CD1-CB 4.37Å; I174-C203 HydrophobicContact CG1-CB 3.65Å; I174-F204 HydrophobicContact CD1-CD1 3.76Å; I174-F204 HydrophobicContact CD1-CE1 3.97Å; I174-F204 HydrophobicContact CD1-CG 4.07Å; I174-F204 HydrophobicContact CD1-CZ 4.49Å; I174-F204 HydrophobicContact CG1-CD1 4.49Å; I174-F204 HydrophobicContact CG1-CD2 4.45Å; I174-F204 HydrophobicContact CG1-CG 4.42Å; I174-F204 HydrophobicContact CG2-CD1 4.48Å; I174-F204 HydrophobicContact CG2-CD2 4.27Å; I174-F204 HydrophobicContact CG2-CE1 3.81Å; I174-F204 HydrophobicContact CG2-CE2 3.57Å; I174-F204 HydrophobicContact CG2-CZ 3.31Å; I174-Y207 HydrophobicContact CD1-CD2 4.49Å
175T98.7Very high97.9Very high47 Ų4752.7 Ų52.729%0.28829%0.288SS..Hα-helixtrans-60-41.8178.2-600000111.6W145 S171 A172 V178 V179W145-T175 PolarHBondContact NE1-OG1 3.26Å; S171-T175 PolarHBondContact O-N 3.33Å; S171-T175 PolarHBondContact O-OG1 2.88Å; S171-T175 VanDerWaalsContact O-OG1 3.08Å; A172-T175 PolarHBondContact O-N 2.92Å; T175-V178 PolarHBondContact O-N 3.28Å; T175-V179 WeakPolarHBondContact O-CG2 3.48Å; T175-V179 PolarHBondContact O-N 3.28Å
176L98.5Very high97.8Very high99 Ų9952.9 Ų52.952%0.51830%0.302SS..Hα-helixtrans-61.2-46.2175.5178.263.1000111.5A172 S173 I174 V178 V179 L180A172-L176 WeakPolarHBondContact O-CB 3.42Å; A172-L176 PolarHBondContact O-N 3Å; S173-L176 PolarHBondContact O-N 3.25Å; I174-L176 VanDerWaalsContact C-N 3.31Å; I174-L176 PolarHBondContact O-N 2.94Å; L176-V178 VanDerWaalsContact C-N 3.33Å; L176-V178 PolarHBondContact O-N 2.9Å; L176-V179 PolarHBondContact O-N 2.72Å; L176-L180 HydrophobicContact CD1-CD1 4.03Å; L176-L180 HydrophobicContact CD1-CG 4.01Å; L176-L180 HydrophobicContact CD2-CD1 4.48Å; L176-L180 HydrophobicContact CG-CD1 3.87Å; L176-L180 HydrophobicContact CG-CG 4.27Å; L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 VanDerWaalsContact O-CG 3.29Å; L176-L180 WeakPolarHBondContact O-CG 3.43Å; L176-L180 PolarHBondContact O-N 2.98Å
177C98.6Very high97.7Very high22 Ų2256 Ų5615%0.14931%0.311CS..Hα-helixtrans-61.6-39.4176.8-71.70000112S173 I174 Y181 V196 L200S173-C177 WeakPolarHBondContact O-CB 2.92Å; S173-C177 PolarHBondContact O-N 3.47Å; S173-C177 PolarHBondContact O-SG 3.34Å; I174-C177 PolarHBondContact O-N 3.25Å; C177-Y181 VanDerWaalsContact O-CB 3.25Å; C177-Y181 WeakPolarHBondContact O-CB 3.44Å; C177-Y181 PolarHBondContact O-N 3.47Å; C177-V196 HydrophobicContact CB-CG1 3.94Å; C177-V196 WeakPolarHBondContact O-CG1 3.35Å; C177-L200 HydrophobicContact CB-CB 3.81Å; C177-L200 HydrophobicContact CB-CD1 3.88Å; C177-L200 HydrophobicContact CB-CG 4.4Å
178V98.1Very high97.4Very high33 Ų3360 Ų6020%0.234%0.34CS..Hα-helixtrans-60.7-48.8174171.80000111I174 T175 L176 Y181 F182 L200I174-V178 WeakPolarHBondContact O-CG2 3.24Å; I174-V178 PolarHBondContact O-N 3.03Å; T175-V178 PolarHBondContact O-N 3.28Å; L176-V178 VanDerWaalsContact C-N 3.33Å; L176-V178 PolarHBondContact O-N 2.9Å; V178-Y181 WeakPolarHBondContact O-CB 3.24Å; V178-Y181 PolarHBondContact O-N 3.44Å; V178-F182 HydrophobicContact CG1-CD2 3.98Å; V178-F182 HydrophobicContact CG1-CE2 3.76Å; V178-F182 VanDerWaalsContact O-CD2 3.22Å; V178-F182 WeakPolarHBondContact O-CD2 3.48Å; V178-F182 PolarHBondContact O-N 3.44Å; V178-L200 HydrophobicContact CG2-CD1 3.75Å; V178-L200 HydrophobicContact CG2-CD2 3.87Å; V178-L200 HydrophobicContact CG2-CG 4.49Å
179V98.1Very high97.1Very high75 Ų7560 Ų6046%0.45534%0.338SS..Hα-helixtrans-62.3-47.4179.3171.40000111.1T175 L176 Y181 F182 I183T175-V179 WeakPolarHBondContact O-CG2 3.48Å; T175-V179 PolarHBondContact O-N 3.28Å; L176-V179 PolarHBondContact O-N 2.72Å; V179-Y181 VanDerWaalsContact C-N 3.32Å; V179-Y181 PolarHBondContact O-N 3.19Å; V179-F182 PolarHBondContact O-N 3.28Å; V179-I183 HydrophobicContact CG1-CD1 3.76Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CG1 3.48Å; V179-I183 PolarHBondContact O-N 3.44Å
180L98.1Very high96.7Very high66 Ų6659.2 Ų59.235%0.34633%0.332SS..Hα-helixtrans-61.8-39.7177.9-72176.5000111.9L176 F182 I183 L184 V196L176-L180 HydrophobicContact CD1-CD1 4.03Å; L176-L180 HydrophobicContact CD1-CG 4.01Å; L176-L180 HydrophobicContact CD2-CD1 4.48Å; L176-L180 HydrophobicContact CG-CD1 3.87Å; L176-L180 HydrophobicContact CG-CG 4.27Å; L176-L180 WeakPolarHBondContact O-CB 3.46Å; L176-L180 VanDerWaalsContact O-CG 3.29Å; L176-L180 WeakPolarHBondContact O-CG 3.43Å; L176-L180 PolarHBondContact O-N 2.98Å; L180-F182 PolarHBondContact O-N 3.33Å; L180-I183 PolarHBondContact O-N 3.33Å; L180-L184 WeakPolarHBondContact O-CB 3.35Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 3.03Å; L180-V196 HydrophobicContact CB-CG1 4.09Å
181Y97.3Very high96.5Very high50 Ų5058.2 Ų58.220%0.19633%0.326CS..Hα-helixtrans-56.3-51175.6172.9-92.6000111Y54 C177 V178 V179 I183 L184 M185 A193 Q197Y54-Y181 HydrophobicContact CD1-CE2 4.26Å; Y54-Y181 AromaticContact CE1-CE2 3.8Å; Y54-Y181 HydrophobicContact CE1-CE2 3.8Å; C177-Y181 VanDerWaalsContact O-CB 3.25Å; C177-Y181 WeakPolarHBondContact O-CB 3.44Å; C177-Y181 PolarHBondContact O-N 3.47Å; V178-Y181 WeakPolarHBondContact O-CB 3.24Å; V178-Y181 PolarHBondContact O-N 3.44Å; V179-Y181 VanDerWaalsContact C-N 3.32Å; V179-Y181 PolarHBondContact O-N 3.19Å; Y181-I183 PolarHBondContact O-N 2.97Å; Y181-L184 PolarHBondContact O-N 2.89Å; Y181-M185 HydrophobicContact CD1-CG 4.15Å; Y181-M185 HydrophobicContact CD2-CG 4.34Å; Y181-M185 HydrophobicContact CE1-CG 3.78Å; Y181-M185 HydrophobicContact CE2-CG 4.01Å; Y181-M185 HydrophobicContact CE2-SD 4.32Å; Y181-M185 HydrophobicContact CG-CG 4.41Å; Y181-M185 WeakPolarHBondContact O-CB 3.29Å; Y181-M185 VanDerWaalsContact O-CG 3.22Å; Y181-M185 WeakPolarHBondContact O-CG 3.29Å; Y181-M185 PolarHBondContact O-N 3.3Å; Y181-A193 HydrophobicContact CD2-CB 4.37Å; Y181-Q197 HydrophobicContact CD2-CB 4.21Å; Y181-Q197 HydrophobicContact CE2-CB 4.29Å
182F95.9Very high96.3Very high134 Ų13463.6 Ų63.659%0.58835%0.347SS*.Hα-helixtrans-64.7-39.1179.4-76.2-66.4000113V178 V179 L180 M185 A186V178-F182 HydrophobicContact CG1-CD2 3.98Å; V178-F182 HydrophobicContact CG1-CE2 3.76Å; V178-F182 VanDerWaalsContact O-CD2 3.22Å; V178-F182 WeakPolarHBondContact O-CD2 3.48Å; V178-F182 PolarHBondContact O-N 3.44Å; V179-F182 PolarHBondContact O-N 3.28Å; L180-F182 PolarHBondContact O-N 3.33Å; F182-M185 PolarHBondContact O-N 3.45Å; F182-A186 WeakPolarHBondContact O-CB 3.4Å; F182-A186 PolarHBondContact O-N 3.38Å
183I97.9Very high96.1Very high80 Ų8061.5 Ų61.541%0.4133%0.33SS..Hα-helixtrans-61.3-48.5175.5-67.9168.4000110.6V179 L180 Y181 A186 Q187V179-I183 HydrophobicContact CG1-CD1 3.76Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CG1 3.48Å; V179-I183 PolarHBondContact O-N 3.44Å; L180-I183 PolarHBondContact O-N 3.33Å; Y181-I183 PolarHBondContact O-N 2.97Å; I183-A186 PolarHBondContact O-N 2.89Å; I183-Q187 WeakPolarHBondContact O-CG 3.48Å; I183-Q187 PolarHBondContact O-N 3.36Å
184L96.6Very high96Very high27 Ų2759.4 Ų59.414%0.14132%0.316CS..Hα-helixtrans-67-38-178.8-67.9168.3000111.9L180 Y181 Q187 S188 I189 A193 V196L180-L184 WeakPolarHBondContact O-CB 3.35Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 3.03Å; Y181-L184 PolarHBondContact O-N 2.89Å; L184-Q187 CarbonylContact O-C 3.6Å; L184-Q187 PolarHBondContact O-N 3.28Å; L184-S188 PolarHBondContact O-N 2.84Å; L184-S188 VanDerWaalsContact O-N 3.13Å; L184-I189 HydrophobicContact CD2-CB 4.15Å; L184-I189 HydrophobicContact CD2-CD1 4.28Å; L184-I189 HydrophobicContact CD2-CG2 4.22Å; L184-I189 PolarHBondContact O-N 2.82Å; L184-A193 HydrophobicContact CB-CB 3.8Å; L184-V196 HydrophobicContact CD1-CB 4.42Å; L184-V196 HydrophobicContact CD1-CG2 3.76Å
185M93.7Very high95.9Very high63 Ų6363.1 Ų63.131%0.3133%0.33SS..Hα-helixtrans-62.3-44.4172.6-73.9-62.6-68.700111.6Y54 Y181 F182 Q187 S188 A193Y54-M185 HydrophobicContact CE1-SD 4.15Å; Y54-M185 PolarHBondContact OH-SD 3.37Å; Y181-M185 HydrophobicContact CD1-CG 4.15Å; Y181-M185 HydrophobicContact CD2-CG 4.34Å; Y181-M185 HydrophobicContact CE1-CG 3.78Å; Y181-M185 HydrophobicContact CE2-CG 4.01Å; Y181-M185 HydrophobicContact CE2-SD 4.32Å; Y181-M185 HydrophobicContact CG-CG 4.41Å; Y181-M185 WeakPolarHBondContact O-CB 3.29Å; Y181-M185 VanDerWaalsContact O-CG 3.22Å; Y181-M185 WeakPolarHBondContact O-CG 3.29Å; Y181-M185 PolarHBondContact O-N 3.3Å; F182-M185 PolarHBondContact O-N 3.45Å; M185-Q187 PolarHBondContact O-N 2.99Å; M185-S188 PolarHBondContact O-N 3.12Å; M185-A193 HydrophobicContact CG-CB 4.23Å; M185-A193 HydrophobicContact SD-CB 4.01Å
186A95.7Very high95.9Very high86 Ų8662.1 Ų62.171%0.71132%0.323SS*.Hα-helixtrans-63.2-29.5176.700000112.7F182 I183 S188F182-A186 WeakPolarHBondContact O-CB 3.4Å; F182-A186 PolarHBondContact O-N 3.38Å; I183-A186 PolarHBondContact O-N 2.89Å; A186-S188 VanDerWaalsContact C-N 3.32Å
187Q95.3Very high95.9Very high121 Ų12158 Ų5857%0.56530%0.302SS*.THydrogen-bonded Turntrans-86.30.6174.7-65.9178.5-3600113.4I183 L184 M185 I189I183-Q187 WeakPolarHBondContact O-CG 3.48Å; I183-Q187 PolarHBondContact O-N 3.36Å; L184-Q187 CarbonylContact O-C 3.6Å; L184-Q187 PolarHBondContact O-N 3.28Å; M185-Q187 PolarHBondContact O-N 2.99Å; Q187-I189 HydrophobicContact CB-CD1 3.76Å; Q187-I189 HydrophobicContact CB-CG1 3.73Å; Q187-I189 PolarHBondContact O-N 2.55Å
188S91.4Very high95.9Very high86 Ų8657.5 Ų57.560%0.60130%0.296SS*.THydrogen-bonded Turntrans58.428.6-175.2-52.20000114.1L184 M185 A186 H190L184-S188 PolarHBondContact O-N 2.84Å; L184-S188 VanDerWaalsContact O-N 3.13Å; M185-S188 PolarHBondContact O-N 3.12Å; A186-S188 VanDerWaalsContact C-N 3.32Å; S188-H190 PolarHBondContact O-CD2 3.08Å; S188-H190 PolarHBondContact O-N 2.96Å
189I92.6Very high95.9Very high50 Ų5057.3 Ų57.326%0.25630%0.301SS..  trans-93.171.4-179.6-54.7-180000109.2E44 L184 Q187 M191 Y192 A193E44-I189 VanDerWaalsContact OE1-CG2 3.3Å; E44-I189 WeakPolarHBondContact OE1-CG2 3.24Å; L184-I189 HydrophobicContact CD2-CB 4.15Å; L184-I189 HydrophobicContact CD2-CD1 4.28Å; L184-I189 HydrophobicContact CD2-CG2 4.22Å; L184-I189 PolarHBondContact O-N 2.82Å; Q187-I189 HydrophobicContact CB-CD1 3.76Å; Q187-I189 HydrophobicContact CB-CG1 3.73Å; Q187-I189 PolarHBondContact O-N 2.55Å; I189-M191 PolarHBondContact O-N 3.49Å; I189-Y192 HydrophobicContact CG2-CD2 3.42Å; I189-Y192 VanDerWaalsContact CG2-CD2 3.42Å; I189-Y192 HydrophobicContact CG2-CE2 4.32Å; I189-Y192 HydrophobicContact CG2-CG 4.15Å; I189-A193 WeakPolarHBondContact O-CB 3.15Å; I189-A193 PolarHBondContact O-N 3.34Å; I189-A193 VanDerWaalsContact O-N 3.08Å
190H91.8Very high95.9Very high84 Ų8454.1 Ų54.139%0.38928%0.281SS..Hα-helixtrans-67.3-35.6-166.3-69.2-71.9000115A52 Y54 S188 A193 A194A52-H190 HydrophobicContact CB-CB 3.9Å; Y54-H190 HydrophobicContact CE2-CB 4.11Å; Y54-H190 AromaticContact CE2-ND1 3.99Å; Y54-H190 AromaticContact CZ-ND1 3.89Å; Y54-H190 VanDerWaalsContact OH-CA 3.25Å; Y54-H190 WeakPolarHBondContact OH-CA 3.06Å; Y54-H190 WeakPolarHBondContact OH-CB 3.37Å; Y54-H190 PolarHBondContact OH-ND1 2.82Å; Y54-H190 PolarHBondContact OH-O 3.42Å; S188-H190 PolarHBondContact O-CD2 3.08Å; S188-H190 PolarHBondContact O-N 2.96Å; H190-A193 PolarHBondContact O-N 2.92Å; H190-A194 WeakPolarHBondContact O-CB 3.4Å; H190-A194 PolarHBondContact O-N 3.23Å
191M93.1Very high95.9Very high13 Ų1351.6 Ų51.66%0.06427%0.268CS..Hα-helixtrans-66.3-42.9-178.8-77.9-56.2-5600112.3L38 E44 A52 P53 I189 R195L38-M191 HydrophobicContact CB-SD 4.41Å; L38-M191 HydrophobicContact CD1-SD 4.01Å; E44-M191 HydrophobicContact CG-CB 3.78Å; E44-M191 HydrophobicContact CG-CG 3.95Å; A52-M191 HydrophobicContact CB-SD 3.74Å; P53-M191 VanDerWaalsContact CD-SD 3.6Å; P53-M191 HydrophobicContact CG-CE 4.1Å; I189-M191 PolarHBondContact O-N 3.49Å; M191-R195 WeakPolarHBondContact O-CG 3.49Å; M191-R195 PolarHBondContact O-N 3.46Å
192Y94.4Very high96Very high112 Ų11251.1 Ų51.144%0.43927%0.268SS..Hα-helixtrans-72.1-37.5176-67.1-83.2000111.4E44 I189 A194 R195 V196E44-Y192 VanDerWaalsContact CD-CE2 3.44Å; E44-Y192 HydrophobicContact CG-CE2 4.19Å; E44-Y192 WeakPolarHBondContact OE1-CD2 3.4Å; E44-Y192 VanDerWaalsContact OE1-CE2 3.32Å; E44-Y192 WeakPolarHBondContact OE1-CE2 3.19Å; I189-Y192 HydrophobicContact CG2-CD2 3.42Å; I189-Y192 VanDerWaalsContact CG2-CD2 3.42Å; I189-Y192 HydrophobicContact CG2-CE2 4.32Å; I189-Y192 HydrophobicContact CG2-CG 4.15Å; Y192-A194 VanDerWaalsContact C-N 3.33Å; Y192-A194 PolarHBondContact O-N 3.39Å; Y192-R195 PolarHBondContact O-N 2.83Å; Y192-V196 WeakPolarHBondContact O-CG2 3.38Å; Y192-V196 PolarHBondContact O-N 2.94Å
193A96Very high96.1Very high0 Ų046.1 Ų46.10%025%0.25CC..Hα-helixtrans-59.1-43.6174.200000111.9Y54 Y181 L184 M185 I189 H190 V196 Q197Y54-A193 HydrophobicContact CE1-CB 4Å; Y54-A193 WeakPolarHBondContact OH-CB 3.36Å; Y181-A193 HydrophobicContact CD2-CB 4.37Å; L184-A193 HydrophobicContact CB-CB 3.8Å; M185-A193 HydrophobicContact CG-CB 4.23Å; M185-A193 HydrophobicContact SD-CB 4.01Å; I189-A193 WeakPolarHBondContact O-CB 3.15Å; I189-A193 PolarHBondContact O-N 3.34Å; I189-A193 VanDerWaalsContact O-N 3.08Å; H190-A193 PolarHBondContact O-N 2.92Å; A193-V196 PolarHBondContact O-N 3.46Å; A193-Q197 PolarHBondContact O-N 3.25Å
194A96.4Very high96.2Very high0 Ų043.1 Ų43.10%023%0.234CC..Hα-helixtrans-60.4-45.917500000112A52 P53 Y54 H190 Y192 V196 Q197 W198A52-A194 HydrophobicContact CB-CB 4.28Å; P53-A194 HydrophobicContact CG-CB 4.2Å; Y54-A194 HydrophobicContact CD1-CB 3.85Å; Y54-A194 HydrophobicContact CD2-CB 4.27Å; Y54-A194 HydrophobicContact CE1-CB 3.92Å; Y54-A194 HydrophobicContact CE2-CB 4.36Å; Y54-A194 HydrophobicContact CG-CB 4.05Å; H190-A194 WeakPolarHBondContact O-CB 3.4Å; H190-A194 PolarHBondContact O-N 3.23Å; Y192-A194 VanDerWaalsContact C-N 3.33Å; Y192-A194 PolarHBondContact O-N 3.39Å; A194-V196 VanDerWaalsContact C-N 3.32Å; A194-V196 PolarHBondContact O-N 3.36Å; A194-Q197 WeakPolarHBondContact O-CB 3.14Å; A194-Q197 PolarHBondContact O-N 3Å; A194-Q197 VanDerWaalsContact O-N 3.12Å; A194-W198 VanDerWaalsContact O-CD1 3.29Å; A194-W198 PolarHBondContact O-N 2.88Å
195R97Very high96.3Very high78 Ų7842.4 Ų42.429%0.29423%0.23SC..Hα-helixtrans-59.9-41.5175.6-70169.3178.8161.23.7112.4L40 S42 M191 Y192 Q197 W198 G199L40-R195 HydrophobicContact CD2-CG 3.98Å; L40-R195 VanDerWaalsContact O-CZ 3.29Å; L40-R195 PolarHBondContact O-NE 3.38Å; L40-R195 PolarHBondContact O-NH2 3.39Å; S42-R195 PolarHBondContact O-NH2 2.86Å; M191-R195 WeakPolarHBondContact O-CG 3.49Å; M191-R195 PolarHBondContact O-N 3.46Å; Y192-R195 PolarHBondContact O-N 2.83Å; R195-Q197 VanDerWaalsContact C-N 3.33Å; R195-W198 PolarHBondContact O-N 3.07Å; R195-G199 PolarHBondContact O-N 2.98Å
196V98.1Very high96.5Very high26 Ų2642.4 Ų42.416%0.15824%0.237CC..Hα-helixtrans-64.8-38.4175.7170.90000111.1C177 L180 L184 Y192 A193 A194 G199 L200C177-V196 HydrophobicContact CB-CG1 3.94Å; C177-V196 WeakPolarHBondContact O-CG1 3.35Å; L180-V196 HydrophobicContact CB-CG1 4.09Å; L184-V196 HydrophobicContact CD1-CB 4.42Å; L184-V196 HydrophobicContact CD1-CG2 3.76Å; Y192-V196 WeakPolarHBondContact O-CG2 3.38Å; Y192-V196 PolarHBondContact O-N 2.94Å; A193-V196 PolarHBondContact O-N 3.46Å; A194-V196 VanDerWaalsContact C-N 3.32Å; A194-V196 PolarHBondContact O-N 3.36Å; V196-G199 PolarHBondContact O-N 3.25Å; V196-L200 WeakPolarHBondContact O-CB 3.37Å; V196-L200 PolarHBondContact O-N 2.68Å
197Q97.9Very high96.6Very high13 Ų1338.4 Ų38.46%0.06120%0.203CC..Hα-helixtrans-62.1-43.6174.5-171.4-168.247.500111.8Y54 Y181 A193 A194 R195 L200 V201Y54-Q197 VanDerWaalsContact CA-OE1 3.25Å; Y181-Q197 HydrophobicContact CD2-CB 4.21Å; Y181-Q197 HydrophobicContact CE2-CB 4.29Å; A193-Q197 PolarHBondContact O-N 3.25Å; A194-Q197 WeakPolarHBondContact O-CB 3.14Å; A194-Q197 PolarHBondContact O-N 3Å; A194-Q197 VanDerWaalsContact O-N 3.12Å; R195-Q197 VanDerWaalsContact C-N 3.33Å; Q197-L200 WeakPolarHBondContact O-CB 3.47Å; Q197-L200 PolarHBondContact O-N 2.94Å; Q197-V201 WeakPolarHBondContact O-CG2 3.39Å; Q197-V201 PolarHBondContact O-N 3.36Å
198W98.4Very high96.8Very high11 Ų1133.2 Ų33.24%0.04218%0.179CC..Hα-helixtrans-61.4-45.5173.6-83.192.5000111.9L24 W25 Y28 L40 P53 I55 A194 R195 L200 V201 M202L24-W198 HydrophobicContact CB-CH2 4.37Å; L24-W198 HydrophobicContact CB-CZ3 4.33Å; L24-W198 WeakPolarHBondContact O-CH2 3.5Å; W25-W198 AromaticContact CD2-CZ3 4Å; W25-W198 HydrophobicContact CD2-CZ3 4Å; W25-W198 HydrophobicContact CE3-CH2 4.43Å; W25-W198 HydrophobicContact CE3-CZ3 4.2Å; W25-W198 HydrophobicContact CG-CZ3 4.47Å; W25-W198 HydrophobicContact CH2-CE3 4.34Å; W25-W198 HydrophobicContact CH2-CZ3 4.49Å; W25-W198 HydrophobicContact CZ2-CE3 4.19Å; W25-W198 HydrophobicContact CZ2-CZ3 4.31Å; W25-W198 HydrophobicContact CZ3-CZ3 4.44Å; Y28-W198 AromaticContact CD2-CZ2 3.87Å; Y28-W198 HydrophobicContact CD2-CZ2 3.87Å; Y28-W198 HydrophobicContact CG-CH2 4.24Å; Y28-W198 HydrophobicContact CG-CZ2 4.01Å; L40-W198 HydrophobicContact CD1-CD2 4.19Å; L40-W198 HydrophobicContact CD1-CG 4.15Å; L40-W198 HydrophobicContact CD2-CG 4.18Å; P53-W198 PolarHBondContact O-NE1 3.05Å; I55-W198 HydrophobicContact CD1-CD2 3.87Å; I55-W198 HydrophobicContact CD1-CE3 4.05Å; I55-W198 HydrophobicContact CD1-CG 4.28Å; I55-W198 HydrophobicContact CD1-CH2 4.47Å; I55-W198 HydrophobicContact CD1-CZ2 4.32Å; I55-W198 HydrophobicContact CD1-CZ3 4.35Å; I55-W198 HydrophobicContact CG1-CD2 3.78Å; I55-W198 HydrophobicContact CG1-CE3 4.23Å; I55-W198 HydrophobicContact CG1-CG 4.3Å; I55-W198 HydrophobicContact CG1-CH2 3.98Å; I55-W198 HydrophobicContact CG1-CZ2 3.48Å; I55-W198 VanDerWaalsContact CG1-CZ2 3.48Å; I55-W198 HydrophobicContact CG1-CZ3 4.33Å; A194-W198 VanDerWaalsContact O-CD1 3.29Å; A194-W198 PolarHBondContact O-N 2.88Å; R195-W198 PolarHBondContact O-N 3.07Å; W198-L200 VanDerWaalsContact C-N 3.33Å; W198-L200 PolarHBondContact O-N 2.87Å; W198-V201 PolarHBondContact O-N 3.23Å; W198-M202 HydrophobicContact CE3-CE 3.64Å; W198-M202 HydrophobicContact CZ3-CE 3.65Å; W198-M202 VanDerWaalsContact O-CG 3.29Å; W198-M202 WeakPolarHBondContact O-CG 3.34Å; W198-M202 PolarHBondContact O-N 2.86Å
199G98.3Very high97.1Very high28 Ų2829.7 Ų29.729%0.28916%0.156SC..Hα-helixtrans-56.9-45.717400000112.5R195 V196 V201 M202 C203R195-G199 PolarHBondContact O-N 2.98Å; V196-G199 PolarHBondContact O-N 3.25Å; G199-V201 PolarHBondContact O-N 2.87Å; G199-M202 PolarHBondContact O-N 2.93Å; G199-C203 WeakPolarHBondContact O-CB 3.24Å; G199-C203 PolarHBondContact O-N 2.55Å; G199-C203 PolarHBondContact O-SG 3.08Å
200L98.6Very high97.4Very high8 Ų828.5 Ų28.54%0.04215%0.151CC..Hα-helixtrans-54.6-52.6176.1176.161.8000111.6F137 I174 C177 V178 V196 Q197 W198 C203 F204F137-L200 HydrophobicContact CD1-CD2 4.03Å; F137-L200 HydrophobicContact CD1-CG 4.45Å; F137-L200 HydrophobicContact CE1-CD2 4.28Å; I174-L200 HydrophobicContact CB-CD1 4.19Å; I174-L200 HydrophobicContact CG1-CD1 4.45Å; I174-L200 HydrophobicContact CG2-CD1 3.73Å; I174-L200 WeakPolarHBondContact O-CD1 3.42Å; C177-L200 HydrophobicContact CB-CB 3.81Å; C177-L200 HydrophobicContact CB-CD1 3.88Å; C177-L200 HydrophobicContact CB-CG 4.4Å; V178-L200 HydrophobicContact CG2-CD1 3.75Å; V178-L200 HydrophobicContact CG2-CD2 3.87Å; V178-L200 HydrophobicContact CG2-CG 4.49Å; V196-L200 WeakPolarHBondContact O-CB 3.37Å; V196-L200 PolarHBondContact O-N 2.68Å; Q197-L200 WeakPolarHBondContact O-CB 3.47Å; Q197-L200 PolarHBondContact O-N 2.94Å; W198-L200 VanDerWaalsContact C-N 3.33Å; W198-L200 PolarHBondContact O-N 2.87Å; L200-C203 PolarHBondContact O-N 3.2Å; L200-F204 HydrophobicContact CD1-CD2 3.91Å; L200-F204 HydrophobicContact CD1-CE2 3.56Å; L200-F204 HydrophobicContact CG-CD2 4.02Å; L200-F204 HydrophobicContact CG-CE2 3.91Å; L200-F204 WeakPolarHBondContact O-CD2 3.37Å; L200-F204 PolarHBondContact O-N 3.2Å
201V98.6Very high97.7Very high13 Ų1324.6 Ų24.68%0.07913%0.133CC..Hα-helixtrans-64.4-41.9-178.8173.80000111.2L24 I55 F137 Q197 W198 G199 C203 F204 L205L24-V201 HydrophobicContact CD1-CG1 3.62Å; I55-V201 HydrophobicContact CD1-CB 3.93Å; I55-V201 HydrophobicContact CD1-CG1 4.25Å; I55-V201 HydrophobicContact CD1-CG2 3.6Å; F137-V201 HydrophobicContact CE1-CG2 3.76Å; F137-V201 HydrophobicContact CZ-CG2 3.92Å; Q197-V201 WeakPolarHBondContact O-CG2 3.39Å; Q197-V201 PolarHBondContact O-N 3.36Å; W198-V201 PolarHBondContact O-N 3.23Å; G199-V201 PolarHBondContact O-N 2.87Å; V201-C203 VanDerWaalsContact C-N 3.33Å; V201-C203 PolarHBondContact O-N 2.92Å; V201-F204 WeakPolarHBondContact O-CB 3.37Å; V201-F204 PolarHBondContact O-N 3.38Å; V201-L205 HydrophobicContact CG1-CD1 4.12Å; V201-L205 HydrophobicContact CG1-CG 4.34Å; V201-L205 WeakPolarHBondContact O-CG 3.4Å; V201-L205 PolarHBondContact O-N 3.39Å
202M98.4Very high97.8Very high40 Ų4024.2 Ų24.220%0.19713%0.132CC..Hα-helixtrans-66.4-35177.5-64.6-58.9155.400112.2S21 W25 W198 G199 L205 S206S21-M202 PolarHBondContact OG-SD 2.58Å; W25-M202 HydrophobicContact CZ2-CE 4.29Å; W25-M202 VanDerWaalsContact NE1-CE 3.29Å; W198-M202 HydrophobicContact CE3-CE 3.64Å; W198-M202 HydrophobicContact CZ3-CE 3.65Å; W198-M202 VanDerWaalsContact O-CG 3.29Å; W198-M202 WeakPolarHBondContact O-CG 3.34Å; W198-M202 PolarHBondContact O-N 2.86Å; G199-M202 PolarHBondContact O-N 2.93Å; M202-L205 HydrophobicContact SD-CD1 4.37Å; M202-S206 VanDerWaalsContact O-CB 3.28Å; M202-S206 WeakPolarHBondContact O-CB 3.36Å; M202-S206 PolarHBondContact O-N 3.12Å; M202-S206 PolarHBondContact O-OG 3.3Å
203C98.8Very high97.9Very high29 Ų2920.9 Ų20.920%0.19612%0.123CC..Hα-helixtrans-64.4-42.4171.3-72.50000111.9I174 G199 L200 V201 S206 Y207I174-C203 HydrophobicContact CD1-CB 4.37Å; I174-C203 HydrophobicContact CG1-CB 3.65Å; G199-C203 WeakPolarHBondContact O-CB 3.24Å; G199-C203 PolarHBondContact O-N 2.55Å; G199-C203 PolarHBondContact O-SG 3.08Å; L200-C203 PolarHBondContact O-N 3.2Å; V201-C203 VanDerWaalsContact C-N 3.33Å; V201-C203 PolarHBondContact O-N 2.92Å; C203-S206 PolarHBondContact O-N 3.29Å; C203-Y207 WeakPolarHBondContact O-CB 3.36Å; C203-Y207 PolarHBondContact O-N 2.89Å
204F98.7Very high97.9Very high18 Ų1821.2 Ų21.28%0.07912%0.124CC..Hα-helixtrans-58.5-53.5173-89.5-64.4000111.8F137 T141 I174 L200 V201 S206 Y207 F208F137-F204 HydrophobicContact CD1-CD2 4.13Å; F137-F204 AromaticContact CD1-CE2 3.69Å; F137-F204 HydrophobicContact CD1-CE2 3.69Å; F137-F204 HydrophobicContact CE1-CD2 4.39Å; F137-F204 HydrophobicContact CE1-CE2 4.38Å; T141-F204 WeakPolarHBondContact OG1-CZ 3.38Å; I174-F204 HydrophobicContact CD1-CD1 3.76Å; I174-F204 HydrophobicContact CD1-CE1 3.97Å; I174-F204 HydrophobicContact CD1-CG 4.07Å; I174-F204 HydrophobicContact CD1-CZ 4.49Å; I174-F204 HydrophobicContact CG1-CD1 4.49Å; I174-F204 HydrophobicContact CG1-CD2 4.45Å; I174-F204 HydrophobicContact CG1-CG 4.42Å; I174-F204 HydrophobicContact CG2-CD1 4.48Å; I174-F204 HydrophobicContact CG2-CD2 4.27Å; I174-F204 HydrophobicContact CG2-CE1 3.81Å; I174-F204 HydrophobicContact CG2-CE2 3.57Å; I174-F204 HydrophobicContact CG2-CZ 3.31Å; L200-F204 HydrophobicContact CD1-CD2 3.91Å; L200-F204 HydrophobicContact CD1-CE2 3.56Å; L200-F204 HydrophobicContact CG-CD2 4.02Å; L200-F204 HydrophobicContact CG-CE2 3.91Å; L200-F204 WeakPolarHBondContact O-CD2 3.37Å; L200-F204 PolarHBondContact O-N 3.2Å; V201-F204 WeakPolarHBondContact O-CB 3.37Å; V201-F204 PolarHBondContact O-N 3.38Å; F204-S206 VanDerWaalsContact C-N 3.27Å; F204-S206 PolarHBondContact O-N 2.97Å; F204-Y207 WeakPolarHBondContact O-CA 3.28Å; F204-Y207 VanDerWaalsContact O-CB 3.29Å; F204-Y207 WeakPolarHBondContact O-CB 3.24Å; F204-Y207 PolarHBondContact O-N 2.78Å; F204-F208 HydrophobicContact CD1-CE2 4.44Å; F204-F208 WeakPolarHBondContact O-CD2 3.17Å; F204-F208 PolarHBondContact O-N 2.8Å
205L98.6Very high97.9Very high11 Ų1121.2 Ų21.26%0.05812%0.124CC..Hα-helixtrans-60.6-39.7-178.8-66.2179.1000111.5F16 T17 T20 L24 V201 M202 F208 G209F16-L205 HydrophobicContact CE1-CD2 3.9Å; F16-L205 HydrophobicContact CZ-CD2 4.13Å; T17-L205 HydrophobicContact CG2-CB 4.12Å; T17-L205 WeakPolarHBondContact CG2-O 3.42Å; T17-L205 PolarHBondContact OG1-O 3.14Å; T20-L205 HydrophobicContact CG2-CD1 4.24Å; T20-L205 HydrophobicContact CG2-CD2 3.83Å; L24-L205 HydrophobicContact CD1-CD1 4.45Å; V201-L205 HydrophobicContact CG1-CD1 4.12Å; V201-L205 HydrophobicContact CG1-CG 4.34Å; V201-L205 WeakPolarHBondContact O-CG 3.4Å; V201-L205 PolarHBondContact O-N 3.39Å; M202-L205 HydrophobicContact SD-CD1 4.37Å; L205-F208 PolarHBondContact O-N 3Å; L205-G209 PolarHBondContact O-N 3.11Å; L205-G209 VanDerWaalsContact O-N 3.08Å
206S98.6Very high97.8Very high64 Ų6420.7 Ų20.745%0.44812%0.122SC..Hα-helixtrans-62.4-42173.3-59.80000112.1M202 C203 F204 G209 T210M202-S206 VanDerWaalsContact O-CB 3.28Å; M202-S206 WeakPolarHBondContact O-CB 3.36Å; M202-S206 PolarHBondContact O-N 3.12Å; M202-S206 PolarHBondContact O-OG 3.3Å; C203-S206 PolarHBondContact O-N 3.29Å; F204-S206 VanDerWaalsContact C-N 3.27Å; F204-S206 PolarHBondContact O-N 2.97Å; S206-G209 PolarHBondContact O-N 3.36Å; S206-T210 WeakPolarHBondContact O-CG2 3.13Å; S206-T210 PolarHBondContact O-N 2.87Å
207Y98.8Very high97.6Very high1 Ų122.7 Ų22.70%0.00413%0.13CC..Hα-helixtrans-58.2-50.2175.4-174.8-71.5000111C144 Q147 A148 R167 L170 S171 I174 C203 F204 G209 T210 F211C144-Y207 HydrophobicContact CB-CD2 3.98Å; C144-Y207 HydrophobicContact CB-CE1 4.32Å; C144-Y207 HydrophobicContact CB-CE2 3.67Å; C144-Y207 HydrophobicContact CB-CG 4.43Å; C144-Y207 PolarHBondContact O-OH 2.81Å; Q147-Y207 HydrophobicContact CB-CE1 4.39Å; Q147-Y207 VanDerWaalsContact CB-OH 3.32Å; Q147-Y207 WeakPolarHBondContact CB-OH 3.33Å; A148-Y207 PolarHBondContact N-OH 3.3Å; R167-Y207 HydrophobicContact CB-CD2 4.41Å; R167-Y207 HydrophobicContact CB-CE2 3.64Å; R167-Y207 HydrophobicContact CG-CD2 4.33Å; R167-Y207 HydrophobicContact CG-CE1 4.44Å; R167-Y207 HydrophobicContact CG-CE2 3.77Å; R167-Y207 WeakPolarHBondContact O-CE2 3.34Å; L170-Y207 HydrophobicContact CB-CD2 3.81Å; L170-Y207 HydrophobicContact CD1-CD2 4.49Å; S171-Y207 WeakPolarHBondContact OG-CE2 3.41Å; I174-Y207 HydrophobicContact CD1-CD2 4.49Å; C203-Y207 WeakPolarHBondContact O-CB 3.36Å; C203-Y207 PolarHBondContact O-N 2.89Å; F204-Y207 WeakPolarHBondContact O-CA 3.28Å; F204-Y207 VanDerWaalsContact O-CB 3.29Å; F204-Y207 WeakPolarHBondContact O-CB 3.24Å; F204-Y207 PolarHBondContact O-N 2.78Å; Y207-G209 VanDerWaalsContact C-N 3.29Å; Y207-G209 PolarHBondContact O-N 3.33Å; Y207-T210 WeakPolarHBondContact O-CB 3.25Å; Y207-T210 WeakPolarHBondContact O-CG2 3.44Å; Y207-T210 PolarHBondContact O-N 3.23Å; Y207-T210 PolarHBondContact O-OG1 3.2Å; Y207-F211 HydrophobicContact CD1-CE2 4.35Å; Y207-F211 HydrophobicContact CE1-CE2 4.07Å; Y207-F211 HydrophobicContact CE1-CZ 4.06Å
208F98.2Very high97.4Very high13 Ų1324.4 Ų24.46%0.05714%0.136CC..Hα-helixtrans-62.8-36.3-179.6-85.1-88.1000112.6P13 F16 L107 F204 L205 T210 F211P13-F208 WeakPolarHBondContact CB-O 3.45Å; F16-F208 HydrophobicContact CD1-CB 3.71Å; F16-F208 HydrophobicContact CD1-CD1 4.47Å; F16-F208 HydrophobicContact CD1-CG 4.17Å; F16-F208 HydrophobicContact CE1-CB 3.47Å; F16-F208 VanDerWaalsContact CE1-CB 3.47Å; F16-F208 HydrophobicContact CE1-CD1 4.01Å; F16-F208 AromaticContact CE1-CD2 3.98Å; F16-F208 HydrophobicContact CE1-CD2 3.98Å; F16-F208 AromaticContact CE1-CG 3.55Å; F16-F208 HydrophobicContact CE1-CG 3.55Å; F16-F208 HydrophobicContact CZ-CG 4.35Å; L107-F208 HydrophobicContact CD1-CE1 3.64Å; L107-F208 HydrophobicContact CD1-CZ 3.45Å; L107-F208 VanDerWaalsContact CD1-CZ 3.45Å; L107-F208 HydrophobicContact CD2-CE1 3.89Å; L107-F208 HydrophobicContact CD2-CZ 4.43Å; L107-F208 HydrophobicContact CG-CE1 4.44Å; F204-F208 HydrophobicContact CD1-CE2 4.44Å; F204-F208 WeakPolarHBondContact O-CD2 3.17Å; F204-F208 PolarHBondContact O-N 2.8Å; L205-F208 PolarHBondContact O-N 3Å; F208-T210 PolarHBondContact O-N 3.48Å; F208-T210 VanDerWaalsContact O-N 3.11Å; F208-F211 AromaticContact CD1-CD2 4Å; F208-F211 HydrophobicContact CD1-CD2 4Å; F208-F211 AromaticContact CD1-CE2 3.82Å; F208-F211 HydrophobicContact CD1-CE2 3.82Å; F208-F211 HydrophobicContact CE1-CE2 4.11Å; F208-F211 HydrophobicContact CG-CE2 4.44Å; F208-F211 WeakPolarHBondContact O-CB 3.47Å; F208-F211 VanDerWaalsContact O-CD2 3.28Å; F208-F211 WeakPolarHBondContact O-CD2 3.25Å; F208-F211 PolarHBondContact O-N 3.39Å
209G98.2Very high97Very high12 Ų1232.6 Ų32.612%0.12417%0.167CC..Hα-helixtrans-56.8-29.4174.700000112.9T17 L205 S206 Y207 F211 A212T17-G209 WeakPolarHBondContact OG1-CA 3.3Å; T17-G209 PolarHBondContact OG1-N 3.3Å; T17-G209 VanDerWaalsContact OG1-N 3.15Å; L205-G209 PolarHBondContact O-N 3.11Å; L205-G209 VanDerWaalsContact O-N 3.08Å; S206-G209 PolarHBondContact O-N 3.36Å; Y207-G209 VanDerWaalsContact C-N 3.29Å; Y207-G209 PolarHBondContact O-N 3.33Å; G209-F211 PolarHBondContact O-N 2.86Å; G209-A212 WeakPolarHBondContact O-CB 3.37Å; G209-A212 PolarHBondContact O-N 2.86Å; G209-A212 VanDerWaalsContact O-N 3.13Å
210T98.1Very high96.7Very high25 Ų2532.5 Ų32.515%0.15316%0.158CC..THydrogen-bonded Turntrans-65-19.2177.873.40000113.8R167 L170 S206 Y207 F208 A212 V213R167-T210 PolarHBondContact NE-OG1 3.44Å; R167-T210 VanDerWaalsContact NH2-C 3.33Å; R167-T210 PolarHBondContact NH2-O 2.94Å; R167-T210 VanDerWaalsContact NH2-O 3.16Å; R167-T210 PolarHBondContact NH2-OG1 3.3Å; L170-T210 HydrophobicContact CD1-CG2 4.21Å; S206-T210 WeakPolarHBondContact O-CG2 3.13Å; S206-T210 PolarHBondContact O-N 2.87Å; Y207-T210 WeakPolarHBondContact O-CB 3.25Å; Y207-T210 WeakPolarHBondContact O-CG2 3.44Å; Y207-T210 PolarHBondContact O-N 3.23Å; Y207-T210 PolarHBondContact O-OG1 3.2Å; F208-T210 PolarHBondContact O-N 3.48Å; F208-T210 VanDerWaalsContact O-N 3.11Å; T210-A212 PolarHBondContact O-N 2.99Å; T210-V213 WeakPolarHBondContact O-CB 3.29Å; T210-V213 PolarHBondContact O-N 2.94Å
211F97.8Very high96.1Very high1 Ų137.7 Ų37.70%0.00418%0.182CC..Hα-helixtrans-61.9-24.4174.2-73.4-66.7000112.5P13 V82 R86 Q147 R167 Y207 F208 G209 V213 E214 F215P13-F211 HydrophobicContact CB-CB 3.92Å; P13-F211 HydrophobicContact CG-CB 4.02Å; V82-F211 HydrophobicContact CG1-CD2 4.08Å; V82-F211 HydrophobicContact CG1-CE2 4.46Å; V82-F211 HydrophobicContact CG1-CG 4.42Å; R86-F211 HydrophobicContact CG-CD1 4.48Å; R86-F211 HydrophobicContact CG-CE1 4.03Å; Q147-F211 HydrophobicContact CB-CE1 4.29Å; Q147-F211 HydrophobicContact CB-CZ 3.92Å; Q147-F211 HydrophobicContact CG-CE1 4.31Å; Q147-F211 HydrophobicContact CG-CZ 3.85Å; R167-F211 VanDerWaalsContact NH2-CA 3.31Å; R167-F211 VanDerWaalsContact NH2-CD1 3.26Å; Y207-F211 HydrophobicContact CD1-CE2 4.35Å; Y207-F211 HydrophobicContact CE1-CE2 4.07Å; Y207-F211 HydrophobicContact CE1-CZ 4.06Å; F208-F211 AromaticContact CD1-CD2 4Å; F208-F211 HydrophobicContact CD1-CD2 4Å; F208-F211 AromaticContact CD1-CE2 3.82Å; F208-F211 HydrophobicContact CD1-CE2 3.82Å; F208-F211 HydrophobicContact CE1-CE2 4.11Å; F208-F211 HydrophobicContact CG-CE2 4.44Å; F208-F211 WeakPolarHBondContact O-CB 3.47Å; F208-F211 VanDerWaalsContact O-CD2 3.28Å; F208-F211 WeakPolarHBondContact O-CD2 3.25Å; F208-F211 PolarHBondContact O-N 3.39Å; G209-F211 PolarHBondContact O-N 2.86Å; F211-V213 PolarHBondContact O-N 3.41Å; F211-V213 VanDerWaalsContact O-N 3.16Å; F211-E214 PolarHBondContact O-N 3.08Å; F211-E214 VanDerWaalsContact O-N 3.08Å; F211-F215 WeakPolarHBondContact O-CB 3.38Å; F211-F215 PolarHBondContact O-N 3.2Å
212A97.3Very high95.5Very high5 Ų544.8 Ų44.84%0.04122%0.218CC..Hα-helixtrans-53.8-37.4175.800000112.2M10 P13 L14 G209 T210 E214 F215 R216M10-A212 HydrophobicContact CB-CB 4.38Å; M10-A212 WeakPolarHBondContact CB-O 3.44Å; M10-A212 VanDerWaalsContact O-CB 3.28Å; M10-A212 WeakPolarHBondContact O-CB 3.19Å; P13-A212 HydrophobicContact CG-CB 3.9Å; P13-A212 VanDerWaalsContact CG-N 3.29Å; L14-A212 HydrophobicContact CD1-CB 4.23Å; L14-A212 HydrophobicContact CD2-CB 3.78Å; L14-A212 HydrophobicContact CG-CB 3.78Å; G209-A212 WeakPolarHBondContact O-CB 3.37Å; G209-A212 PolarHBondContact O-N 2.86Å; G209-A212 VanDerWaalsContact O-N 3.13Å; T210-A212 PolarHBondContact O-N 2.99Å; A212-E214 VanDerWaalsContact C-N 3.32Å; A212-E214 PolarHBondContact O-N 3.45Å; A212-F215 PolarHBondContact O-N 3.37Å; A212-R216 PolarHBondContact O-N 3.44Å
213V96.2Very high95Very high43 Ų4348.5 Ų48.526%0.26124%0.243SC..Hα-helixtrans-63.4-37.1-178.4178.40000111.9V163 T210 F211 R216 H217V163-V213 HydrophobicContact CG2-CB 4.08Å; V163-V213 HydrophobicContact CG2-CG1 3.36Å; T210-V213 WeakPolarHBondContact O-CB 3.29Å; T210-V213 PolarHBondContact O-N 2.94Å; F211-V213 PolarHBondContact O-N 3.41Å; F211-V213 VanDerWaalsContact O-N 3.16Å; V213-R216 WeakPolarHBondContact O-CD 3.37Å; V213-R216 WeakPolarHBondContact O-CG 3.22Å; V213-R216 PolarHBondContact O-NE 3.23Å; V213-H217 PolarHBondContact O-CD2 3.02Å
214E95.3Very high94.5Very high6 Ų653.3 Ų53.33%0.02828%0.275CS..Hα-helixtrans-88.6-35.2178.6-69.8172.198.600111.7R86 Q89 I156 R167 F211 A212 R216 H217R86-E214 IonicContact CZ-OE1 2.83Å; R86-E214 VanDerWaalsContact CZ-OE1 3.29Å; R86-E214 IonicContact CZ-OE2 3.14Å; R86-E214 VanDerWaalsContact CZ-OE2 3.31Å; R86-E214 IonicContact NH1-OE1 3.12Å; R86-E214 PolarHBondContact NH1-OE1 2.94Å; R86-E214 IonicContact NH1-OE2 2.72Å; R86-E214 PolarHBondContact NH1-OE2 3.13Å; R86-E214 VanDerWaalsContact NH1-OE2 3.14Å; R86-E214 VanDerWaalsContact NH2-CD 3.31Å; R86-E214 IonicContact NH2-OE1 3.29Å; R86-E214 PolarHBondContact NH2-OE1 3.49Å; R86-E214 IonicContact NH2-OE2 3.31Å; R86-E214 PolarHBondContact NH2-OE2 2.93Å; Q89-E214 PolarHBondContact NE2-O 2.78Å; I156-E214 HydrophobicContact CD1-CB 4.5Å; I156-E214 HydrophobicContact CD1-CG 4.5Å; R167-E214 IonicContact CZ-OE2 2.79Å; R167-E214 IonicContact NH1-OE2 3.04Å; R167-E214 PolarHBondContact NH1-OE2 2.85Å; R167-E214 IonicContact NH2-OE2 2.66Å; R167-E214 PolarHBondContact NH2-OE2 2.84Å; F211-E214 PolarHBondContact O-N 3.08Å; F211-E214 VanDerWaalsContact O-N 3.08Å; A212-E214 VanDerWaalsContact C-N 3.32Å; A212-E214 PolarHBondContact O-N 3.45Å; E214-R216 VanDerWaalsContact C-N 3.25Å; E214-R216 PolarHBondContact O-N 3.39Å; E214-H217 PolarHBondContact O-N 2.93Å
215F96.4Very high93.9Very high0 Ų057.1 Ų57.10%030%0.304CS..Hα-helixtrans-66.8-26.3179.9-80.320.4000112.4S7 W9 L12 P13 V82 L85 R86 Q89 F211 A212 H217 Y218S7-F215 WeakPolarHBondContact CB-O 3.32Å; W9-F215 WeakPolarHBondContact O-CD2 3.28Å; L12-F215 HydrophobicContact CD2-CE2 4.27Å; P13-F215 HydrophobicContact CG-CD2 4.28Å; V82-F215 HydrophobicContact CG1-CZ 4.33Å; V82-F215 HydrophobicContact CG2-CE2 4.49Å; L85-F215 HydrophobicContact CB-CE2 4.16Å; L85-F215 HydrophobicContact CB-CZ 3.99Å; L85-F215 HydrophobicContact CD1-CE2 4.4Å; R86-F215 HydrophobicContact CB-CE1 4.28Å; R86-F215 HydrophobicContact CB-CZ 4.17Å; Q89-F215 VanDerWaalsContact OE1-CE1 3.23Å; F211-F215 WeakPolarHBondContact O-CB 3.38Å; F211-F215 PolarHBondContact O-N 3.2Å; A212-F215 PolarHBondContact O-N 3.37Å; F215-H217 PolarHBondContact O-N 3.24Å; F215-Y218 PolarHBondContact O-N 2.9Å; F215-Y218 VanDerWaalsContact O-N 3.08Å; F215-Y218 VanDerWaalsContact O-O 3.13Å
216R95.5Very high93.2Very high67 Ų6765.3 Ų65.325%0.25334%0.342SS..THydrogen-bonded Turntrans-57.2-21.7173.980.9-165.8172.6-161.8-1114C6 S7 M10 E159 A212 V213 E214C6-R216 HydrophobicContact CB-CB 4.45Å; S7-R216 WeakPolarHBondContact CB-O 3.35Å; S7-R216 PolarHBondContact N-O 3.08Å; M10-R216 HydrophobicContact CB-CB 3.91Å; M10-R216 HydrophobicContact SD-CB 4.04Å; E159-R216 IonicContact OE1-NH2 2.86Å; E159-R216 PolarHBondContact OE1-NH2 3.27Å; E159-R216 IonicContact OE2-CZ 3.66Å; E159-R216 IonicContact OE2-NE 3.94Å; E159-R216 IonicContact OE2-NH2 2.69Å; E159-R216 PolarHBondContact OE2-NH2 2.92Å; A212-R216 PolarHBondContact O-N 3.44Å; V213-R216 WeakPolarHBondContact O-CD 3.37Å; V213-R216 WeakPolarHBondContact O-CG 3.22Å; V213-R216 PolarHBondContact O-NE 3.23Å; E214-R216 VanDerWaalsContact C-N 3.25Å; E214-R216 PolarHBondContact O-N 3.39Å
217H93.7Very high91.8Very high68 Ų6871.9 Ų71.932%0.31536%0.359SS..THydrogen-bonded Turntrans-93.5-3-177.7-58.8-63.3000113.7K157 E159 V213 E214 F215K157-H217 HydrophobicContact CG-CB 4.46Å; E159-H217 IonicContact OE2-CD2 3.86Å; E159-H217 IonicContact OE2-CE1 3.61Å; E159-H217 IonicContact OE2-NE2 2.78Å; E159-H217 PolarHBondContact OE2-NE2 3.43Å; V213-H217 PolarHBondContact O-CD2 3.02Å; E214-H217 PolarHBondContact O-N 2.93Å; F215-H217 PolarHBondContact O-N 3.24Å
218Y92.5Very high90Very high49 Ų4979.3 Ų79.319%0.19239%0.393CS..  trans-129.5134.9-172.2-75.2-103.3000111.5S7 Q89 I156 F215S7-Y218 WeakPolarHBondContact CB-O 3.31Å; S7-Y218 PolarHBondContact OG-O 2.96Å; Q89-Y218 HydrophobicContact CG-CD1 3.77Å; Q89-Y218 HydrophobicContact CG-CD2 3.88Å; Q89-Y218 HydrophobicContact CG-CE1 3.66Å; Q89-Y218 HydrophobicContact CG-CE2 3.81Å; Q89-Y218 HydrophobicContact CG-CG 3.85Å; I156-Y218 HydrophobicContact CD1-CE2 4Å; I156-Y218 HydrophobicContact CG2-CE2 3.87Å; F215-Y218 PolarHBondContact O-N 2.9Å; F215-Y218 VanDerWaalsContact O-N 3.08Å; F215-Y218 VanDerWaalsContact O-O 3.13Å
219R91.5Very high87.8Confident183 Ų18384.2 Ų84.269%0.69142%0.416SS*.  trans-104.3126.9169.6-171-178.9-178.3-147.92.3108.1E221R219-E221 VanDerWaalsContact CD-OE1 3.26Å; R219-E221 WeakPolarHBondContact CD-OE1 3.22Å; R219-E221 HydrophobicContact CG-CG 4.16Å; R219-E221 IonicContact CZ-OE1 3.08Å; R219-E221 IonicContact NE-OE1 3.31Å; R219-E221 PolarHBondContact NE-OE1 3.33Å; R219-E221 VanDerWaalsContact NH1-CD 3.28Å; R219-E221 IonicContact NH1-OE1 2.61Å; R219-E221 PolarHBondContact NH1-OE1 2.85Å; R219-E221 IonicContact NH1-OE2 3.72Å; R219-E221 IonicContact NH2-OE1 3.98Å
220Y90.4Very high85.5Confident27 Ų2790.3 Ų90.311%0.10645%0.446CS..  trans-102.7133.5168.3-49.2-86.1000108.2W9 L85 Q89W9-Y220 HydrophobicContact CB-CD2 3.99Å; W9-Y220 HydrophobicContact CB-CE2 4.1Å; W9-Y220 AromaticContact CD1-CD2 3.72Å; W9-Y220 AromaticContact CD2-CD2 3.62Å; W9-Y220 HydrophobicContact CD2-CD2 3.62Å; W9-Y220 HydrophobicContact CD2-CE2 4.46Å; W9-Y220 HydrophobicContact CD2-CG 4.46Å; W9-Y220 AromaticContact CE2-CD2 3.88Å; W9-Y220 HydrophobicContact CE3-CD2 4.19Å; W9-Y220 AromaticContact CG-CD2 3.5Å; W9-Y220 HydrophobicContact CG-CD2 3.5Å; W9-Y220 HydrophobicContact CG-CE2 4.12Å; W9-Y220 WeakPolarHBondContact CZ2-O 3.35Å; W9-Y220 AromaticContact NE1-CD2 3.92Å; W9-Y220 VanDerWaalsContact NE1-N 3.15Å; W9-Y220 PolarHBondContact NE1-O 2.89Å; L85-Y220 HydrophobicContact CB-CE1 4.15Å; L85-Y220 HydrophobicContact CB-CE2 4.12Å; L85-Y220 HydrophobicContact CD1-CD2 3.97Å; L85-Y220 HydrophobicContact CD1-CE2 4.09Å; L85-Y220 HydrophobicContact CD1-CG 4.46Å; L85-Y220 HydrophobicContact CD2-CD1 3.76Å; L85-Y220 HydrophobicContact CD2-CD2 4.06Å; L85-Y220 HydrophobicContact CD2-CE1 4.16Å; L85-Y220 HydrophobicContact CD2-CE2 4.44Å; L85-Y220 HydrophobicContact CD2-CG 3.71Å; L85-Y220 HydrophobicContact CG-CD2 4.42Å; L85-Y220 HydrophobicContact CG-CE2 4.45Å; L85-Y220 PolarHBondContact O-OH 3.33Å; Q89-Y220 HydrophobicContact CB-CE1 4.49Å; Q89-Y220 WeakPolarHBondContact CB-OH 3.32Å
221E87.6Confident83.1Confident117 Ų11796 Ų9655%0.54747%0.469SS..  trans-124129.4179.5-68.5174.9-143.800108R219R219-E221 VanDerWaalsContact CD-OE1 3.26Å; R219-E221 WeakPolarHBondContact CD-OE1 3.22Å; R219-E221 HydrophobicContact CG-CG 4.16Å; R219-E221 IonicContact CZ-OE1 3.08Å; R219-E221 IonicContact NE-OE1 3.31Å; R219-E221 PolarHBondContact NE-OE1 3.33Å; R219-E221 VanDerWaalsContact NH1-CD 3.28Å; R219-E221 IonicContact NH1-OE1 2.61Å; R219-E221 PolarHBondContact NH1-OE1 2.85Å; R219-E221 IonicContact NH1-OE2 3.72Å; R219-E221 IonicContact NH2-OE1 3.98Å
222I85.1Confident80.9Confident161 Ų161101.9 Ų101.983%0.82650%0.5SS*.  trans-100.7111.2174.3-58.3173.9000105.9
223V88.6Confident78.4Confident118 Ų118105.4 Ų105.472%0.71552%0.524SS*.  trans-100.6118.1178.5-177.90000108.1
224C87.6Confident76.3Confident130 Ų130109.5 Ų109.588%0.87854%0.539SS*.  trans-102.8115169.2-174.30000107.3
225S86.6Confident74.2Confident98 Ų98112.9 Ų112.969%0.68556%0.563SS**  trans-119.4138.1176.455.80000109.4
226E84.2Confident72.1Confident184 Ų184119.4 Ų119.486%0.8659%0.593SS**  trans-65.8135.4168.5-167.2166.9-162.600109Q228E226-Q228 VanDerWaalsContact C-N 3.25Å; E226-Q228 PolarHBondContact O-N 3.48Å
227Y69.2Low70.1Confident202 Ų202119 Ų11979%0.79260%0.6SS**  trans-75.282.8178-163.8-93000108.3E229Y227-E229 HydrophobicContact CD1-CG 3.87Å; Y227-E229 HydrophobicContact CE1-CG 3.63Å; Y227-E229 PolarHBondContact O-N 2.85Å; Y227-E229 VanDerWaalsContact O-N 3.14Å
228Q59.4Low68.3Low157 Ų157120.3 Ų120.373%0.73461%0.61SS**  trans-77.498.7169.8-162.7154-6.200107.3E226 N230E226-Q228 VanDerWaalsContact C-N 3.25Å; E226-Q228 PolarHBondContact O-N 3.48Å; Q228-N230 PolarHBondContact O-N 3.27Å
229E53.1Low66.5Low115 Ų115121.5 Ų121.554%0.53763%0.625SS.*  trans-52.3129.6166.8-82.1-168.6155.500108.8Y227 F231Y227-E229 HydrophobicContact CD1-CG 3.87Å; Y227-E229 HydrophobicContact CE1-CG 3.63Å; Y227-E229 PolarHBondContact O-N 2.85Å; Y227-E229 VanDerWaalsContact O-N 3.14Å; E229-F231 HydrophobicContact CB-CB 4.33Å; E229-F231 HydrophobicContact CB-CD2 4.28Å; E229-F231 PolarHBondContact O-N 3.29Å; E229-F231 VanDerWaalsContact OE2-CD2 3.28Å; E229-F231 WeakPolarHBondContact OE2-CD2 3.19Å
230N49.5Very low64.7Low141 Ų141118.8 Ų118.875%0.75462%0.62SS**THydrogen-bonded Turntrans-65.647.8165.1-74-35.4000111.4Q228 L232 S233Q228-N230 PolarHBondContact O-N 3.27Å; N230-L232 VanDerWaalsContact C-N 3.33Å; N230-S233 PolarHBondContact O-OG 3.19Å
231F47.6Very low63.1Low145 Ų145120.1 Ų120.164%0.63664%0.637SS**THydrogen-bonded Turntrans-82.5-13.2175.9-120-84.3000112.7E229E229-F231 HydrophobicContact CB-CB 4.33Å; E229-F231 HydrophobicContact CB-CD2 4.28Å; E229-F231 PolarHBondContact O-N 3.29Å; E229-F231 VanDerWaalsContact OE2-CD2 3.28Å; E229-F231 WeakPolarHBondContact OE2-CD2 3.19Å
232L50.8Low61.6Low124 Ų124118.1 Ų118.165%0.64964%0.636SS**Hα-helixtrans-82.7-23.8175.7-71.4169.4000113.3N230 F234 E236N230-L232 VanDerWaalsContact C-N 3.33Å; L232-F234 VanDerWaalsContact C-N 3.34Å; L232-F234 PolarHBondContact O-N 3.46Å; L232-E236 PolarHBondContact O-N 3.04Å
233S46.8Very low60.1Low78 Ų78116.7 Ų116.755%0.54563%0.625SS.*Hα-helixtrans-77-20.7177.570.50000113.4N230 S237N230-S233 PolarHBondContact O-OG 3.19Å; S233-S237 PolarHBondContact O-OG 3.43Å
234F50.4Low58.5Low130 Ų130120.1 Ų120.157%0.5763%0.627SS**Hα-helixtrans-85.2-36.5175.8-159.6-110.4000111.7L232 S237 L238L232-F234 VanDerWaalsContact C-N 3.34Å; L232-F234 PolarHBondContact O-N 3.46Å; F234-S237 PolarHBondContact O-N 3.3Å; F234-S237 PolarHBondContact O-OG 3.37Å; F234-L238 HydrophobicContact CD1-CD1 3.51Å; F234-L238 HydrophobicContact CD1-CG 4.45Å; F234-L238 HydrophobicContact CE1-CD1 3.21Å; F234-L238 HydrophobicContact CE1-CG 4.17Å; F234-L238 HydrophobicContact CG-CD1 4.41Å; F234-L238 HydrophobicContact CZ-CD1 3.89Å; F234-L238 HydrophobicContact CZ-CG 4.44Å; F234-L238 PolarHBondContact O-N 3.22Å
235S52Low56.9Low76 Ų76121.3 Ų121.353%0.53162%0.62SS.*Hα-helixtrans-67.1-40.3177.5-171.30000112.9S239S235-S239 VanDerWaalsContact O-CB 3.32Å; S235-S239 WeakPolarHBondContact O-CB 3.3Å; S235-S239 PolarHBondContact O-N 2.88Å
236E53.1Low55.4Low138 Ų138121.7 Ų121.765%0.64562%0.618SS**Hα-helixtrans-67.2-40.7175.2-79.8179.3155.400111.3L232 L238 S239 E240L232-E236 PolarHBondContact O-N 3.04Å; E236-L238 PolarHBondContact O-N 2.77Å; E236-S239 PolarHBondContact O-N 2.78Å; E236-E240 PolarHBondContact O-N 2.89Å
237S52.4Low53.9Low57 Ų57119.8 Ų119.840%0.39961%0.614SS.*Hα-helixtrans-66.9-33.7179.2730000114.2S233 F234 A241S233-S237 PolarHBondContact O-OG 3.43Å; F234-S237 PolarHBondContact O-N 3.3Å; F234-S237 PolarHBondContact O-OG 3.37Å; S237-A241 VanDerWaalsContact O-CB 3.23Å; S237-A241 WeakPolarHBondContact O-CB 3.36Å; S237-A241 PolarHBondContact O-N 3.3Å; S237-A241 VanDerWaalsContact O-N 3.13Å
238L55.3Low53.1Low97 Ų97118.5 Ų118.551%0.50862%0.615SS.*Hα-helixtrans-78.9-34175.8-86.7166.8000112.6F234 E236 S242F234-L238 HydrophobicContact CD1-CD1 3.51Å; F234-L238 HydrophobicContact CD1-CG 4.45Å; F234-L238 HydrophobicContact CE1-CD1 3.21Å; F234-L238 HydrophobicContact CE1-CG 4.17Å; F234-L238 HydrophobicContact CG-CD1 4.41Å; F234-L238 HydrophobicContact CZ-CD1 3.89Å; F234-L238 HydrophobicContact CZ-CG 4.44Å; F234-L238 PolarHBondContact O-N 3.22Å; E236-L238 PolarHBondContact O-N 2.77Å; L238-S242 VanDerWaalsContact O-CB 3.31Å; L238-S242 WeakPolarHBondContact O-CB 3.37Å; L238-S242 PolarHBondContact O-N 3.13Å
239S54.8Low52.3Low74 Ų74120.8 Ų120.852%0.51764%0.639SS.*Hα-helixtrans-66.3-47.5174.9-169.90000110.7S235 E236 S242 E243S235-S239 VanDerWaalsContact O-CB 3.32Å; S235-S239 WeakPolarHBondContact O-CB 3.3Å; S235-S239 PolarHBondContact O-N 2.88Å; E236-S239 PolarHBondContact O-N 2.78Å; S239-S242 PolarHBondContact O-N 3.28Å; S239-E243 PolarHBondContact O-N 3.3Å; S239-E243 VanDerWaalsContact O-N 3.09Å
240E54.8Low52.2Low125 Ų125121.1 Ų121.158%0.58464%0.644SS**Hα-helixtrans-64.2-41.7176.4-75.4-176.1152.900111.7E236 S242 E243 Y244E236-E240 PolarHBondContact O-N 2.89Å; E240-S242 VanDerWaalsContact C-N 3.32Å; E240-S242 PolarHBondContact O-N 3.33Å; E240-E243 PolarHBondContact O-N 3.06Å; E240-Y244 WeakPolarHBondContact O-CD2 3.46Å; E240-Y244 PolarHBondContact O-N 2.92Å
241A56.4Low52.4Low56 Ų56120 Ų12046%0.46364%0.638SS.*Hα-helixtrans-65.7-32.9177.700000113.4S237S237-A241 VanDerWaalsContact O-CB 3.23Å; S237-A241 WeakPolarHBondContact O-CB 3.36Å; S237-A241 PolarHBondContact O-N 3.3Å; S237-A241 VanDerWaalsContact O-N 3.13Å
242S55.9Low52.7Low74 Ų74118.6 Ų118.652%0.51764%0.638SS.*Hα-helixtrans-72.6-35175.9179.70000112.7L238 S239 E240 Q245 T246L238-S242 VanDerWaalsContact O-CB 3.31Å; L238-S242 WeakPolarHBondContact O-CB 3.37Å; L238-S242 PolarHBondContact O-N 3.13Å; S239-S242 PolarHBondContact O-N 3.28Å; E240-S242 VanDerWaalsContact C-N 3.32Å; E240-S242 PolarHBondContact O-N 3.33Å; S242-Q245 PolarHBondContact O-N 2.98Å; S242-T246 PolarHBondContact O-OG1 3.48Å
243E54.2Low52.8Low131 Ų131118.3 Ų118.361%0.61264%0.638SS**Hα-helixtrans-70.4-39.1-177.5-149.5166.5-163.100110.8S239 E240 Q245 T246S239-E243 PolarHBondContact O-N 3.3Å; S239-E243 VanDerWaalsContact O-N 3.09Å; E240-E243 PolarHBondContact O-N 3.06Å; E243-Q245 VanDerWaalsContact C-N 3.29Å; E243-Q245 PolarHBondContact O-N 3.28Å; E243-T246 PolarHBondContact O-OG1 3.47Å
244Y53.9Low53.1Low191 Ų191120.8 Ų120.875%0.74964%0.643SS**Hα-helixtrans-69.7-20.9175.1-85.1-83.2000114.8E240E240-Y244 WeakPolarHBondContact O-CD2 3.46Å; E240-Y244 PolarHBondContact O-N 2.92Å
245Q53.8Low53.3Low155 Ų155120.2 Ų120.272%0.72465%0.648SS**Hα-helixtrans-91.2-11.4-174.1-153.3165.71.700113.4S242 E243S242-Q245 PolarHBondContact O-N 2.98Å; E243-Q245 VanDerWaalsContact C-N 3.29Å; E243-Q245 PolarHBondContact O-N 3.28Å
246T55.3Low53.4Low105 Ų105123.4 Ų123.464%0.64466%0.657SS**Hα-helixtrans-91.9-11.7177.342.60000114S242 E243S242-T246 PolarHBondContact O-OG1 3.48Å; E243-T246 PolarHBondContact O-OG1 3.47Å
247D53.9Low53.4Low145 Ų145122.2 Ų122.278%0.77566%0.658SS**SBendtrans-93.37.7178.8-82-20.2000114.6
248Q51.8Low53.5Low174 Ų174127.7 Ų127.781%0.81368%0.679SS**  trans-116.527-176.6-69.7-155-9.300116.1
249V42.2Very low53.4Low205 Ų205130.5 Ų130.5100%1.24270%0.695SS**  trans-129.30172.1-173.40000111.9

Retrieved 249 of 249 residues in 184.5 ms (Link to these results)

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