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14-3-3 protein homolog

AlphaFold DB , UniProt , Accession O42766, Species CANAL (Candida albicans (strain SC5314 / ATCC MYA-2876), Yeast), Gene BMH1, Length 264 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
1M44.9Very low85.7Confident232 Ų23290.2 Ų90.2100%1.14347%0.471SS*.  0139.10-65.1-148-106.900106.6A3M1-A3 PolarHBondContact O-N 3.19Å
2P60.4Low86.7Confident124 Ų12482.7 Ų82.781%0.80543%0.432SS*.PPolyproline II helixtrans-53.7138.4166.124.2-30.4000108.1
3A73.3Confident87.6Confident50 Ų5081.3 Ų81.341%0.41342%0.42SS..PPolyproline II helixtrans-54.1141174.200000108.5M1 D7M1-A3 PolarHBondContact O-N 3.19Å; A3-D7 HydrophobicContact CB-CB 3.95Å
4S90Very high88.3Confident50 Ų5080.7 Ų80.735%0.3542%0.418SS..PPolyproline II helixtrans-61.7163.5173.768.60000110.1E6 D7 S8S4-E6 PolarHBondContact O-N 3.29Å; S4-D7 WeakPolarHBondContact CB-OD2 3.08Å; S4-D7 PolarHBondContact N-OD2 3.2Å; S4-D7 VanDerWaalsContact N-OD2 3.07Å; S4-D7 PolarHBondContact O-N 2.98Å; S4-D7 WeakPolarHBondContact OG-CB 3.26Å; S4-D7 PolarHBondContact OG-N 3.34Å; S4-D7 PolarHBondContact OG-OD2 2.95Å; S4-S8 WeakPolarHBondContact O-CB 3.04Å; S4-S8 PolarHBondContact O-N 3.29Å; S4-S8 PolarHBondContact O-OG 3.34Å
5R93.8Very high89Confident54 Ų5475.7 Ų75.720%0.20439%0.393CS..Hα-helixtrans-55.4-43.1174.3-175.2174.5172.6141.3-16.5110.3S8 V9 V31 S34 Q36 E37 E42R5-S8 PolarHBondContact O-N 3.45Å; R5-V9 WeakPolarHBondContact O-CG2 3.43Å; R5-V9 PolarHBondContact O-N 3.41Å; R5-V31 HydrophobicContact CG-CG1 3.98Å; R5-V31 HydrophobicContact CG-CG2 4.32Å; R5-S34 PolarHBondContact NH1-OG 3.11Å; R5-Q36 PolarHBondContact NH1-O 3.16Å; R5-E37 PolarHBondContact NH2-O 3.29Å; R5-E42 IonicContact CZ-OE1 3.89Å; R5-E42 VanDerWaalsContact CZ-OE1 3.3Å; R5-E42 IonicContact CZ-OE2 3.46Å; R5-E42 IonicContact NE-OE1 3.87Å; R5-E42 PolarHBondContact NE-OE1 2.96Å; R5-E42 IonicContact NE-OE2 2.82Å; R5-E42 IonicContact NH2-OE1 3Å; R5-E42 PolarHBondContact NH2-OE1 2.9Å; R5-E42 VanDerWaalsContact NH2-OE1 3.14Å; R5-E42 IonicContact NH2-OE2 3.85Å; R5-E42 PolarHBondContact NH2-OE2 3.31Å
6E94.3Very high89.5Confident163 Ų16375.3 Ų75.376%0.76239%0.388SS*.Hα-helixtrans-62.3-46.1176.5-65175.3-173.500112.2S4 S8 V9 Y10S4-E6 PolarHBondContact O-N 3.29Å; E6-S8 VanDerWaalsContact C-N 3.31Å; E6-S8 PolarHBondContact O-N 3.49Å; E6-V9 PolarHBondContact O-N 3.12Å; E6-Y10 WeakPolarHBondContact O-CB 3.39Å; E6-Y10 PolarHBondContact O-N 2.91Å
7D95.6Very high89.9Confident85 Ų8580.5 Ų80.546%0.45541%0.411SS..Hα-helixtrans-61.1-41.4175.8-64.6-40.6000111.4A3 S4 Y10 L11A3-D7 HydrophobicContact CB-CB 3.95Å; S4-D7 WeakPolarHBondContact CB-OD2 3.08Å; S4-D7 PolarHBondContact N-OD2 3.2Å; S4-D7 VanDerWaalsContact N-OD2 3.07Å; S4-D7 PolarHBondContact O-N 2.98Å; S4-D7 WeakPolarHBondContact OG-CB 3.26Å; S4-D7 PolarHBondContact OG-N 3.34Å; S4-D7 PolarHBondContact OG-OD2 2.95Å; D7-Y10 PolarHBondContact O-N 2.64Å; D7-L11 WeakPolarHBondContact O-CB 3.46Å; D7-L11 VanDerWaalsContact O-CG 3.24Å; D7-L11 WeakPolarHBondContact O-CG 3.48Å; D7-L11 PolarHBondContact O-N 3.13Å
8S97.1Very high90.4Very high3 Ų379.4 Ų79.42%0.02142%0.415CS..Hα-helixtrans-65.6-44180-54.70000110.9S4 R5 E6 L11 A12 N27S4-S8 WeakPolarHBondContact O-CB 3.04Å; S4-S8 PolarHBondContact O-N 3.29Å; S4-S8 PolarHBondContact O-OG 3.34Å; R5-S8 PolarHBondContact O-N 3.45Å; E6-S8 VanDerWaalsContact C-N 3.31Å; E6-S8 PolarHBondContact O-N 3.49Å; S8-L11 PolarHBondContact O-N 3.41Å; S8-A12 WeakPolarHBondContact O-CB 3.49Å; S8-A12 PolarHBondContact O-N 3.01Å; S8-N27 WeakPolarHBondContact O-CB 3.48Å
9V97.6Very high90.7Very high13 Ų1382.8 Ų82.88%0.07943%0.429CS..Hα-helixtrans-62.7-43.5174.6172.60000111R5 E6 A12 K13 V31 E42 L45R5-V9 WeakPolarHBondContact O-CG2 3.43Å; R5-V9 PolarHBondContact O-N 3.41Å; E6-V9 PolarHBondContact O-N 3.12Å; V9-A12 WeakPolarHBondContact O-CB 3.37Å; V9-A12 PolarHBondContact O-N 2.93Å; V9-K13 HydrophobicContact CG1-CD 4.48Å; V9-K13 WeakPolarHBondContact O-CG 3.48Å; V9-K13 PolarHBondContact O-N 3.47Å; V9-V31 HydrophobicContact CG2-CG1 4.23Å; V9-V31 HydrophobicContact CG2-CG2 3.75Å; V9-E42 HydrophobicContact CG2-CG 3.78Å; V9-L45 HydrophobicContact CG1-CD1 3.97Å
10Y97.6Very high91.1Very high145 Ų14585.5 Ų85.557%0.56943%0.433SS*.Hα-helixtrans-62.7-44.7177.6179.3-107.1000112.2E6 D7 A12 K13 L14E6-Y10 WeakPolarHBondContact O-CB 3.39Å; E6-Y10 PolarHBondContact O-N 2.91Å; D7-Y10 PolarHBondContact O-N 2.64Å; Y10-A12 VanDerWaalsContact C-N 3.33Å; Y10-A12 PolarHBondContact O-N 2.89Å; Y10-K13 PolarHBondContact O-N 2.9Å; Y10-L14 HydrophobicContact CD1-CD1 4.02Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE1-CG 4.12Å; Y10-L14 PolarHBondContact O-N 3.41Å
11L97.8Very high91.4Very high73 Ų7384 Ų8438%0.38242%0.423SS..Hα-helixtrans-64.2-36.5175.5-72172.5000112.1D7 S8 L14 A15 N27D7-L11 WeakPolarHBondContact O-CB 3.46Å; D7-L11 VanDerWaalsContact O-CG 3.24Å; D7-L11 WeakPolarHBondContact O-CG 3.48Å; D7-L11 PolarHBondContact O-N 3.13Å; S8-L11 PolarHBondContact O-N 3.41Å; L11-L14 HydrophobicContact CD2-CD1 4.44Å; L11-L14 PolarHBondContact O-N 3.03Å; L11-A15 VanDerWaalsContact O-CB 3.3Å; L11-A15 WeakPolarHBondContact O-CB 3.25Å; L11-A15 PolarHBondContact O-N 3.21Å; L11-N27 WeakPolarHBondContact CB-OD1 3.49Å
12A98.1Very high93.9Very high0 Ų078.1 Ų78.10%039%0.392CS..Hα-helixtrans-62.9-41.6173.800000111.9S8 V9 Y10 A15 E16 M24 N27 M28S8-A12 WeakPolarHBondContact O-CB 3.49Å; S8-A12 PolarHBondContact O-N 3.01Å; V9-A12 WeakPolarHBondContact O-CB 3.37Å; V9-A12 PolarHBondContact O-N 2.93Å; Y10-A12 VanDerWaalsContact C-N 3.33Å; Y10-A12 PolarHBondContact O-N 2.89Å; A12-A15 PolarHBondContact O-N 3.35Å; A12-E16 WeakPolarHBondContact O-CB 3.4Å; A12-E16 PolarHBondContact O-N 3.07Å; A12-M24 HydrophobicContact CB-CG 4.01Å; A12-N27 HydrophobicContact CB-CB 4.07Å; A12-M28 HydrophobicContact CB-CG 3.75Å; A12-M28 HydrophobicContact CB-SD 3.53Å; A12-M28 VanDerWaalsContact CB-SD 3.53Å
13K98.1Very high95.7Very high65 Ų6575.3 Ų75.328%0.28337%0.369SS..Hα-helixtrans-63.8-41.8174.5-68.6176.1-177.5-174.30112.1V9 Y10 E16 Q17 E41 L45V9-K13 HydrophobicContact CG1-CD 4.48Å; V9-K13 WeakPolarHBondContact O-CG 3.48Å; V9-K13 PolarHBondContact O-N 3.47Å; Y10-K13 PolarHBondContact O-N 2.9Å; K13-E16 PolarHBondContact O-N 3.35Å; K13-Q17 WeakPolarHBondContact O-CG 3.36Å; K13-Q17 PolarHBondContact O-N 3.36Å; K13-Q17 VanDerWaalsContact O-N 3.13Å; K13-E41 VanDerWaalsContact CE-CD 3.45Å; K13-E41 WeakPolarHBondContact CE-OE1 3.3Å; K13-E41 IonicContact NZ-OE1 3.85Å; K13-E41 PolarHBondContact NZ-OE1 2.9Å; K13-E41 IonicContact NZ-OE2 3.15Å; K13-E41 PolarHBondContact NZ-OE2 3.42Å; K13-L45 HydrophobicContact CG-CD1 4.03Å; K13-L45 HydrophobicContact CG-CD2 4.13Å
14L98Very high96.8Very high73 Ų7373 Ų7338%0.38235%0.349SS..Hα-helixtrans-63.8-41.6173.9-70.8179.4000111.8Y10 L11 Q17 A18Y10-L14 HydrophobicContact CD1-CD1 4.02Å; Y10-L14 HydrophobicContact CE1-CD1 3.46Å; Y10-L14 VanDerWaalsContact CE1-CD1 3.46Å; Y10-L14 HydrophobicContact CE1-CG 4.12Å; Y10-L14 PolarHBondContact O-N 3.41Å; L11-L14 HydrophobicContact CD2-CD1 4.44Å; L11-L14 PolarHBondContact O-N 3.03Å; L14-Q17 PolarHBondContact O-N 3.47Å; L14-A18 WeakPolarHBondContact O-CB 3.37Å; L14-A18 PolarHBondContact O-N 3.43Å; L14-A18 VanDerWaalsContact O-N 3.08Å
15A98Very high97.2Very high5 Ų571 Ų714%0.04134%0.335CS..Hα-helixtrans-64.8-39.4177.400000111.7L11 A12 A18 E19 R20 E23 M24L11-A15 VanDerWaalsContact O-CB 3.3Å; L11-A15 WeakPolarHBondContact O-CB 3.25Å; L11-A15 PolarHBondContact O-N 3.21Å; A12-A15 PolarHBondContact O-N 3.35Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 2.76Å; A15-E19 PolarHBondContact O-N 2.85Å; A15-R20 HydrophobicContact CB-CB 4.27Å; A15-R20 PolarHBondContact O-N 2.68Å; A15-E23 HydrophobicContact CB-CB 4.17Å; A15-M24 HydrophobicContact CB-CB 4.1Å
16E97.5Very high97.4Very high69 Ų6974.9 Ų74.932%0.32236%0.355SS..Hα-helixtrans-58.5-51173.4-178.1179.6-152.600111.5A12 K13 A18 E19 M24 L45A12-E16 WeakPolarHBondContact O-CB 3.4Å; A12-E16 PolarHBondContact O-N 3.07Å; K13-E16 PolarHBondContact O-N 3.35Å; E16-A18 PolarHBondContact O-N 3.28Å; E16-E19 PolarHBondContact O-N 3.38Å; E16-M24 HydrophobicContact CB-CE 3.94Å; E16-M24 HydrophobicContact CB-SD 4.02Å; E16-M24 HydrophobicContact CG-CE 4.22Å; E16-M24 HydrophobicContact CG-SD 4.48Å; E16-L45 WeakPolarHBondContact OE2-CD2 3.41Å
17Q97.2Very high97.6Very high165 Ų16568.5 Ų68.577%0.77133%0.327SS*.Hα-helixtrans-62.5-27178-68.7-174.86.400113.3K13 L14K13-Q17 WeakPolarHBondContact O-CG 3.36Å; K13-Q17 PolarHBondContact O-N 3.36Å; K13-Q17 VanDerWaalsContact O-N 3.13Å; L14-Q17 PolarHBondContact O-N 3.47Å
18A97.6Very high97.7Very high60 Ų6064.5 Ų64.550%0.49631%0.305SS..THydrogen-bonded Turntrans-92.54.9175.800000113.5L14 A15 E16 R20L14-A18 WeakPolarHBondContact O-CB 3.37Å; L14-A18 PolarHBondContact O-N 3.43Å; L14-A18 VanDerWaalsContact O-N 3.08Å; A15-A18 CarbonylContact O-C 3.51Å; A15-A18 PolarHBondContact O-N 2.76Å; E16-A18 PolarHBondContact O-N 3.28Å; A18-R20 HydrophobicContact CB-CG 3.92Å; A18-R20 WeakPolarHBondContact O-CG 3.33Å; A18-R20 PolarHBondContact O-N 3.04Å
19E97.2Very high97.6Very high144 Ų14467.1 Ų67.167%0.67332%0.316SS*.THydrogen-bonded Turntrans54.129.4-175.5-55.6-172.9140.700114A15 E16 Y21A15-E19 PolarHBondContact O-N 2.85Å; E16-E19 PolarHBondContact O-N 3.38Å; E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 WeakPolarHBondContact O-CD2 3.33Å; E19-Y21 PolarHBondContact O-N 3.18Å
20R98Very high97.5Very high137 Ų13769.2 Ų69.252%0.51734%0.335SS..  trans-94.663.3179.4-58.1-168.877.3-174.52.3111.2A15 A18 E22 E23 M24A15-R20 HydrophobicContact CB-CB 4.27Å; A15-R20 PolarHBondContact O-N 2.68Å; A18-R20 HydrophobicContact CB-CG 3.92Å; A18-R20 WeakPolarHBondContact O-CG 3.33Å; A18-R20 PolarHBondContact O-N 3.04Å; R20-E22 VanDerWaalsContact C-N 3.27Å; R20-E22 PolarHBondContact O-N 2.69Å; R20-E23 HydrophobicContact CB-CB 4.4Å; R20-E23 HydrophobicContact CB-CG 4.48Å; R20-E23 IonicContact CZ-OE1 3.66Å; R20-E23 IonicContact CZ-OE2 3.42Å; R20-E23 VanDerWaalsContact CZ-OE2 3.24Å; R20-E23 IonicContact NE-OE1 2.95Å; R20-E23 PolarHBondContact NE-OE1 3.07Å; R20-E23 IonicContact NE-OE2 2.57Å; R20-E23 PolarHBondContact NE-OE2 3.43Å; R20-E23 IonicContact NH1-OE1 3.03Å; R20-E23 PolarHBondContact NH1-OE1 3.26Å; R20-E23 IonicContact NH1-OE2 2.84Å; R20-E23 PolarHBondContact NH1-OE2 3.12Å; R20-E23 VanDerWaalsContact NH1-OE2 3.15Å; R20-E23 IonicContact NH2-OE1 3.97Å; R20-E23 PolarHBondContact NH2-OE1 2.6Å; R20-E23 IonicContact NH2-OE2 3.52Å; R20-E23 PolarHBondContact O-N 3.46Å; R20-M24 PolarHBondContact O-N 2.94Å; R20-M24 VanDerWaalsContact O-N 3.11Å
21Y98Very high97.5Very high53 Ų5362.3 Ų62.321%0.20831%0.308CS..Hα-helixtrans-62.9-25.8-171.2-55.5-70.7000115.3E19 M24 V25 V48 N52E19-Y21 HydrophobicContact CB-CE2 3.92Å; E19-Y21 WeakPolarHBondContact O-CD2 3.33Å; E19-Y21 PolarHBondContact O-N 3.18Å; Y21-M24 HydrophobicContact CD1-SD 4.09Å; Y21-M24 WeakPolarHBondContact O-CB 3.34Å; Y21-M24 PolarHBondContact O-N 3.35Å; Y21-V25 WeakPolarHBondContact O-CG2 3.36Å; Y21-V25 PolarHBondContact O-N 3.25Å; Y21-V48 HydrophobicContact CE1-CG1 4.37Å; Y21-N52 HydrophobicContact CD1-CB 3.54Å; Y21-N52 HydrophobicContact CD2-CB 3.43Å; Y21-N52 VanDerWaalsContact CD2-CB 3.43Å; Y21-N52 HydrophobicContact CE1-CB 3.8Å; Y21-N52 VanDerWaalsContact CE1-CG 3.47Å; Y21-N52 VanDerWaalsContact CE1-ND2 3.28Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.49Å; Y21-N52 HydrophobicContact CE2-CB 3.69Å; Y21-N52 HydrophobicContact CG-CB 3.33Å; Y21-N52 VanDerWaalsContact CZ-CG 3.41Å
22E97.4Very high97.4Very high109 Ų10958.9 Ų58.951%0.50929%0.29SS..Hα-helixtrans-64.8-42.7173-63.5-71.1179.800111.4R20 M24 V25 E26 V53R20-E22 VanDerWaalsContact C-N 3.27Å; R20-E22 PolarHBondContact O-N 2.69Å; E22-M24 VanDerWaalsContact C-N 3.3Å; E22-M24 PolarHBondContact O-N 2.99Å; E22-V25 WeakPolarHBondContact O-CB 3.29Å; E22-V25 PolarHBondContact O-N 2.79Å; E22-E26 WeakPolarHBondContact O-CG 3.3Å; E22-E26 PolarHBondContact O-N 2.68Å; E22-V53 HydrophobicContact CG-CG2 4.32Å; E22-V53 WeakPolarHBondContact OE1-CG1 3.47Å
23E97.6Very high97.2Very high66 Ų6661.7 Ų61.731%0.30831%0.309SS..Hα-helixtrans-69-33.7174.9-64.1-175.4170.900111.1A15 R20 V25 E26 N27A15-E23 HydrophobicContact CB-CB 4.17Å; R20-E23 HydrophobicContact CB-CB 4.4Å; R20-E23 HydrophobicContact CB-CG 4.48Å; R20-E23 IonicContact CZ-OE1 3.66Å; R20-E23 IonicContact CZ-OE2 3.42Å; R20-E23 VanDerWaalsContact CZ-OE2 3.24Å; R20-E23 IonicContact NE-OE1 2.95Å; R20-E23 PolarHBondContact NE-OE1 3.07Å; R20-E23 IonicContact NE-OE2 2.57Å; R20-E23 PolarHBondContact NE-OE2 3.43Å; R20-E23 IonicContact NH1-OE1 3.03Å; R20-E23 PolarHBondContact NH1-OE1 3.26Å; R20-E23 IonicContact NH1-OE2 2.84Å; R20-E23 PolarHBondContact NH1-OE2 3.12Å; R20-E23 VanDerWaalsContact NH1-OE2 3.15Å; R20-E23 IonicContact NH2-OE1 3.97Å; R20-E23 PolarHBondContact NH2-OE1 2.6Å; R20-E23 IonicContact NH2-OE2 3.52Å; R20-E23 PolarHBondContact O-N 3.46Å; E23-V25 VanDerWaalsContact C-N 3.33Å; E23-E26 PolarHBondContact O-N 3.49Å; E23-N27 PolarHBondContact O-N 2.82Å; E23-N27 PolarHBondContact O-ND2 3.36Å
24M97.7Very high96.8Very high0 Ų061 Ų610%031%0.313CS..Hα-helixtrans-61.4-42.7172.7-161.8-171.1-178.200110.9A12 A15 E16 R20 Y21 E22 M28 L45 V48 A49A12-M24 HydrophobicContact CB-CG 4.01Å; A15-M24 HydrophobicContact CB-CB 4.1Å; E16-M24 HydrophobicContact CB-CE 3.94Å; E16-M24 HydrophobicContact CB-SD 4.02Å; E16-M24 HydrophobicContact CG-CE 4.22Å; E16-M24 HydrophobicContact CG-SD 4.48Å; R20-M24 PolarHBondContact O-N 2.94Å; R20-M24 VanDerWaalsContact O-N 3.11Å; Y21-M24 HydrophobicContact CD1-SD 4.09Å; Y21-M24 WeakPolarHBondContact O-CB 3.34Å; Y21-M24 PolarHBondContact O-N 3.35Å; E22-M24 VanDerWaalsContact C-N 3.3Å; E22-M24 PolarHBondContact O-N 2.99Å; M24-M28 HydrophobicContact CG-CG 4.49Å; M24-M28 VanDerWaalsContact O-CB 3.3Å; M24-M28 WeakPolarHBondContact O-CB 3.31Å; M24-M28 VanDerWaalsContact O-CG 3.26Å; M24-M28 WeakPolarHBondContact O-CG 3.39Å; M24-M28 PolarHBondContact O-N 3.04Å; M24-L45 HydrophobicContact CE-CB 3.8Å; M24-L45 HydrophobicContact CE-CD2 3.41Å; M24-L45 VanDerWaalsContact CE-CD2 3.41Å; M24-L45 HydrophobicContact CE-CG 4.22Å; M24-L45 WeakPolarHBondContact CE-O 3.24Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.09Å; M24-V48 HydrophobicContact SD-CG1 4.25Å; M24-A49 HydrophobicContact CB-CB 3.79Å; M24-A49 HydrophobicContact CE-CB 4.35Å; M24-A49 HydrophobicContact CG-CB 3.58Å; M24-A49 VanDerWaalsContact SD-CA 3.57Å; M24-A49 HydrophobicContact SD-CB 3.53Å; M24-A49 VanDerWaalsContact SD-CB 3.53Å
25V98.1Very high96.2Very high8 Ų860.4 Ų60.45%0.04833%0.325CS..Hα-helixtrans-60.2-49.9173.4165.80000110.5Y21 E22 E23 N27 M28 K29 A49 Y50 V53Y21-V25 WeakPolarHBondContact O-CG2 3.36Å; Y21-V25 PolarHBondContact O-N 3.25Å; E22-V25 WeakPolarHBondContact O-CB 3.29Å; E22-V25 PolarHBondContact O-N 2.79Å; E23-V25 VanDerWaalsContact C-N 3.33Å; V25-N27 PolarHBondContact O-N 3.29Å; V25-M28 PolarHBondContact O-N 3.33Å; V25-K29 HydrophobicContact CG1-CD 3.7Å; V25-K29 HydrophobicContact CG1-CG 4.18Å; V25-K29 WeakPolarHBondContact O-CB 3.25Å; V25-K29 WeakPolarHBondContact O-CG 3.5Å; V25-K29 PolarHBondContact O-N 3.26Å; V25-A49 HydrophobicContact CG2-CB 3.73Å; V25-Y50 HydrophobicContact CB-CE2 4.46Å; V25-Y50 HydrophobicContact CG1-CD1 4.45Å; V25-Y50 HydrophobicContact CG1-CD2 4.47Å; V25-Y50 HydrophobicContact CG1-CE1 3.78Å; V25-Y50 HydrophobicContact CG1-CE2 3.8Å; V25-Y50 VanDerWaalsContact CG1-CZ 3.44Å; V25-Y50 HydrophobicContact CG2-CD1 4.02Å; V25-Y50 HydrophobicContact CG2-CD2 3.96Å; V25-Y50 HydrophobicContact CG2-CE1 4.18Å; V25-Y50 HydrophobicContact CG2-CE2 4.13Å; V25-Y50 HydrophobicContact CG2-CG 3.93Å; V25-V53 HydrophobicContact CG2-CG2 4.1Å
26E97.3Very high95.8Very high136 Ų13666 Ų6664%0.63635%0.349SS*.Hα-helixtrans-55.8-47.8179.9-71.2178.3-176.700112.7E22 E23 A30E22-E26 WeakPolarHBondContact O-CG 3.3Å; E22-E26 PolarHBondContact O-N 2.68Å; E23-E26 PolarHBondContact O-N 3.49Å; E26-A30 PolarHBondContact O-N 2.9Å
27N97.7Very high95.7Very high30 Ų3064.9 Ų64.916%0.1634%0.344CS..Hα-helixtrans-66.5-46.1178.5-76.4-71.6000112.1S8 L11 A12 E23 V25 K29 A30 V31S8-N27 WeakPolarHBondContact O-CB 3.48Å; L11-N27 WeakPolarHBondContact CB-OD1 3.49Å; A12-N27 HydrophobicContact CB-CB 4.07Å; E23-N27 PolarHBondContact O-N 2.82Å; E23-N27 PolarHBondContact O-ND2 3.36Å; V25-N27 PolarHBondContact O-N 3.29Å; N27-K29 VanDerWaalsContact C-N 3.29Å; N27-K29 PolarHBondContact O-N 2.82Å; N27-A30 WeakPolarHBondContact O-CB 3.35Å; N27-A30 PolarHBondContact O-N 3.34Å; N27-A30 VanDerWaalsContact O-N 3.12Å; N27-V31 WeakPolarHBondContact O-CG2 3.4Å; N27-V31 PolarHBondContact O-N 3.37Å
28M97.8Very high95.7Very high0 Ų057.4 Ų57.40%031%0.31CS..Hα-helixtrans-71-24.9-177.3-68.6-51.7-5100113.1A12 M24 V25 V31 A32 E42 L45 L46A12-M28 HydrophobicContact CB-CG 3.75Å; A12-M28 HydrophobicContact CB-SD 3.53Å; A12-M28 VanDerWaalsContact CB-SD 3.53Å; M24-M28 HydrophobicContact CG-CG 4.49Å; M24-M28 VanDerWaalsContact O-CB 3.3Å; M24-M28 WeakPolarHBondContact O-CB 3.31Å; M24-M28 VanDerWaalsContact O-CG 3.26Å; M24-M28 WeakPolarHBondContact O-CG 3.39Å; M24-M28 PolarHBondContact O-N 3.04Å; V25-M28 PolarHBondContact O-N 3.33Å; M28-V31 HydrophobicContact CE-CB 4.07Å; M28-V31 HydrophobicContact CE-CG1 4.1Å; M28-V31 HydrophobicContact CE-CG2 4.31Å; M28-V31 PolarHBondContact O-N 2.97Å; M28-V31 HydrophobicContact SD-CG2 4.32Å; M28-A32 WeakPolarHBondContact O-CB 3.38Å; M28-A32 PolarHBondContact O-N 2.89Å; M28-E42 HydrophobicContact CE-CB 3.99Å; M28-E42 WeakPolarHBondContact CE-O 3.37Å; M28-L45 HydrophobicContact CE-CB 4.04Å; M28-L45 HydrophobicContact CG-CB 4.17Å; M28-L45 HydrophobicContact SD-CB 3.81Å; M28-L45 HydrophobicContact SD-CD1 4.22Å; M28-L46 HydrophobicContact CB-CB 4.19Å; M28-L46 HydrophobicContact CB-CD1 3.63Å; M28-L46 HydrophobicContact CE-CB 4.28Å
29K96.8Very high95.6Very high58 Ų5857.2 Ų57.225%0.25231%0.305SS..Hα-helixtrans-64.9-42.9167.8-73.2172.877.2172.30112V25 N27 V31 A32 S33 Y50 D100 V104V25-K29 HydrophobicContact CG1-CD 3.7Å; V25-K29 HydrophobicContact CG1-CG 4.18Å; V25-K29 WeakPolarHBondContact O-CB 3.25Å; V25-K29 WeakPolarHBondContact O-CG 3.5Å; V25-K29 PolarHBondContact O-N 3.26Å; N27-K29 VanDerWaalsContact C-N 3.29Å; N27-K29 PolarHBondContact O-N 2.82Å; K29-V31 PolarHBondContact O-N 3.43Å; K29-A32 PolarHBondContact O-N 3.14Å; K29-S33 WeakPolarHBondContact O-CB 3.34Å; K29-S33 PolarHBondContact O-N 2.73Å; K29-S33 PolarHBondContact O-OG 2.99Å; K29-Y50 VanDerWaalsContact CD-OH 3.26Å; K29-Y50 WeakPolarHBondContact CD-OH 3.49Å; K29-Y50 HydrophobicContact CG-CE2 4.34Å; K29-Y50 WeakPolarHBondContact CG-OH 3.48Å; K29-D100 WeakPolarHBondContact CE-OD1 3.05Å; K29-D100 WeakPolarHBondContact CE-OD2 3.39Å; K29-D100 IonicContact NZ-OD1 3.61Å; K29-D100 PolarHBondContact NZ-OD1 3.34Å; K29-D100 IonicContact NZ-OD2 2.72Å; K29-D100 PolarHBondContact NZ-OD2 2.89Å; K29-V104 HydrophobicContact CG-CG2 4.08Å
30A95.3Very high95.4Very high57 Ų5754.1 Ų54.147%0.47130%0.296SS..Hα-helixtrans-59.9-38.7176.100000111.5E26 N27E26-A30 PolarHBondContact O-N 2.9Å; N27-A30 WeakPolarHBondContact O-CB 3.35Å; N27-A30 PolarHBondContact O-N 3.34Å; N27-A30 VanDerWaalsContact O-N 3.12Å
31V96.7Very high95.3Very high1 Ų151.6 Ų51.61%0.00629%0.289CS..Hα-helixtrans-64.5-49.9173.2179.30000111.1R5 V9 N27 M28 K29 S33 S34 L38 E42R5-V31 HydrophobicContact CG-CG1 3.98Å; R5-V31 HydrophobicContact CG-CG2 4.32Å; V9-V31 HydrophobicContact CG2-CG1 4.23Å; V9-V31 HydrophobicContact CG2-CG2 3.75Å; N27-V31 WeakPolarHBondContact O-CG2 3.4Å; N27-V31 PolarHBondContact O-N 3.37Å; M28-V31 HydrophobicContact CE-CB 4.07Å; M28-V31 HydrophobicContact CE-CG1 4.1Å; M28-V31 HydrophobicContact CE-CG2 4.31Å; M28-V31 PolarHBondContact O-N 2.97Å; M28-V31 HydrophobicContact SD-CG2 4.32Å; K29-V31 PolarHBondContact O-N 3.43Å; V31-S33 VanDerWaalsContact C-N 3.32Å; V31-S33 PolarHBondContact O-N 3.28Å; V31-S34 VanDerWaalsContact O-CB 3.31Å; V31-S34 WeakPolarHBondContact O-CB 3.5Å; V31-S34 PolarHBondContact O-N 2.72Å; V31-S34 VanDerWaalsContact O-N 3.15Å; V31-S34 PolarHBondContact O-OG 2.71Å; V31-L38 HydrophobicContact CG1-CD2 3.64Å; V31-E42 HydrophobicContact CG1-CB 4.48Å; V31-E42 HydrophobicContact CG1-CG 4.29Å
32A96Very high95.3Very high0 Ų050 Ų500%028%0.284CS..Hα-helixtrans-60.6-37.7-18000000113M28 K29 S34 V104 H108 L109M28-A32 WeakPolarHBondContact O-CB 3.38Å; M28-A32 PolarHBondContact O-N 2.89Å; K29-A32 PolarHBondContact O-N 3.14Å; A32-S34 PolarHBondContact O-N 3.42Å; A32-V104 HydrophobicContact CB-CG1 3.64Å; A32-H108 WeakPolarHBondContact O-CB 3.39Å; A32-L109 HydrophobicContact CB-CD1 4.32Å; A32-L109 HydrophobicContact CB-CD2 3.81Å; A32-L109 HydrophobicContact CB-CG 4.23Å
33S92.6Very high95.3Very high59 Ų5945.2 Ų45.241%0.41326%0.261SS..THydrogen-bonded Turntrans-77.31.8178.9-63.20000114.6K29 V31 G35 H108K29-S33 WeakPolarHBondContact O-CB 3.34Å; K29-S33 PolarHBondContact O-N 2.73Å; K29-S33 PolarHBondContact O-OG 2.99Å; V31-S33 VanDerWaalsContact C-N 3.32Å; V31-S33 PolarHBondContact O-N 3.28Å; S33-G35 PolarHBondContact O-N 2.87Å; S33-H108 PolarHBondContact OG-CD2 2.95Å; S33-H108 PolarHBondContact OG-NE2 3.22Å
34S90.5Very high95.2Very high52 Ų5243.3 Ų43.336%0.36425%0.253SS..THydrogen-bonded Turntrans-74.5-6.8179.2670000114.6R5 V31 A32 Q36R5-S34 PolarHBondContact NH1-OG 3.11Å; V31-S34 VanDerWaalsContact O-CB 3.31Å; V31-S34 WeakPolarHBondContact O-CB 3.5Å; V31-S34 PolarHBondContact O-N 2.72Å; V31-S34 VanDerWaalsContact O-N 3.15Å; V31-S34 PolarHBondContact O-OG 2.71Å; A32-S34 PolarHBondContact O-N 3.42Å; S34-Q36 PolarHBondContact O-N 3.03Å
35G85.5Confident95.2Very high60 Ų6043.8 Ų43.862%0.61926%0.256SS*.SBendtrans75.98.117800000114.7S33S33-G35 PolarHBondContact O-N 2.87Å
36Q90.4Very high95.2Very high121 Ų12143.4 Ų43.457%0.56525%0.253SS*.SBendtrans-109.3139.5175.2-73174.414.300109.3R5 S34 L38R5-Q36 PolarHBondContact NH1-O 3.16Å; S34-Q36 PolarHBondContact O-N 3.03Å; Q36-L38 PolarHBondContact O-N 3.3Å
37E94.4Very high95.2Very high46 Ų4637.5 Ų37.522%0.21523%0.227CC..PPolyproline II helixtrans-53.6140.1175.1-170.6169.4-158.200110.4R5 Q114 S118R5-E37 PolarHBondContact NH2-O 3.29Å; E37-Q114 PolarHBondContact OE1-N 3.25Å; E37-Q114 VanDerWaalsContact OE2-CB 3.29Å; E37-Q114 WeakPolarHBondContact OE2-CB 3.17Å; E37-Q114 VanDerWaalsContact OE2-CG 3.27Å; E37-Q114 WeakPolarHBondContact OE2-CG 3.41Å; E37-S118 VanDerWaalsContact OE1-CB 3.22Å; E37-S118 WeakPolarHBondContact OE1-CB 3.33Å; E37-S118 PolarHBondContact OE1-OG 3.41Å
38L96.8Very high95.1Very high9 Ų937.2 Ų37.25%0.04723%0.227CC..PPolyproline II helixtrans-74.9138.2176.3-59.5-171.9000110V31 Q36 E42 R43 L46 L109V31-L38 HydrophobicContact CG1-CD2 3.64Å; Q36-L38 PolarHBondContact O-N 3.3Å; L38-E42 HydrophobicContact CB-CB 4.01Å; L38-E42 HydrophobicContact CD2-CB 4.19Å; L38-E42 HydrophobicContact CG-CB 4.48Å; L38-R43 HydrophobicContact CB-CB 4.18Å; L38-L46 HydrophobicContact CD1-CD2 4.03Å; L38-L109 HydrophobicContact CD1-CD2 3.62Å; L38-L109 HydrophobicContact CD2-CD2 4.45Å; L38-L109 HydrophobicContact CG-CD2 3.71Å
39S96Very high95.2Very high55 Ų5537.2 Ų37.239%0.38523%0.227SC..PPolyproline II helixtrans-62.6165.2162.463.80000110.7E41 E42 R43S39-E41 VanDerWaalsContact C-N 3.26Å; S39-E41 PolarHBondContact O-N 2.79Å; S39-E42 WeakPolarHBondContact CB-OE2 3.41Å; S39-E42 PolarHBondContact N-OE2 3.28Å; S39-E42 PolarHBondContact O-N 3.01Å; S39-E42 WeakPolarHBondContact OG-CB 3.43Å; S39-E42 VanDerWaalsContact OG-CD 3.23Å; S39-E42 VanDerWaalsContact OG-CG 3.25Å; S39-E42 WeakPolarHBondContact OG-CG 3.39Å; S39-E42 PolarHBondContact OG-N 2.85Å; S39-E42 PolarHBondContact OG-OE2 3.25Å; S39-R43 VanDerWaalsContact O-CB 3.3Å; S39-R43 WeakPolarHBondContact O-CB 3.41Å; S39-R43 PolarHBondContact O-N 3.18Å
40V93.7Very high95.2Very high80 Ų8034.5 Ų34.549%0.48522%0.215SC..Hα-helixtrans-56-42.8176173.20000111.2N44V40-N44 WeakPolarHBondContact O-CB 3.5Å; V40-N44 PolarHBondContact O-N 3.08Å; V40-N44 PolarHBondContact O-ND2 3.42Å; V40-N44 PolarHBondContact O-OD1 3.03Å
41E95.6Very high95.3Very high83 Ų8334.9 Ų34.939%0.38821%0.206SC..Hα-helixtrans-62.9-50.1177.9-174.9178.6-142.400111.5K13 S39 R43 N44 L45K13-E41 VanDerWaalsContact CE-CD 3.45Å; K13-E41 WeakPolarHBondContact CE-OE1 3.3Å; K13-E41 IonicContact NZ-OE1 3.85Å; K13-E41 PolarHBondContact NZ-OE1 2.9Å; K13-E41 IonicContact NZ-OE2 3.15Å; K13-E41 PolarHBondContact NZ-OE2 3.42Å; S39-E41 VanDerWaalsContact C-N 3.26Å; S39-E41 PolarHBondContact O-N 2.79Å; E41-R43 VanDerWaalsContact C-N 3.35Å; E41-R43 PolarHBondContact O-N 2.85Å; E41-N44 PolarHBondContact O-N 2.9Å; E41-L45 HydrophobicContact CG-CD1 4.26Å; E41-L45 WeakPolarHBondContact O-CG 3.31Å; E41-L45 PolarHBondContact O-N 3.34Å
42E97.2Very high95.3Very high20 Ų2037.3 Ų37.39%0.09322%0.219CC..Hα-helixtrans-63.3-41.2-179.7-69.9163.7136.900112.1R5 V9 M28 V31 L38 S39 N44 L45 L46R5-E42 IonicContact CZ-OE1 3.89Å; R5-E42 VanDerWaalsContact CZ-OE1 3.3Å; R5-E42 IonicContact CZ-OE2 3.46Å; R5-E42 IonicContact NE-OE1 3.87Å; R5-E42 PolarHBondContact NE-OE1 2.96Å; R5-E42 IonicContact NE-OE2 2.82Å; R5-E42 IonicContact NH2-OE1 3Å; R5-E42 PolarHBondContact NH2-OE1 2.9Å; R5-E42 VanDerWaalsContact NH2-OE1 3.14Å; R5-E42 IonicContact NH2-OE2 3.85Å; R5-E42 PolarHBondContact NH2-OE2 3.31Å; V9-E42 HydrophobicContact CG2-CG 3.78Å; M28-E42 HydrophobicContact CE-CB 3.99Å; M28-E42 WeakPolarHBondContact CE-O 3.37Å; V31-E42 HydrophobicContact CG1-CB 4.48Å; V31-E42 HydrophobicContact CG1-CG 4.29Å; L38-E42 HydrophobicContact CB-CB 4.01Å; L38-E42 HydrophobicContact CD2-CB 4.19Å; L38-E42 HydrophobicContact CG-CB 4.48Å; S39-E42 WeakPolarHBondContact CB-OE2 3.41Å; S39-E42 PolarHBondContact N-OE2 3.28Å; S39-E42 PolarHBondContact O-N 3.01Å; S39-E42 WeakPolarHBondContact OG-CB 3.43Å; S39-E42 VanDerWaalsContact OG-CD 3.23Å; S39-E42 VanDerWaalsContact OG-CG 3.25Å; S39-E42 WeakPolarHBondContact OG-CG 3.39Å; S39-E42 PolarHBondContact OG-N 2.85Å; S39-E42 PolarHBondContact OG-OE2 3.25Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.34Å; E42-L45 PolarHBondContact O-N 3.43Å; E42-L46 PolarHBondContact O-N 2.9Å
43R97.2Very high95.4Very high9 Ų937.7 Ų37.73%0.03422%0.221CC..Hα-helixtrans-60.8-42.9174.7-178.6-167.571.2-164-1.1111.3L38 S39 E41 L46 S47 E117 F121 Y122L38-R43 HydrophobicContact CB-CB 4.18Å; S39-R43 VanDerWaalsContact O-CB 3.3Å; S39-R43 WeakPolarHBondContact O-CB 3.41Å; S39-R43 PolarHBondContact O-N 3.18Å; E41-R43 VanDerWaalsContact C-N 3.35Å; E41-R43 PolarHBondContact O-N 2.85Å; R43-L46 PolarHBondContact O-N 3.29Å; R43-S47 WeakPolarHBondContact O-CB 3.42Å; R43-S47 PolarHBondContact O-N 3.12Å; R43-E117 IonicContact CZ-OE1 2.6Å; R43-E117 IonicContact NH1-OE1 3.06Å; R43-E117 PolarHBondContact NH1-OE1 2.92Å; R43-E117 IonicContact NH2-OE1 2.8Å; R43-E117 PolarHBondContact NH2-OE1 3.37Å; R43-F121 HydrophobicContact CG-CD1 3.63Å; R43-F121 HydrophobicContact CG-CD2 4.47Å; R43-F121 HydrophobicContact CG-CE1 3.42Å; R43-F121 VanDerWaalsContact CG-CE1 3.42Å; R43-F121 HydrophobicContact CG-CE2 4.29Å; R43-F121 HydrophobicContact CG-CG 4.16Å; R43-F121 HydrophobicContact CG-CZ 3.78Å; R43-Y122 HydrophobicContact CG-CE1 3.95Å
44N95.2Very high95.6Very high25 Ų2535 Ų3513%0.13420%0.202CC..Hα-helixtrans-65.4-44.4178.1-70.1-8.8000111V40 E41 E42 L46 S47 V48V40-N44 WeakPolarHBondContact O-CB 3.5Å; V40-N44 PolarHBondContact O-N 3.08Å; V40-N44 PolarHBondContact O-ND2 3.42Å; V40-N44 PolarHBondContact O-OD1 3.03Å; E41-N44 PolarHBondContact O-N 2.9Å; E42-N44 VanDerWaalsContact C-N 3.32Å; E42-N44 PolarHBondContact O-N 3.34Å; N44-L46 PolarHBondContact O-N 3.16Å; N44-S47 WeakPolarHBondContact O-CB 3.31Å; N44-S47 PolarHBondContact O-N 2.92Å; N44-S47 VanDerWaalsContact O-N 3.13Å; N44-V48 WeakPolarHBondContact O-CG2 3.47Å; N44-V48 PolarHBondContact O-N 2.96Å
45L97.9Very high95.9Very high10 Ų1034 Ų345%0.05220%0.2CC..Hα-helixtrans-57.4-48.7174.9-72.2170.1000111.6V9 K13 E16 M24 M28 E41 E42 S47 V48 A49V9-L45 HydrophobicContact CG1-CD1 3.97Å; K13-L45 HydrophobicContact CG-CD1 4.03Å; K13-L45 HydrophobicContact CG-CD2 4.13Å; E16-L45 WeakPolarHBondContact OE2-CD2 3.41Å; M24-L45 HydrophobicContact CE-CB 3.8Å; M24-L45 HydrophobicContact CE-CD2 3.41Å; M24-L45 VanDerWaalsContact CE-CD2 3.41Å; M24-L45 HydrophobicContact CE-CG 4.22Å; M24-L45 WeakPolarHBondContact CE-O 3.24Å; M28-L45 HydrophobicContact CE-CB 4.04Å; M28-L45 HydrophobicContact CG-CB 4.17Å; M28-L45 HydrophobicContact SD-CB 3.81Å; M28-L45 HydrophobicContact SD-CD1 4.22Å; E41-L45 HydrophobicContact CG-CD1 4.26Å; E41-L45 WeakPolarHBondContact O-CG 3.31Å; E41-L45 PolarHBondContact O-N 3.34Å; E42-L45 PolarHBondContact O-N 3.43Å; L45-S47 VanDerWaalsContact C-N 3.26Å; L45-S47 PolarHBondContact O-N 2.68Å; L45-V48 PolarHBondContact O-N 3.23Å; L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 3.3Å
46L98Very high96.4Very high0 Ų033 Ų330%019%0.186CC..Hα-helixtrans-57-43176.2-179.473.9000111.5M28 L38 E42 R43 N44 A49 Y50 I101 L109M28-L46 HydrophobicContact CB-CB 4.19Å; M28-L46 HydrophobicContact CB-CD1 3.63Å; M28-L46 HydrophobicContact CE-CB 4.28Å; L38-L46 HydrophobicContact CD1-CD2 4.03Å; E42-L46 PolarHBondContact O-N 2.9Å; R43-L46 PolarHBondContact O-N 3.29Å; N44-L46 PolarHBondContact O-N 3.16Å; L46-A49 PolarHBondContact O-N 3.37Å; L46-Y50 HydrophobicContact CD1-CD2 3.79Å; L46-Y50 HydrophobicContact CD1-CE2 3.66Å; L46-Y50 HydrophobicContact CG-CD2 4.24Å; L46-Y50 PolarHBondContact O-N 2.86Å; L46-I101 HydrophobicContact CD2-CD1 4.47Å; L46-L109 HydrophobicContact CD2-CD1 3.31Å
47S97.1Very high96.7Very high12 Ų1231.1 Ų31.18%0.08417%0.174CC..Hα-helixtrans-65.5-46179.6-163.40000112.4R43 N44 L45 A49 K51 P256R43-S47 WeakPolarHBondContact O-CB 3.42Å; R43-S47 PolarHBondContact O-N 3.12Å; N44-S47 WeakPolarHBondContact O-CB 3.31Å; N44-S47 PolarHBondContact O-N 2.92Å; N44-S47 VanDerWaalsContact O-N 3.13Å; L45-S47 VanDerWaalsContact C-N 3.26Å; L45-S47 PolarHBondContact O-N 2.68Å; S47-A49 VanDerWaalsContact C-N 3.33Å; S47-A49 PolarHBondContact O-N 3.04Å; S47-K51 WeakPolarHBondContact O-CB 3.18Å; S47-K51 PolarHBondContact O-N 3.18Å; S47-P256 WeakPolarHBondContact OG-CG 3.4Å
48V97.4Very high96.9Very high25 Ų2530.3 Ų30.315%0.15217%0.168CC..Hα-helixtrans-60.7-43.4176.9169.40000110.9Y21 M24 N44 L45 K51 N52Y21-V48 HydrophobicContact CE1-CG1 4.37Å; M24-V48 HydrophobicContact CE-CB 4.12Å; M24-V48 HydrophobicContact CE-CG1 4.09Å; M24-V48 HydrophobicContact SD-CG1 4.25Å; N44-V48 WeakPolarHBondContact O-CG2 3.47Å; N44-V48 PolarHBondContact O-N 2.96Å; L45-V48 PolarHBondContact O-N 3.23Å; V48-K51 PolarHBondContact O-N 3.47Å; V48-N52 PolarHBondContact O-N 3.41Å; V48-N52 VanDerWaalsContact O-N 3.09Å; V48-N52 PolarHBondContact O-ND2 2.94Å
49A98Very high96.9Very high0 Ų032 Ų320%018%0.184CC..Hα-helixtrans-56.2-60.8178.300000111.4M24 V25 L45 L46 S47 K51 N52 V53M24-A49 HydrophobicContact CB-CB 3.79Å; M24-A49 HydrophobicContact CE-CB 4.35Å; M24-A49 HydrophobicContact CG-CB 3.58Å; M24-A49 VanDerWaalsContact SD-CA 3.57Å; M24-A49 HydrophobicContact SD-CB 3.53Å; M24-A49 VanDerWaalsContact SD-CB 3.53Å; V25-A49 HydrophobicContact CG2-CB 3.73Å; L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 3.3Å; L46-A49 PolarHBondContact O-N 3.37Å; S47-A49 VanDerWaalsContact C-N 3.33Å; S47-A49 PolarHBondContact O-N 3.04Å; A49-K51 VanDerWaalsContact C-N 3.34Å; A49-K51 PolarHBondContact O-N 3.44Å; A49-N52 PolarHBondContact O-N 3.01Å; A49-V53 WeakPolarHBondContact O-CG2 3.4Å; A49-V53 PolarHBondContact O-N 3.11Å
50Y98.4Very high97Very high1 Ų131.1 Ų31.10%0.00418%0.177CC..Hα-helixtrans-68.5-31.5-176.7-86.6-77.3000112.9V25 K29 L46 I54 I97 D100 I101 Y129V25-Y50 HydrophobicContact CB-CE2 4.46Å; V25-Y50 HydrophobicContact CG1-CD1 4.45Å; V25-Y50 HydrophobicContact CG1-CD2 4.47Å; V25-Y50 HydrophobicContact CG1-CE1 3.78Å; V25-Y50 HydrophobicContact CG1-CE2 3.8Å; V25-Y50 VanDerWaalsContact CG1-CZ 3.44Å; V25-Y50 HydrophobicContact CG2-CD1 4.02Å; V25-Y50 HydrophobicContact CG2-CD2 3.96Å; V25-Y50 HydrophobicContact CG2-CE1 4.18Å; V25-Y50 HydrophobicContact CG2-CE2 4.13Å; V25-Y50 HydrophobicContact CG2-CG 3.93Å; K29-Y50 VanDerWaalsContact CD-OH 3.26Å; K29-Y50 WeakPolarHBondContact CD-OH 3.49Å; K29-Y50 HydrophobicContact CG-CE2 4.34Å; K29-Y50 WeakPolarHBondContact CG-OH 3.48Å; L46-Y50 HydrophobicContact CD1-CD2 3.79Å; L46-Y50 HydrophobicContact CD1-CE2 3.66Å; L46-Y50 HydrophobicContact CG-CD2 4.24Å; L46-Y50 PolarHBondContact O-N 2.86Å; Y50-I54 WeakPolarHBondContact O-CB 3.24Å; Y50-I54 WeakPolarHBondContact O-CG2 3.5Å; Y50-I54 PolarHBondContact O-N 2.93Å; Y50-I97 HydrophobicContact CD1-CG2 4.2Å; Y50-D100 HydrophobicContact CE1-CB 4.43Å; Y50-D100 PolarHBondContact OH-OD2 2.94Å; Y50-I101 HydrophobicContact CD1-CB 3.8Å; Y50-I101 HydrophobicContact CD1-CG1 4.43Å; Y50-I101 HydrophobicContact CD1-CG2 4.37Å; Y50-I101 HydrophobicContact CD2-CB 4.41Å; Y50-I101 HydrophobicContact CD2-CD1 3.76Å; Y50-I101 HydrophobicContact CD2-CG1 4.32Å; Y50-I101 HydrophobicContact CE1-CB 3.65Å; Y50-I101 HydrophobicContact CE1-CG2 4.46Å; Y50-I101 HydrophobicContact CE2-CB 4.27Å; Y50-I101 HydrophobicContact CE2-CD1 3.7Å; Y50-I101 HydrophobicContact CE2-CG1 4.41Å; Y50-I101 HydrophobicContact CG-CB 4.17Å; Y50-I101 HydrophobicContact CG-CD1 4.24Å; Y50-I101 HydrophobicContact CG-CG1 4.3Å; Y50-Y129 VanDerWaalsContact C-OH 3.23Å; Y50-Y129 VanDerWaalsContact CB-OH 3.29Å; Y50-Y129 WeakPolarHBondContact CB-OH 3.37Å; Y50-Y129 PolarHBondContact O-OH 3.16Å; Y50-Y129 VanDerWaalsContact O-OH 3.12Å
51K96Very high97.2Very high64 Ų6429.1 Ų29.128%0.27816%0.161SC..Hα-helixtrans-61.3-46.7175174.9-169.3174.7-160.50111.4S47 V48 A49 G55 P256S47-K51 WeakPolarHBondContact O-CB 3.18Å; S47-K51 PolarHBondContact O-N 3.18Å; V48-K51 PolarHBondContact O-N 3.47Å; A49-K51 VanDerWaalsContact C-N 3.34Å; A49-K51 PolarHBondContact O-N 3.44Å; K51-G55 WeakPolarHBondContact O-CA 3.43Å; K51-G55 PolarHBondContact O-N 3Å; K51-P256 HydrophobicContact CD-CG 4.15Å
52N96.9Very high97.2Very high52 Ų5228 Ų2828%0.27815%0.154SC..Hα-helixtrans-68.9-43.4-178-82.1-71.7000111.6Y21 V48 A49 G55 A56Y21-N52 HydrophobicContact CD1-CB 3.54Å; Y21-N52 HydrophobicContact CD2-CB 3.43Å; Y21-N52 VanDerWaalsContact CD2-CB 3.43Å; Y21-N52 HydrophobicContact CE1-CB 3.8Å; Y21-N52 VanDerWaalsContact CE1-CG 3.47Å; Y21-N52 VanDerWaalsContact CE1-ND2 3.28Å; Y21-N52 WeakPolarHBondContact CE1-ND2 3.49Å; Y21-N52 HydrophobicContact CE2-CB 3.69Å; Y21-N52 HydrophobicContact CG-CB 3.33Å; Y21-N52 VanDerWaalsContact CZ-CG 3.41Å; V48-N52 PolarHBondContact O-N 3.41Å; V48-N52 VanDerWaalsContact O-N 3.09Å; V48-N52 PolarHBondContact O-ND2 2.94Å; A49-N52 PolarHBondContact O-N 3.01Å; N52-G55 PolarHBondContact O-N 3.48Å; N52-A56 WeakPolarHBondContact O-CB 2.93Å; N52-A56 PolarHBondContact O-N 3.19Å; N52-A56 VanDerWaalsContact O-N 3.09Å
53V97.6Very high97.3Very high9 Ų932.2 Ų32.26%0.05518%0.175CC..Hα-helixtrans-60.3-53.3176.7174.30000111.2E22 V25 A49 G55 R57 I97E22-V53 HydrophobicContact CG-CG2 4.32Å; E22-V53 WeakPolarHBondContact OE1-CG1 3.47Å; V25-V53 HydrophobicContact CG2-CG2 4.1Å; A49-V53 WeakPolarHBondContact O-CG2 3.4Å; A49-V53 PolarHBondContact O-N 3.11Å; V53-G55 PolarHBondContact O-N 3.22Å; V53-R57 PolarHBondContact O-N 3.39Å; V53-I97 HydrophobicContact CG1-CD1 3.66Å; V53-I97 HydrophobicContact CG1-CG1 3.88Å; V53-I97 HydrophobicContact CG1-CG2 4.1Å
54I97.7Very high97.3Very high3 Ų332.5 Ų32.52%0.01518%0.178CC..Hα-helixtrans-68.1-37.5-179.2-160.972.8000111.8Y50 A56 R57 R58 L94 I97 Y129 Y132Y50-I54 WeakPolarHBondContact O-CB 3.24Å; Y50-I54 WeakPolarHBondContact O-CG2 3.5Å; Y50-I54 PolarHBondContact O-N 2.93Å; I54-A56 PolarHBondContact O-N 3.12Å; I54-R57 PolarHBondContact O-N 2.81Å; I54-R58 HydrophobicContact CG1-CG 4.14Å; I54-R58 WeakPolarHBondContact O-CB 3.26Å; I54-R58 WeakPolarHBondContact O-CG 3.27Å; I54-R58 PolarHBondContact O-N 2.94Å; I54-L94 HydrophobicContact CD1-CD2 3.54Å; I54-L94 HydrophobicContact CG1-CD2 4.21Å; I54-I97 HydrophobicContact CB-CG2 4.05Å; I54-I97 HydrophobicContact CD1-CB 3.76Å; I54-I97 HydrophobicContact CD1-CD1 4.29Å; I54-I97 HydrophobicContact CD1-CG2 3.56Å; I54-I97 HydrophobicContact CG1-CG2 4.36Å; I54-Y129 HydrophobicContact CB-CE1 3.92Å; I54-Y129 HydrophobicContact CD1-CE1 4.21Å; I54-Y129 HydrophobicContact CG1-CD1 4.48Å; I54-Y129 HydrophobicContact CG1-CE1 3.88Å; I54-Y129 HydrophobicContact CG2-CE1 3.96Å; I54-Y129 WeakPolarHBondContact CG2-OH 3.49Å; I54-Y132 HydrophobicContact CG1-CD2 3.97Å; I54-Y132 HydrophobicContact CG1-CE2 4.43Å; I54-Y132 HydrophobicContact CG2-CE2 4.17Å
55G96.3Very high97.4Very high30 Ų3032.2 Ų32.231%0.30918%0.178SC..Hα-helixtrans-60.7-46.4-179.200000111.7K51 N52 V53 R57 R58 A59K51-G55 WeakPolarHBondContact O-CA 3.43Å; K51-G55 PolarHBondContact O-N 3Å; N52-G55 PolarHBondContact O-N 3.48Å; V53-G55 PolarHBondContact O-N 3.22Å; G55-R57 PolarHBondContact O-N 2.97Å; G55-R58 PolarHBondContact O-N 3.34Å; G55-A59 WeakPolarHBondContact O-CB 3.39Å; G55-A59 PolarHBondContact O-N 3.46Å
56A95.8Very high97.4Very high40 Ų4033.9 Ų33.933%0.33119%0.19SC..Hα-helixtrans-64.5-39.717800000112.4N52 I54 S60N52-A56 WeakPolarHBondContact O-CB 2.93Å; N52-A56 PolarHBondContact O-N 3.19Å; N52-A56 VanDerWaalsContact O-N 3.09Å; I54-A56 PolarHBondContact O-N 3.12Å; A56-S60 PolarHBondContact O-N 3.03Å; A56-S60 VanDerWaalsContact O-N 3.12Å; A56-S60 PolarHBondContact O-OG 3.28Å
57R97.7Very high97.4Very high81 Ų8137.4 Ų37.431%0.30621%0.208SC..Hα-helixtrans-69.6-41.1175.3-68.3-33.496.8-144.67112.5V53 I54 G55 A59 S60 W61 L94 I97V53-R57 PolarHBondContact O-N 3.39Å; I54-R57 PolarHBondContact O-N 2.81Å; G55-R57 PolarHBondContact O-N 2.97Å; R57-A59 VanDerWaalsContact C-N 3.33Å; R57-A59 PolarHBondContact O-N 3.05Å; R57-S60 PolarHBondContact NH1-OG 3.18Å; R57-S60 VanDerWaalsContact NH1-OG 3.09Å; R57-S60 WeakPolarHBondContact O-CB 3.22Å; R57-S60 PolarHBondContact O-N 2.94Å; R57-S60 VanDerWaalsContact O-N 3.17Å; R57-W61 PolarHBondContact O-N 3.47Å; R57-L94 HydrophobicContact CB-CD2 3.47Å; R57-L94 VanDerWaalsContact CB-CD2 3.47Å; R57-L94 HydrophobicContact CB-CG 3.96Å; R57-I97 HydrophobicContact CB-CD1 4.19Å; R57-I97 HydrophobicContact CG-CD1 3.52Å
58R97.7Very high97.4Very high29 Ų2937.3 Ų37.311%0.10921%0.207CC..Hα-helixtrans-64.8-37.9177.1-73.2178.664.4-134.413.9111.6I54 G55 S60 W61 R62 L94 E135I54-R58 HydrophobicContact CG1-CG 4.14Å; I54-R58 WeakPolarHBondContact O-CB 3.26Å; I54-R58 WeakPolarHBondContact O-CG 3.27Å; I54-R58 PolarHBondContact O-N 2.94Å; G55-R58 PolarHBondContact O-N 3.34Å; R58-S60 VanDerWaalsContact C-N 3.35Å; R58-W61 PolarHBondContact O-N 3.46Å; R58-R62 VanDerWaalsContact CZ-NH2 3.29Å; R58-R62 WeakPolarHBondContact O-CG 3.29Å; R58-R62 PolarHBondContact O-N 3.09Å; R58-L94 HydrophobicContact CB-CD2 4.41Å; R58-L94 HydrophobicContact CG-CD2 3.54Å; R58-E135 IonicContact CZ-OE1 3.2Å; R58-E135 IonicContact CZ-OE2 2.79Å; R58-E135 IonicContact NE-OE1 3.26Å; R58-E135 IonicContact NE-OE2 3.79Å; R58-E135 PolarHBondContact NE-OE2 3.39Å; R58-E135 VanDerWaalsContact NH2-CD 3.27Å; R58-E135 IonicContact NH2-OE1 2.64Å; R58-E135 PolarHBondContact NH2-OE1 3.1Å; R58-E135 IonicContact NH2-OE2 3.36Å; R58-E135 PolarHBondContact NH2-OE2 3.5Å
59A97.1Very high97.3Very high45 Ų4540.4 Ų40.437%0.37222%0.22SC..Hα-helixtrans-61.4-44.8172.600000111.4G55 R57 W61 R62 I63G55-A59 WeakPolarHBondContact O-CB 3.39Å; G55-A59 PolarHBondContact O-N 3.46Å; R57-A59 VanDerWaalsContact C-N 3.33Å; R57-A59 PolarHBondContact O-N 3.05Å; A59-W61 PolarHBondContact O-N 2.72Å; A59-R62 PolarHBondContact O-N 3.06Å; A59-I63 WeakPolarHBondContact O-CG1 3.4Å; A59-I63 PolarHBondContact O-N 3.29Å; A59-I63 VanDerWaalsContact O-N 3.1Å
60S98Very high97.3Very high35 Ų3546.3 Ų46.325%0.24525%0.245CC..Hα-helixtrans-59.8-47.6176.1-54.30000111.5A56 R57 R58 R62 I63 V64A56-S60 PolarHBondContact O-N 3.03Å; A56-S60 VanDerWaalsContact O-N 3.12Å; A56-S60 PolarHBondContact O-OG 3.28Å; R57-S60 PolarHBondContact NH1-OG 3.18Å; R57-S60 VanDerWaalsContact NH1-OG 3.09Å; R57-S60 WeakPolarHBondContact O-CB 3.22Å; R57-S60 PolarHBondContact O-N 2.94Å; R57-S60 VanDerWaalsContact O-N 3.17Å; R58-S60 VanDerWaalsContact C-N 3.35Å; S60-R62 PolarHBondContact O-N 3.48Å; S60-I63 PolarHBondContact O-N 3.13Å; S60-V64 WeakPolarHBondContact O-CG2 3.46Å; S60-V64 PolarHBondContact O-N 2.96Å
61W98.3Very high97.2Very high38 Ų3847.7 Ų47.714%0.14425%0.252CS..Hα-helixtrans-59.6-44.6178.6175.676.6000112.6R57 R58 A59 V64 S65 I90 E91 L94 E135 F136R57-W61 PolarHBondContact O-N 3.47Å; R58-W61 PolarHBondContact O-N 3.46Å; A59-W61 PolarHBondContact O-N 2.72Å; W61-V64 PolarHBondContact O-N 2.89Å; W61-S65 WeakPolarHBondContact O-CB 3.36Å; W61-S65 PolarHBondContact O-N 3.47Å; W61-S65 PolarHBondContact O-OG 3.49Å; W61-I90 HydrophobicContact CB-CG2 3.71Å; W61-E91 PolarHBondContact NE1-OE1 2.94Å; W61-E91 VanDerWaalsContact NE1-OE1 3.13Å; W61-L94 HydrophobicContact CB-CD1 3.71Å; W61-L94 HydrophobicContact CG-CD1 3.91Å; W61-E135 HydrophobicContact CH2-CB 4.21Å; W61-E135 HydrophobicContact CZ3-CB 4.25Å; W61-F136 HydrophobicContact CD2-CB 4.41Å; W61-F136 HydrophobicContact CH2-CB 4.16Å; W61-F136 HydrophobicContact CZ2-CB 3.42Å; W61-F136 VanDerWaalsContact CZ2-CB 3.42Å
62R96.3Very high97.2Very high61 Ų6149.6 Ų49.623%0.2326%0.261CS..Hα-helixtrans-60.7-46.7176.9-74.6177.9179.9102.9-4.8112.6R58 A59 S60 V64 S65 S66 E135R58-R62 VanDerWaalsContact CZ-NH2 3.29Å; R58-R62 WeakPolarHBondContact O-CG 3.29Å; R58-R62 PolarHBondContact O-N 3.09Å; A59-R62 PolarHBondContact O-N 3.06Å; S60-R62 PolarHBondContact O-N 3.48Å; R62-V64 VanDerWaalsContact C-N 3.34Å; R62-V64 PolarHBondContact O-N 3.3Å; R62-S65 PolarHBondContact O-N 2.87Å; R62-S66 WeakPolarHBondContact O-CB 3.27Å; R62-S66 PolarHBondContact O-N 3.32Å; R62-E135 IonicContact NH2-OE2 3.66Å
63I97.9Very high97.2Very high108 Ų10851.5 Ų51.555%0.55428%0.284SS*.Hα-helixtrans-60.6-48.2179.4-69.3166.9000109.8A59 S60 S65 S66 I67A59-I63 WeakPolarHBondContact O-CG1 3.4Å; A59-I63 PolarHBondContact O-N 3.29Å; A59-I63 VanDerWaalsContact O-N 3.1Å; S60-I63 PolarHBondContact O-N 3.13Å; I63-S65 PolarHBondContact O-N 3.04Å; I63-S66 PolarHBondContact O-N 3.46Å; I63-I67 HydrophobicContact CG2-CD1 3.78Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.21Å; I63-I67 PolarHBondContact O-N 3.48Å
64V98.2Very high97.1Very high15 Ų1557.3 Ų57.39%0.09131%0.309CS..Hα-helixtrans-63.2-42.5179.8173.10000111.4S60 W61 R62 S66 I67 E68 I83 Y86 R87 I90S60-V64 WeakPolarHBondContact O-CG2 3.46Å; S60-V64 PolarHBondContact O-N 2.96Å; W61-V64 PolarHBondContact O-N 2.89Å; R62-V64 VanDerWaalsContact C-N 3.34Å; R62-V64 PolarHBondContact O-N 3.3Å; V64-S66 VanDerWaalsContact C-N 3.35Å; V64-S66 PolarHBondContact O-N 3.29Å; V64-I67 PolarHBondContact O-N 3.25Å; V64-E68 PolarHBondContact O-N 2.9Å; V64-I83 HydrophobicContact CG1-CG2 3.86Å; V64-Y86 HydrophobicContact CG1-CD1 4.14Å; V64-Y86 HydrophobicContact CG2-CD1 3.83Å; V64-Y86 HydrophobicContact CG2-CE1 3.8Å; V64-R87 HydrophobicContact CG1-CB 3.8Å; V64-R87 HydrophobicContact CG1-CG 4.18Å; V64-I90 HydrophobicContact CB-CD1 4.19Å; V64-I90 HydrophobicContact CG2-CD1 3.67Å
65S97.3Very high97Very high18 Ų1859.7 Ų59.713%0.12634%0.335CS..Hα-helixtrans-62.5-39.9176.3-56.50000112.1W61 R62 I63 E68 Q69 R87W61-S65 WeakPolarHBondContact O-CB 3.36Å; W61-S65 PolarHBondContact O-N 3.47Å; W61-S65 PolarHBondContact O-OG 3.49Å; R62-S65 PolarHBondContact O-N 2.87Å; I63-S65 PolarHBondContact O-N 3.04Å; S65-E68 WeakPolarHBondContact O-CB 3.28Å; S65-E68 PolarHBondContact O-N 3.48Å; S65-Q69 WeakPolarHBondContact O-CG 3.37Å; S65-Q69 PolarHBondContact O-N 2.85Å; S65-Q69 VanDerWaalsContact O-N 3.14Å; S65-R87 WeakPolarHBondContact OG-CD 3.4Å
66S97.2Very high97Very high45 Ų4561.1 Ų61.132%0.31534%0.335SS..Hα-helixtrans-67.3-36.9174.8-176.90000112.6R62 I63 V64 K70R62-S66 WeakPolarHBondContact O-CB 3.27Å; R62-S66 PolarHBondContact O-N 3.32Å; I63-S66 PolarHBondContact O-N 3.46Å; V64-S66 VanDerWaalsContact C-N 3.35Å; V64-S66 PolarHBondContact O-N 3.29Å; S66-K70 WeakPolarHBondContact O-CG 3.39Å; S66-K70 PolarHBondContact O-N 3.37Å
67I97.6Very high97Very high74 Ų7467.1 Ų67.138%0.37936%0.356SS..Hα-helixtrans-66.1-41.9174.4-67165.9000110.1I63 V64 Q69 K70 E71 I83I63-I67 HydrophobicContact CG2-CD1 3.78Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.21Å; I63-I67 PolarHBondContact O-N 3.48Å; V64-I67 PolarHBondContact O-N 3.25Å; I67-Q69 PolarHBondContact O-N 2.89Å; I67-K70 PolarHBondContact O-N 3.41Å; I67-E71 HydrophobicContact CG2-CG 4.24Å; I67-E71 WeakPolarHBondContact O-CG 3.1Å; I67-E71 PolarHBondContact O-N 3.2Å; I67-I83 HydrophobicContact CG2-CD1 3.88Å
68E97.4Very high96.9Very high10 Ų1066.8 Ų66.85%0.04737%0.367CS..Hα-helixtrans-54.6-52.7175.7-168.2-175.6159.100111.5V64 S65 K70 E71 E72 V80 I83 R84 R87V64-E68 PolarHBondContact O-N 2.9Å; S65-E68 WeakPolarHBondContact O-CB 3.28Å; S65-E68 PolarHBondContact O-N 3.48Å; E68-K70 VanDerWaalsContact C-N 3.29Å; E68-K70 PolarHBondContact O-N 3.3Å; E68-E71 PolarHBondContact O-N 3.37Å; E68-E72 WeakPolarHBondContact O-CB 3.11Å; E68-E72 PolarHBondContact O-N 3.35Å; E68-V80 HydrophobicContact CG-CG1 4.38Å; E68-I83 HydrophobicContact CB-CG2 3.56Å; E68-I83 HydrophobicContact CG-CG2 3.99Å; E68-R84 HydrophobicContact CG-CG 4.34Å; E68-R84 WeakPolarHBondContact OE1-CG 3.45Å; E68-R84 IonicContact OE1-CZ 3.75Å; E68-R84 IonicContact OE1-NE 2.88Å; E68-R84 PolarHBondContact OE1-NE 2.92Å; E68-R84 IonicContact OE1-NH2 3.72Å; E68-R87 VanDerWaalsContact CD-NH1 3.29Å; E68-R87 IonicContact OE1-NH1 3.24Å; E68-R87 PolarHBondContact OE1-NH1 3.02Å; E68-R87 WeakPolarHBondContact OE2-CD 3.25Å; E68-R87 IonicContact OE2-CZ 3.3Å; E68-R87 IonicContact OE2-NE 3.62Å; E68-R87 IonicContact OE2-NH1 2.73Å; E68-R87 PolarHBondContact OE2-NH1 3.48Å
69Q96.2Very high96.9Very high91 Ų9169.3 Ų69.343%0.42538%0.38SS..Hα-helixtrans-56.8-42.7178.8-70.8173.6-9.400111.9S65 I67 E72 A73S65-Q69 WeakPolarHBondContact O-CG 3.37Å; S65-Q69 PolarHBondContact O-N 2.85Å; S65-Q69 VanDerWaalsContact O-N 3.14Å; I67-Q69 PolarHBondContact O-N 2.89Å; Q69-E72 PolarHBondContact O-N 3.18Å; Q69-A73 WeakPolarHBondContact O-CB 3.37Å; Q69-A73 PolarHBondContact O-N 3.05Å
70K97Very high96.9Very high123 Ų12367.6 Ų67.654%0.53536%0.364SS..Hα-helixtrans-67.3-36.8179-72.6171-175169.50113S66 I67 E68 K74S66-K70 WeakPolarHBondContact O-CG 3.39Å; S66-K70 PolarHBondContact O-N 3.37Å; I67-K70 PolarHBondContact O-N 3.41Å; E68-K70 VanDerWaalsContact C-N 3.29Å; E68-K70 PolarHBondContact O-N 3.3Å; K70-K74 WeakPolarHBondContact O-CG 3.26Å; K70-K74 PolarHBondContact O-N 3.18Å
71E97.4Very high96.9Very high31 Ų3168.3 Ų68.315%0.14537%0.373CS..Hα-helixtrans-77.4-33.3178-67-55.4125.300111.8I67 E68 K74 G75 N76 V80 I83I67-E71 HydrophobicContact CG2-CG 4.24Å; I67-E71 WeakPolarHBondContact O-CG 3.1Å; I67-E71 PolarHBondContact O-N 3.2Å; E68-E71 PolarHBondContact O-N 3.37Å; E71-K74 PolarHBondContact O-N 3.11Å; E71-K74 IonicContact OE1-NZ 2.71Å; E71-K74 PolarHBondContact OE1-NZ 3.01Å; E71-G75 PolarHBondContact O-N 2.65Å; E71-N76 HydrophobicContact CB-CB 4.43Å; E71-N76 PolarHBondContact O-N 3.15Å; E71-N76 VanDerWaalsContact O-N 3.11Å; E71-N76 PolarHBondContact OE2-ND2 3.49Å; E71-V80 HydrophobicContact CB-CG2 3.95Å; E71-I83 HydrophobicContact CB-CD1 3.92Å; E71-I83 HydrophobicContact CG-CD1 3.69Å
72E96.1Very high96.9Very high103 Ų10372.3 Ų72.348%0.48140%0.396SS..Hα-helixtrans-63.4-43.5172-172.4161.2-137.400111.2E68 Q69 K74 G75 V80 R84E68-E72 WeakPolarHBondContact O-CB 3.11Å; E68-E72 PolarHBondContact O-N 3.35Å; Q69-E72 PolarHBondContact O-N 3.18Å; E72-K74 PolarHBondContact O-N 2.8Å; E72-G75 PolarHBondContact O-N 3.27Å; E72-V80 HydrophobicContact CB-CG2 4.01Å; E72-R84 IonicContact OE1-CZ 3.92Å; E72-R84 IonicContact OE1-NH2 2.76Å; E72-R84 PolarHBondContact OE1-NH2 3.3Å; E72-R84 IonicContact OE2-NH2 3.58Å
73A96.5Very high97Very high92 Ų9270.7 Ų70.776%0.7639%0.392SS*.Hα-helixtrans-62.1-23174.700000114Q69Q69-A73 WeakPolarHBondContact O-CB 3.37Å; Q69-A73 PolarHBondContact O-N 3.05Å
74K96.4Very high97Very high131 Ų13170.4 Ų70.457%0.5738%0.384SS*.THydrogen-bonded Turntrans-87.3-8.4175.1-67.4170.3-167.6169.30113.4K70 E71 E72 N76K70-K74 WeakPolarHBondContact O-CG 3.26Å; K70-K74 PolarHBondContact O-N 3.18Å; E71-K74 PolarHBondContact O-N 3.11Å; E71-K74 IonicContact OE1-NZ 2.71Å; E71-K74 PolarHBondContact OE1-NZ 3.01Å; E72-K74 PolarHBondContact O-N 2.8Å; K74-N76 VanDerWaalsContact C-N 3.32Å
75G95Very high97Very high54 Ų5475.3 Ų75.356%0.55741%0.41SS*.THydrogen-bonded Turntrans7321.7-173.500000113.9E71 E72 E77E71-G75 PolarHBondContact O-N 2.65Å; E72-G75 PolarHBondContact O-N 3.27Å; G75-E77 PolarHBondContact O-N 3.37Å
76N95.1Very high97.1Very high59 Ų5980.8 Ų80.832%0.31643%0.428SS..  trans-81.764-177.6-73.8-17.6000111.4E71 K74 S78 Q79 V80E71-N76 HydrophobicContact CB-CB 4.43Å; E71-N76 PolarHBondContact O-N 3.15Å; E71-N76 VanDerWaalsContact O-N 3.11Å; E71-N76 PolarHBondContact OE2-ND2 3.49Å; K74-N76 VanDerWaalsContact C-N 3.32Å; N76-S78 VanDerWaalsContact C-N 3.27Å; N76-S78 PolarHBondContact O-N 3.33Å; N76-S78 VanDerWaalsContact O-N 3.13Å; N76-Q79 HydrophobicContact CB-CB 4.14Å; N76-Q79 HydrophobicContact CB-CG 4.44Å; N76-Q79 PolarHBondContact O-N 3.12Å; N76-Q79 PolarHBondContact O-OE1 3.46Å; N76-V80 WeakPolarHBondContact O-CG2 3.5Å; N76-V80 PolarHBondContact O-N 2.89Å
77E95.7Very high97.1Very high166 Ų16682 Ų8278%0.77643%0.426SS*.Hα-helixtrans-52.1-40.8-170.3-65.8-176.8176.300113.8G75 Q79 V80 A81G75-E77 PolarHBondContact O-N 3.37Å; E77-Q79 PolarHBondContact O-N 3.15Å; E77-V80 PolarHBondContact O-N 2.88Å; E77-A81 PolarHBondContact O-N 3.32Å
78S96.3Very high97.1Very high75 Ų7580.7 Ų80.752%0.52443%0.427SS..Hα-helixtrans-67.6-36.1-179.770.90000112.9N76 L82N76-S78 VanDerWaalsContact C-N 3.27Å; N76-S78 PolarHBondContact O-N 3.33Å; N76-S78 VanDerWaalsContact O-N 3.13Å; S78-L82 WeakPolarHBondContact O-CG 3.3Å; S78-L82 PolarHBondContact O-N 3.23Å
79Q97.5Very high97.2Very high82 Ų8286 Ų8638%0.38345%0.45SS..Hα-helixtrans-73.3-42176.4-71.367.426.500109.9N76 E77 A81 L82 I83N76-Q79 HydrophobicContact CB-CB 4.14Å; N76-Q79 HydrophobicContact CB-CG 4.44Å; N76-Q79 PolarHBondContact O-N 3.12Å; N76-Q79 PolarHBondContact O-OE1 3.46Å; E77-Q79 PolarHBondContact O-N 3.15Å; Q79-A81 VanDerWaalsContact C-N 3.29Å; Q79-A81 PolarHBondContact O-N 3.35Å; Q79-L82 PolarHBondContact O-N 2.6Å; Q79-I83 HydrophobicContact CB-CD1 4.44Å; Q79-I83 WeakPolarHBondContact O-CD1 3.31Å; Q79-I83 WeakPolarHBondContact O-CG1 3.38Å; Q79-I83 PolarHBondContact O-N 3.06Å
80V98.2Very high97.3Very high8 Ų882 Ų825%0.04843%0.431CS..Hα-helixtrans-57.6-42.9176.7173.30000111.1E68 E71 E72 N76 E77 I83 R84E68-V80 HydrophobicContact CG-CG1 4.38Å; E71-V80 HydrophobicContact CB-CG2 3.95Å; E72-V80 HydrophobicContact CB-CG2 4.01Å; N76-V80 WeakPolarHBondContact O-CG2 3.5Å; N76-V80 PolarHBondContact O-N 2.89Å; E77-V80 PolarHBondContact O-N 2.88Å; V80-I83 PolarHBondContact O-N 3.01Å; V80-R84 HydrophobicContact CG1-CG 4.44Å; V80-R84 VanDerWaalsContact CG1-CZ 3.47Å; V80-R84 WeakPolarHBondContact O-CB 3.39Å; V80-R84 WeakPolarHBondContact O-CG 3.42Å; V80-R84 PolarHBondContact O-N 3.03Å
81A97.8Very high97.3Very high51 Ų5177.7 Ų77.742%0.42141%0.413SS..Hα-helixtrans-59.3-47.8175.700000112.4E77 Q79 I83 R84 D85E77-A81 PolarHBondContact O-N 3.32Å; Q79-A81 VanDerWaalsContact C-N 3.29Å; Q79-A81 PolarHBondContact O-N 3.35Å; A81-I83 VanDerWaalsContact C-N 3.32Å; A81-I83 PolarHBondContact O-N 3.35Å; A81-R84 PolarHBondContact O-N 2.8Å; A81-D85 PolarHBondContact O-N 2.85Å; A81-D85 VanDerWaalsContact O-N 3.12Å
82L98.1Very high97.4Very high122 Ų12279 Ų7964%0.63943%0.429SS*.Hα-helixtrans-62.3-38.8176.7-67.1173.3000112.5S78 Q79 Y86S78-L82 WeakPolarHBondContact O-CG 3.3Å; S78-L82 PolarHBondContact O-N 3.23Å; Q79-L82 PolarHBondContact O-N 2.6Å; L82-Y86 PolarHBondContact O-N 3.43Å; L82-Y86 VanDerWaalsContact O-N 3.1Å
83I98.4Very high97.5Very high26 Ų2677.6 Ų77.613%0.13342%0.423CS..Hα-helixtrans-67.2-41.4178.5-66.9159.5000110.5V64 I67 E68 E71 Q79 V80 A81 Y86 R87V64-I83 HydrophobicContact CG1-CG2 3.86Å; I67-I83 HydrophobicContact CG2-CD1 3.88Å; E68-I83 HydrophobicContact CB-CG2 3.56Å; E68-I83 HydrophobicContact CG-CG2 3.99Å; E71-I83 HydrophobicContact CB-CD1 3.92Å; E71-I83 HydrophobicContact CG-CD1 3.69Å; Q79-I83 HydrophobicContact CB-CD1 4.44Å; Q79-I83 WeakPolarHBondContact O-CD1 3.31Å; Q79-I83 WeakPolarHBondContact O-CG1 3.38Å; Q79-I83 PolarHBondContact O-N 3.06Å; V80-I83 PolarHBondContact O-N 3.01Å; A81-I83 VanDerWaalsContact C-N 3.32Å; A81-I83 PolarHBondContact O-N 3.35Å; I83-Y86 PolarHBondContact O-N 3.41Å; I83-R87 WeakPolarHBondContact O-CB 3.32Å; I83-R87 PolarHBondContact O-N 2.97Å
84R98Very high97.6Very high102 Ų10273.3 Ų73.339%0.38539%0.387SS..Hα-helixtrans-61.1-45.1176.7-78.4175176.9158.84.6112.1E68 E72 V80 A81 Y86 R87 A88E68-R84 HydrophobicContact CG-CG 4.34Å; E68-R84 WeakPolarHBondContact OE1-CG 3.45Å; E68-R84 IonicContact OE1-CZ 3.75Å; E68-R84 IonicContact OE1-NE 2.88Å; E68-R84 PolarHBondContact OE1-NE 2.92Å; E68-R84 IonicContact OE1-NH2 3.72Å; E72-R84 IonicContact OE1-CZ 3.92Å; E72-R84 IonicContact OE1-NH2 2.76Å; E72-R84 PolarHBondContact OE1-NH2 3.3Å; E72-R84 IonicContact OE2-NH2 3.58Å; V80-R84 HydrophobicContact CG1-CG 4.44Å; V80-R84 VanDerWaalsContact CG1-CZ 3.47Å; V80-R84 WeakPolarHBondContact O-CB 3.39Å; V80-R84 WeakPolarHBondContact O-CG 3.42Å; V80-R84 PolarHBondContact O-N 3.03Å; A81-R84 PolarHBondContact O-N 2.8Å; R84-Y86 VanDerWaalsContact C-N 3.31Å; R84-Y86 PolarHBondContact O-N 3.4Å; R84-R87 PolarHBondContact O-N 3.5Å; R84-A88 WeakPolarHBondContact O-CB 3.5Å; R84-A88 PolarHBondContact O-N 3.31Å
85D98.1Very high97.7Very high119 Ų11968.3 Ų68.364%0.63637%0.369SS*.Hα-helixtrans-61.8-41.4176.4-71.2-16.8000111.3A81 A88 K89A81-D85 PolarHBondContact O-N 2.85Å; A81-D85 VanDerWaalsContact O-N 3.12Å; D85-A88 PolarHBondContact O-N 3.04Å; D85-K89 PolarHBondContact O-N 3.49Å
86Y98.4Very high97.8Very high133 Ų13373.1 Ų73.152%0.52237%0.374SS..Hα-helixtrans-68.4-40.3176.6-170.5-116.6000112.5V64 L82 I83 R84 K89 I90V64-Y86 HydrophobicContact CG1-CD1 4.14Å; V64-Y86 HydrophobicContact CG2-CD1 3.83Å; V64-Y86 HydrophobicContact CG2-CE1 3.8Å; L82-Y86 PolarHBondContact O-N 3.43Å; L82-Y86 VanDerWaalsContact O-N 3.1Å; I83-Y86 PolarHBondContact O-N 3.41Å; R84-Y86 VanDerWaalsContact C-N 3.31Å; R84-Y86 PolarHBondContact O-N 3.4Å; Y86-K89 WeakPolarHBondContact O-CB 3.39Å; Y86-K89 PolarHBondContact O-N 2.98Å; Y86-I90 HydrophobicContact CD1-CD1 4.1Å; Y86-I90 HydrophobicContact CE1-CD1 3.81Å; Y86-I90 PolarHBondContact O-N 3.41Å
87R98.1Very high98Very high69 Ų6971.3 Ų71.326%0.2636%0.364SS..Hα-helixtrans-60.3-45.7174.7-166-171.175-165.4-0.5110.9V64 S65 E68 I83 R84 K89 I90 E91V64-R87 HydrophobicContact CG1-CB 3.8Å; V64-R87 HydrophobicContact CG1-CG 4.18Å; S65-R87 WeakPolarHBondContact OG-CD 3.4Å; E68-R87 VanDerWaalsContact CD-NH1 3.29Å; E68-R87 IonicContact OE1-NH1 3.24Å; E68-R87 PolarHBondContact OE1-NH1 3.02Å; E68-R87 WeakPolarHBondContact OE2-CD 3.25Å; E68-R87 IonicContact OE2-CZ 3.3Å; E68-R87 IonicContact OE2-NE 3.62Å; E68-R87 IonicContact OE2-NH1 2.73Å; E68-R87 PolarHBondContact OE2-NH1 3.48Å; I83-R87 WeakPolarHBondContact O-CB 3.32Å; I83-R87 PolarHBondContact O-N 2.97Å; R84-R87 PolarHBondContact O-N 3.5Å; R87-K89 VanDerWaalsContact C-N 3.25Å; R87-K89 PolarHBondContact O-N 3.32Å; R87-I90 WeakPolarHBondContact O-CB 3.1Å; R87-I90 PolarHBondContact O-N 3.01Å; R87-E91 WeakPolarHBondContact CD-OE1 2.87Å; R87-E91 WeakPolarHBondContact CG-OE1 3.43Å; R87-E91 IonicContact CZ-OE1 3.85Å; R87-E91 IonicContact NE-OE1 2.81Å; R87-E91 PolarHBondContact NE-OE1 3.21Å; R87-E91 IonicContact NH2-OE1 3.14Å; R87-E91 WeakPolarHBondContact O-CG 3.43Å; R87-E91 PolarHBondContact O-N 3.33Å
88A98Very high98.1Very high48 Ų4863.4 Ų63.440%0.39733%0.327SS..Hα-helixtrans-60-3517800000112.4R84 D85 E91 A92R84-A88 WeakPolarHBondContact O-CB 3.5Å; R84-A88 PolarHBondContact O-N 3.31Å; D85-A88 PolarHBondContact O-N 3.04Å; A88-E91 PolarHBondContact O-N 3.38Å; A88-A92 PolarHBondContact O-N 2.89Å
89K98.4Very high98.2Very high122 Ų12265.5 Ų65.553%0.5333%0.329SS..Hα-helixtrans-62.6-45.6172.2-174-175.2174.6-174.20111.7D85 Y86 R87 E91 A92 E93D85-K89 PolarHBondContact O-N 3.49Å; Y86-K89 WeakPolarHBondContact O-CB 3.39Å; Y86-K89 PolarHBondContact O-N 2.98Å; R87-K89 VanDerWaalsContact C-N 3.25Å; R87-K89 PolarHBondContact O-N 3.32Å; K89-E91 VanDerWaalsContact C-N 3.34Å; K89-A92 PolarHBondContact O-N 2.87Å; K89-E93 VanDerWaalsContact CE-OE1 3.31Å; K89-E93 WeakPolarHBondContact CE-OE1 3.11Å; K89-E93 WeakPolarHBondContact O-CG 3.4Å; K89-E93 PolarHBondContact O-N 3.07Å
90I98.5Very high98.3Very high5 Ų563.7 Ų63.73%0.02632%0.321CS..Hα-helixtrans-65.3-39.4178-60168.3000110.7W61 V64 Y86 R87 A92 E93 L94W61-I90 HydrophobicContact CB-CG2 3.71Å; V64-I90 HydrophobicContact CB-CD1 4.19Å; V64-I90 HydrophobicContact CG2-CD1 3.67Å; Y86-I90 HydrophobicContact CD1-CD1 4.1Å; Y86-I90 HydrophobicContact CE1-CD1 3.81Å; Y86-I90 PolarHBondContact O-N 3.41Å; R87-I90 WeakPolarHBondContact O-CB 3.1Å; R87-I90 PolarHBondContact O-N 3.01Å; I90-A92 VanDerWaalsContact C-N 3.31Å; I90-A92 PolarHBondContact O-N 2.95Å; I90-E93 PolarHBondContact O-N 3.34Å; I90-L94 HydrophobicContact CG2-CD1 4.23Å; I90-L94 HydrophobicContact CG2-CG 4.41Å; I90-L94 WeakPolarHBondContact O-CB 3.09Å; I90-L94 WeakPolarHBondContact O-CG 3.43Å; I90-L94 PolarHBondContact O-N 3.09Å
91E98.4Very high98.3Very high33 Ų3363.3 Ų63.315%0.15432%0.319CS..Hα-helixtrans-61.7-38175.4-70.7168.5-177.600111.9W61 R87 A88 K89 L94 S95 F136W61-E91 PolarHBondContact NE1-OE1 2.94Å; W61-E91 VanDerWaalsContact NE1-OE1 3.13Å; R87-E91 WeakPolarHBondContact CD-OE1 2.87Å; R87-E91 WeakPolarHBondContact CG-OE1 3.43Å; R87-E91 IonicContact CZ-OE1 3.85Å; R87-E91 IonicContact NE-OE1 2.81Å; R87-E91 PolarHBondContact NE-OE1 3.21Å; R87-E91 IonicContact NH2-OE1 3.14Å; R87-E91 WeakPolarHBondContact O-CG 3.43Å; R87-E91 PolarHBondContact O-N 3.33Å; A88-E91 PolarHBondContact O-N 3.38Å; K89-E91 VanDerWaalsContact C-N 3.34Å; E91-L94 PolarHBondContact O-N 3.17Å; E91-S95 WeakPolarHBondContact O-CB 3.18Å; E91-S95 PolarHBondContact O-N 2.92Å; E91-S95 PolarHBondContact O-OG 3.2Å; E91-F136 HydrophobicContact CB-CD2 3.81Å; E91-F136 HydrophobicContact CB-CE2 4.09Å; E91-F136 HydrophobicContact CG-CB 4.07Å; E91-F136 HydrophobicContact CG-CD2 3.76Å; E91-F136 HydrophobicContact CG-CG 4.08Å
92A98.3Very high98.3Very high60 Ų6061.6 Ų61.650%0.49630%0.303SS..Hα-helixtrans-67.1-40.5174.400000112.1A88 K89 I90 S95 K96A88-A92 PolarHBondContact O-N 2.89Å; K89-A92 PolarHBondContact O-N 2.87Å; I90-A92 VanDerWaalsContact C-N 3.31Å; I90-A92 PolarHBondContact O-N 2.95Å; A92-S95 PolarHBondContact O-N 3.38Å; A92-K96 WeakPolarHBondContact O-CB 3.38Å; A92-K96 PolarHBondContact O-N 3.08Å
93E98.4Very high98.3Very high73 Ų7358.1 Ų58.134%0.34129%0.289SS..Hα-helixtrans-63.2-45.5173.6-69169.3-17000111.3K89 I90 K96 I97K89-E93 VanDerWaalsContact CE-OE1 3.31Å; K89-E93 WeakPolarHBondContact CE-OE1 3.11Å; K89-E93 WeakPolarHBondContact O-CG 3.4Å; K89-E93 PolarHBondContact O-N 3.07Å; I90-E93 PolarHBondContact O-N 3.34Å; E93-K96 PolarHBondContact O-N 3.46Å; E93-I97 WeakPolarHBondContact O-CD1 3.08Å; E93-I97 VanDerWaalsContact O-CG1 3.31Å; E93-I97 WeakPolarHBondContact O-CG1 3.42Å; E93-I97 PolarHBondContact O-N 2.92Å
94L98.2Very high98.3Very high1 Ų157.1 Ų57.11%0.00528%0.284CS..Hα-helixtrans-59.2-47.1174.7-79.7172.5000112.3I54 R57 R58 W61 I90 E91 K96 I97 C98 F136I54-L94 HydrophobicContact CD1-CD2 3.54Å; I54-L94 HydrophobicContact CG1-CD2 4.21Å; R57-L94 HydrophobicContact CB-CD2 3.47Å; R57-L94 VanDerWaalsContact CB-CD2 3.47Å; R57-L94 HydrophobicContact CB-CG 3.96Å; R58-L94 HydrophobicContact CB-CD2 4.41Å; R58-L94 HydrophobicContact CG-CD2 3.54Å; W61-L94 HydrophobicContact CB-CD1 3.71Å; W61-L94 HydrophobicContact CG-CD1 3.91Å; I90-L94 HydrophobicContact CG2-CD1 4.23Å; I90-L94 HydrophobicContact CG2-CG 4.41Å; I90-L94 WeakPolarHBondContact O-CB 3.09Å; I90-L94 WeakPolarHBondContact O-CG 3.43Å; I90-L94 PolarHBondContact O-N 3.09Å; E91-L94 PolarHBondContact O-N 3.17Å; L94-K96 VanDerWaalsContact C-N 3.31Å; L94-K96 PolarHBondContact O-N 3.42Å; L94-I97 PolarHBondContact O-N 3.34Å; L94-C98 PolarHBondContact O-N 2.72Å; L94-C98 PolarHBondContact O-SG 3.34Å; L94-F136 HydrophobicContact CB-CE1 3.77Å; L94-F136 HydrophobicContact CB-CZ 3.84Å; L94-F136 HydrophobicContact CD1-CD1 4.1Å; L94-F136 HydrophobicContact CD1-CE1 4.09Å
95S98.3Very high98.3Very high27 Ų2752.2 Ų52.219%0.18927%0.265CS..Hα-helixtrans-57.8-47.5177.6-58.10000110.4E91 A92 I97 C98 E99 F136E91-S95 WeakPolarHBondContact O-CB 3.18Å; E91-S95 PolarHBondContact O-N 2.92Å; E91-S95 PolarHBondContact O-OG 3.2Å; A92-S95 PolarHBondContact O-N 3.38Å; S95-I97 PolarHBondContact O-N 2.9Å; S95-C98 PolarHBondContact O-N 3.46Å; S95-E99 WeakPolarHBondContact O-CB 3.46Å; S95-E99 VanDerWaalsContact O-CG 3.28Å; S95-E99 WeakPolarHBondContact O-CG 3.47Å; S95-E99 PolarHBondContact O-N 2.96Å; S95-F136 VanDerWaalsContact OG-CE2 3.24Å; S95-F136 WeakPolarHBondContact OG-CE2 3.42Å; S95-F136 WeakPolarHBondContact OG-CZ 3.31Å
96K98.4Very high98.2Very high155 Ų15548.7 Ų48.767%0.67425%0.25SC*.Hα-helixtrans-59.1-44.7178.2-174.2-177.5177.7-171.20112.1A92 E93 L94 C98 D100A92-K96 WeakPolarHBondContact O-CB 3.38Å; A92-K96 PolarHBondContact O-N 3.08Å; E93-K96 PolarHBondContact O-N 3.46Å; L94-K96 VanDerWaalsContact C-N 3.31Å; L94-K96 PolarHBondContact O-N 3.42Å; K96-C98 VanDerWaalsContact C-N 3.35Å; K96-D100 VanDerWaalsContact O-CB 3.23Å; K96-D100 WeakPolarHBondContact O-CB 3.18Å; K96-D100 PolarHBondContact O-N 2.93Å
97I98.4Very high98.1Very high20 Ų2047.3 Ų47.310%0.10325%0.252CS..Hα-helixtrans-63.8-42.7178.2-63155.6000110.6Y50 V53 I54 R57 E93 L94 S95 D100 I101Y50-I97 HydrophobicContact CD1-CG2 4.2Å; V53-I97 HydrophobicContact CG1-CD1 3.66Å; V53-I97 HydrophobicContact CG1-CG1 3.88Å; V53-I97 HydrophobicContact CG1-CG2 4.1Å; I54-I97 HydrophobicContact CB-CG2 4.05Å; I54-I97 HydrophobicContact CD1-CB 3.76Å; I54-I97 HydrophobicContact CD1-CD1 4.29Å; I54-I97 HydrophobicContact CD1-CG2 3.56Å; I54-I97 HydrophobicContact CG1-CG2 4.36Å; R57-I97 HydrophobicContact CB-CD1 4.19Å; R57-I97 HydrophobicContact CG-CD1 3.52Å; E93-I97 WeakPolarHBondContact O-CD1 3.08Å; E93-I97 VanDerWaalsContact O-CG1 3.31Å; E93-I97 WeakPolarHBondContact O-CG1 3.42Å; E93-I97 PolarHBondContact O-N 2.92Å; L94-I97 PolarHBondContact O-N 3.34Å; S95-I97 PolarHBondContact O-N 2.9Å; I97-D100 PolarHBondContact O-N 3.34Å; I97-I101 WeakPolarHBondContact O-CG2 3.46Å; I97-I101 PolarHBondContact O-N 3.47Å
98C98.5Very high98.1Very high0 Ų046.8 Ų46.80%025%0.252CS..Hα-helixtrans-65.9-49.7179-63.50000111.7L94 S95 K96 D100 I101 L102 Y129 L133L94-C98 PolarHBondContact O-N 2.72Å; L94-C98 PolarHBondContact O-SG 3.34Å; S95-C98 PolarHBondContact O-N 3.46Å; K96-C98 VanDerWaalsContact C-N 3.35Å; C98-D100 PolarHBondContact O-N 2.87Å; C98-I101 VanDerWaalsContact O-CG2 3.25Å; C98-I101 WeakPolarHBondContact O-CG2 3.42Å; C98-I101 PolarHBondContact O-N 2.82Å; C98-L102 HydrophobicContact CB-CD1 4.46Å; C98-L102 VanDerWaalsContact O-CB 3.25Å; C98-L102 WeakPolarHBondContact O-CB 3.38Å; C98-L102 WeakPolarHBondContact O-CD1 3.39Å; C98-L102 WeakPolarHBondContact O-CG 3.25Å; C98-L102 PolarHBondContact O-N 3.34Å; C98-Y129 HydrophobicContact CB-CD1 4.2Å; C98-L133 HydrophobicContact CB-CD1 4.06Å; C98-L133 HydrophobicContact CB-CD2 3.62Å; C98-L133 HydrophobicContact CB-CG 3.67Å
99E98.4Very high98.1Very high120 Ų12044.5 Ų44.556%0.56123%0.233SC*.Hα-helixtrans-58-38.2177.4-72.6168.3-171.600111.4S95 L102 S103S95-E99 WeakPolarHBondContact O-CB 3.46Å; S95-E99 VanDerWaalsContact O-CG 3.28Å; S95-E99 WeakPolarHBondContact O-CG 3.47Å; S95-E99 PolarHBondContact O-N 2.96Å; E99-L102 PolarHBondContact O-N 3.41Å; E99-S103 WeakPolarHBondContact O-CB 3.08Å; E99-S103 PolarHBondContact O-N 2.83Å
100D98.3Very high98Very high43 Ų4340.1 Ų40.123%0.2322%0.215CC..Hα-helixtrans-62.1-54.8179.2-167.247.7000112.1K29 Y50 K96 I97 C98 L102 S103 V104K29-D100 WeakPolarHBondContact CE-OD1 3.05Å; K29-D100 WeakPolarHBondContact CE-OD2 3.39Å; K29-D100 IonicContact NZ-OD1 3.61Å; K29-D100 PolarHBondContact NZ-OD1 3.34Å; K29-D100 IonicContact NZ-OD2 2.72Å; K29-D100 PolarHBondContact NZ-OD2 2.89Å; Y50-D100 HydrophobicContact CE1-CB 4.43Å; Y50-D100 PolarHBondContact OH-OD2 2.94Å; K96-D100 VanDerWaalsContact O-CB 3.23Å; K96-D100 WeakPolarHBondContact O-CB 3.18Å; K96-D100 PolarHBondContact O-N 2.93Å; I97-D100 PolarHBondContact O-N 3.34Å; C98-D100 PolarHBondContact O-N 2.87Å; D100-L102 VanDerWaalsContact C-N 3.35Å; D100-L102 PolarHBondContact O-N 2.65Å; D100-S103 PolarHBondContact O-N 3.34Å; D100-S103 PolarHBondContact O-OG 3.4Å; D100-V104 WeakPolarHBondContact O-CG2 3.18Å; D100-V104 PolarHBondContact O-N 2.89Å; D100-V104 VanDerWaalsContact O-N 3.17Å
101I98.2Very high97.8Very high0 Ų044.8 Ų44.80%024%0.244CC..Hα-helixtrans-67.6-35.2177.8-177.857.8000112.4L46 Y50 I97 C98 S103 V104 L105 M125 Y129L46-I101 HydrophobicContact CD2-CD1 4.47Å; Y50-I101 HydrophobicContact CD1-CB 3.8Å; Y50-I101 HydrophobicContact CD1-CG1 4.43Å; Y50-I101 HydrophobicContact CD1-CG2 4.37Å; Y50-I101 HydrophobicContact CD2-CB 4.41Å; Y50-I101 HydrophobicContact CD2-CD1 3.76Å; Y50-I101 HydrophobicContact CD2-CG1 4.32Å; Y50-I101 HydrophobicContact CE1-CB 3.65Å; Y50-I101 HydrophobicContact CE1-CG2 4.46Å; Y50-I101 HydrophobicContact CE2-CB 4.27Å; Y50-I101 HydrophobicContact CE2-CD1 3.7Å; Y50-I101 HydrophobicContact CE2-CG1 4.41Å; Y50-I101 HydrophobicContact CG-CB 4.17Å; Y50-I101 HydrophobicContact CG-CD1 4.24Å; Y50-I101 HydrophobicContact CG-CG1 4.3Å; I97-I101 WeakPolarHBondContact O-CG2 3.46Å; I97-I101 PolarHBondContact O-N 3.47Å; C98-I101 VanDerWaalsContact O-CG2 3.25Å; C98-I101 WeakPolarHBondContact O-CG2 3.42Å; C98-I101 PolarHBondContact O-N 2.82Å; I101-S103 VanDerWaalsContact C-N 3.25Å; I101-S103 PolarHBondContact O-N 3.05Å; I101-V104 HydrophobicContact CD1-CB 4.41Å; I101-V104 PolarHBondContact O-N 3.4Å; I101-L105 HydrophobicContact CD1-CD1 4.32Å; I101-L105 HydrophobicContact CD1-CG 4Å; I101-L105 HydrophobicContact CG1-CD1 3.86Å; I101-L105 HydrophobicContact CG1-CG 4.07Å; I101-L105 WeakPolarHBondContact O-CB 3.38Å; I101-L105 VanDerWaalsContact O-CG 3.24Å; I101-L105 WeakPolarHBondContact O-CG 3.29Å; I101-L105 PolarHBondContact O-N 3.12Å; I101-M125 HydrophobicContact CD1-CE 3.79Å; I101-M125 HydrophobicContact CD1-SD 4.17Å; I101-M125 HydrophobicContact CG1-CE 3.79Å; I101-M125 HydrophobicContact CG1-SD 4.28Å; I101-Y129 HydrophobicContact CG1-CD2 4.33Å; I101-Y129 HydrophobicContact CG1-CE2 4.26Å; I101-Y129 HydrophobicContact CG2-CD1 3.32Å; I101-Y129 HydrophobicContact CG2-CD2 3.71Å; I101-Y129 HydrophobicContact CG2-CE1 3.58Å; I101-Y129 HydrophobicContact CG2-CE2 3.98Å; I101-Y129 HydrophobicContact CG2-CG 3.4Å
102L98.6Very high97.6Very high16 Ų1644.1 Ų44.18%0.08424%0.243CC..Hα-helixtrans-62.7-35.4177.4-72.5170000111.5C98 E99 D100 S106 K126 L133C98-L102 HydrophobicContact CB-CD1 4.46Å; C98-L102 VanDerWaalsContact O-CB 3.25Å; C98-L102 WeakPolarHBondContact O-CB 3.38Å; C98-L102 WeakPolarHBondContact O-CD1 3.39Å; C98-L102 WeakPolarHBondContact O-CG 3.25Å; C98-L102 PolarHBondContact O-N 3.34Å; E99-L102 PolarHBondContact O-N 3.41Å; D100-L102 VanDerWaalsContact C-N 3.35Å; D100-L102 PolarHBondContact O-N 2.65Å; L102-S106 WeakPolarHBondContact O-CB 3.36Å; L102-S106 PolarHBondContact O-N 3.2Å; L102-S106 PolarHBondContact O-OG 3.17Å; L102-K126 HydrophobicContact CD2-CB 4.42Å; L102-K126 HydrophobicContact CD2-CG 3.81Å; L102-L133 HydrophobicContact CD1-CD1 3.74Å
103S98.1Very high97.4Very high48 Ų4841.9 Ų41.934%0.33622%0.224SC..Hα-helixtrans-66.5-49172.875.30000111.4E99 D100 I101 L105 S106 D107E99-S103 WeakPolarHBondContact O-CB 3.08Å; E99-S103 PolarHBondContact O-N 2.83Å; D100-S103 PolarHBondContact O-N 3.34Å; D100-S103 PolarHBondContact O-OG 3.4Å; I101-S103 VanDerWaalsContact C-N 3.25Å; I101-S103 PolarHBondContact O-N 3.05Å; S103-L105 VanDerWaalsContact C-N 3.31Å; S103-L105 PolarHBondContact O-N 2.96Å; S103-S106 PolarHBondContact O-N 3.05Å; S103-D107 VanDerWaalsContact O-CB 3.26Å; S103-D107 WeakPolarHBondContact O-CB 3.47Å; S103-D107 VanDerWaalsContact O-CG 3.26Å; S103-D107 PolarHBondContact O-N 3.22Å
104V97.8Very high97.2Very high5 Ų545.6 Ų45.63%0.0324%0.242CC..Hα-helixtrans-59-42.1177.9175.60000111.7K29 A32 D100 I101 H108 L109K29-V104 HydrophobicContact CG-CG2 4.08Å; A32-V104 HydrophobicContact CB-CG1 3.64Å; D100-V104 WeakPolarHBondContact O-CG2 3.18Å; D100-V104 PolarHBondContact O-N 2.89Å; D100-V104 VanDerWaalsContact O-N 3.17Å; I101-V104 HydrophobicContact CD1-CB 4.41Å; I101-V104 PolarHBondContact O-N 3.4Å; V104-H108 WeakPolarHBondContact O-CB 3.46Å; V104-H108 PolarHBondContact O-N 3.09Å; V104-H108 VanDerWaalsContact O-N 3.14Å; V104-L109 HydrophobicContact CG1-CD1 3.81Å; V104-L109 HydrophobicContact CG1-CG 4.2Å; V104-L109 PolarHBondContact O-N 2.89Å
105L98.1Very high97.1Very high0 Ų048.8 Ų48.80%026%0.262CS..Iπ-helixtrans-62.7-49176.6-73.5168.3000111.5I101 S103 L109 I110 Y122 M125 K126I101-L105 HydrophobicContact CD1-CD1 4.32Å; I101-L105 HydrophobicContact CD1-CG 4Å; I101-L105 HydrophobicContact CG1-CD1 3.86Å; I101-L105 HydrophobicContact CG1-CG 4.07Å; I101-L105 WeakPolarHBondContact O-CB 3.38Å; I101-L105 VanDerWaalsContact O-CG 3.24Å; I101-L105 WeakPolarHBondContact O-CG 3.29Å; I101-L105 PolarHBondContact O-N 3.12Å; S103-L105 VanDerWaalsContact C-N 3.31Å; S103-L105 PolarHBondContact O-N 2.96Å; L105-L109 HydrophobicContact CD2-CB 4.34Å; L105-L109 HydrophobicContact CD2-CD1 4.01Å; L105-L109 PolarHBondContact O-N 3.18Å; L105-I110 HydrophobicContact CB-CD1 4.22Å; L105-I110 VanDerWaalsContact O-CB 3.3Å; L105-I110 WeakPolarHBondContact O-CB 3.46Å; L105-I110 VanDerWaalsContact O-CG1 3.31Å; L105-I110 WeakPolarHBondContact O-CG1 3.42Å; L105-I110 PolarHBondContact O-N 3.31Å; L105-Y122 HydrophobicContact CD2-CD1 3.76Å; L105-Y122 HydrophobicContact CD2-CG 4.11Å; L105-M125 HydrophobicContact CD1-CB 4.14Å; L105-M125 HydrophobicContact CD1-CG 4.07Å; L105-M125 HydrophobicContact CD1-SD 4.44Å; L105-M125 HydrophobicContact CD2-CB 4.36Å; L105-M125 HydrophobicContact CD2-SD 4.13Å; L105-K126 HydrophobicContact CD1-CB 4.09Å
106S97.1Very high97Very high44 Ų4447.8 Ų47.831%0.30826%0.255SS..Iπ-helixtrans-74-39.1-173.7-56.40000112.4L102 S103L102-S106 WeakPolarHBondContact O-CB 3.36Å; L102-S106 PolarHBondContact O-N 3.2Å; L102-S106 PolarHBondContact O-OG 3.17Å; S103-S106 PolarHBondContact O-N 3.05Å
107D96.8Very high96.9Very high105 Ų10543 Ų4356%0.56124%0.235SC*.Iπ-helixtrans-84-28.9-172.9-63.8-16.2000112.4S103 T111S103-D107 VanDerWaalsContact O-CB 3.26Å; S103-D107 WeakPolarHBondContact O-CB 3.47Å; S103-D107 VanDerWaalsContact O-CG 3.26Å; S103-D107 PolarHBondContact O-N 3.22Å; D107-T111 PolarHBondContact O-OG1 3.02Å
108H96.6Very high96.8Very high57 Ų5742.3 Ų42.326%0.26423%0.232SC..Iπ-helixtrans-129.3-49.7-170.3-54.6-51.1000114.8A32 S33 V104 T111 S112A32-H108 WeakPolarHBondContact O-CB 3.39Å; S33-H108 PolarHBondContact OG-CD2 2.95Å; S33-H108 PolarHBondContact OG-NE2 3.22Å; V104-H108 WeakPolarHBondContact O-CB 3.46Å; V104-H108 PolarHBondContact O-N 3.09Å; V104-H108 VanDerWaalsContact O-N 3.14Å; H108-T111 PolarHBondContact O-OG1 3.38Å; H108-T111 VanDerWaalsContact O-OG1 3.05Å; H108-S112 VanDerWaalsContact O-CB 3.25Å; H108-S112 WeakPolarHBondContact O-CB 3.44Å; H108-S112 PolarHBondContact O-N 3.35Å; H108-S112 VanDerWaalsContact O-N 3.17Å; H108-S112 PolarHBondContact O-OG 3.02Å
109L97.4Very high96.8Very high0 Ų045.2 Ų45.20%025%0.245CC..Iπ-helixtrans-84.2-44-165-61174.8000113.1A32 L38 L46 V104 L105 T111 S112 A113 Y122A32-L109 HydrophobicContact CB-CD1 4.32Å; A32-L109 HydrophobicContact CB-CD2 3.81Å; A32-L109 HydrophobicContact CB-CG 4.23Å; L38-L109 HydrophobicContact CD1-CD2 3.62Å; L38-L109 HydrophobicContact CD2-CD2 4.45Å; L38-L109 HydrophobicContact CG-CD2 3.71Å; L46-L109 HydrophobicContact CD2-CD1 3.31Å; V104-L109 HydrophobicContact CG1-CD1 3.81Å; V104-L109 HydrophobicContact CG1-CG 4.2Å; V104-L109 PolarHBondContact O-N 2.89Å; L105-L109 HydrophobicContact CD2-CB 4.34Å; L105-L109 HydrophobicContact CD2-CD1 4.01Å; L105-L109 PolarHBondContact O-N 3.18Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 3.2Å; L109-S112 PolarHBondContact O-N 2.98Å; L109-S112 PolarHBondContact O-OG 3.2Å; L109-A113 WeakPolarHBondContact O-CB 3.41Å; L109-A113 PolarHBondContact O-N 2.88Å; L109-Y122 HydrophobicContact CB-CD1 3.98Å; L109-Y122 HydrophobicContact CB-CD2 3.93Å; L109-Y122 HydrophobicContact CB-CE1 3.96Å; L109-Y122 HydrophobicContact CB-CE2 3.91Å; L109-Y122 HydrophobicContact CB-CG 4Å; L109-Y122 HydrophobicContact CD1-CD1 4.24Å; L109-Y122 HydrophobicContact CD1-CE1 3.98Å; L109-Y122 HydrophobicContact CD2-CE1 4.46Å; L109-Y122 HydrophobicContact CG-CE1 4.36Å; L109-Y122 WeakPolarHBondContact O-CD2 3.44Å; L109-Y122 WeakPolarHBondContact O-CE2 3.4Å
110I96.9Very high96.8Very high30 Ų3039.5 Ų39.515%0.15422%0.218CC..Hα-helixtrans-65.8-37.5176.3-67.8171.5000110.2L105 Y123 K126L105-I110 HydrophobicContact CB-CD1 4.22Å; L105-I110 VanDerWaalsContact O-CB 3.3Å; L105-I110 WeakPolarHBondContact O-CB 3.46Å; L105-I110 VanDerWaalsContact O-CG1 3.31Å; L105-I110 WeakPolarHBondContact O-CG1 3.42Å; L105-I110 PolarHBondContact O-N 3.31Å; I110-Y123 HydrophobicContact CD1-CD1 4.18Å; I110-Y123 HydrophobicContact CD1-CE1 4.13Å; I110-Y123 HydrophobicContact CG2-CE1 4.02Å; I110-Y123 HydrophobicContact CG2-CE2 4.36Å; I110-K126 HydrophobicContact CD1-CD 3.86Å
111T94.6Very high96.8Very high103 Ų10338.4 Ų38.463%0.63221%0.211SC*.Hα-helixtrans-72.2-28.8-179.852.90000113.1D107 H108 L109D107-T111 PolarHBondContact O-OG1 3.02Å; H108-T111 PolarHBondContact O-OG1 3.38Å; H108-T111 VanDerWaalsContact O-OG1 3.05Å; L109-T111 VanDerWaalsContact C-N 3.29Å; L109-T111 PolarHBondContact O-N 3.2Å
112S93.8Very high96.8Very high20 Ų2038.4 Ų38.414%0.1421%0.211CC..Hα-helixtrans-94.2-9.6178.461.20000114.6H108 L109 Q114H108-S112 VanDerWaalsContact O-CB 3.25Å; H108-S112 WeakPolarHBondContact O-CB 3.44Å; H108-S112 PolarHBondContact O-N 3.35Å; H108-S112 VanDerWaalsContact O-N 3.17Å; H108-S112 PolarHBondContact O-OG 3.02Å; L109-S112 PolarHBondContact O-N 2.98Å; L109-S112 PolarHBondContact O-OG 3.2Å; S112-Q114 PolarHBondContact O-N 2.94Å
113A95.2Very high96.8Very high12 Ų1240.9 Ų40.910%0.09922%0.22CC..  trans-67.1116.7-17800000112.6L109 K119 Y122L109-A113 WeakPolarHBondContact O-CB 3.41Å; L109-A113 PolarHBondContact O-N 2.88Å; A113-K119 HydrophobicContact CB-CG 3.83Å; A113-K119 WeakPolarHBondContact O-CE 3.46Å; A113-Y122 HydrophobicContact CB-CD2 3.82Å; A113-Y122 HydrophobicContact CB-CE2 3.94Å
114Q94.2Very high96.8Very high151 Ų15140 Ų4071%0.70621%0.21SC*.  trans-98-40.4-179-55.7-177.614.900111.3E37 S112E37-Q114 PolarHBondContact OE1-N 3.25Å; E37-Q114 VanDerWaalsContact OE2-CB 3.29Å; E37-Q114 WeakPolarHBondContact OE2-CB 3.17Å; E37-Q114 VanDerWaalsContact OE2-CG 3.27Å; E37-Q114 WeakPolarHBondContact OE2-CG 3.41Å; S112-Q114 PolarHBondContact O-N 2.94Å
115T95.4Very high96.8Very high69 Ų6940.2 Ų40.242%0.42321%0.211SC..SBendtrans-84.6151.1-176.8710000112.4E117 S118 K119T115-E117 PolarHBondContact O-N 3.49Å; T115-S118 PolarHBondContact O-N 2.96Å; T115-S118 WeakPolarHBondContact OG1-CB 3.37Å; T115-S118 PolarHBondContact OG1-N 3.26Å; T115-S118 PolarHBondContact OG1-OG 2.69Å; T115-S118 VanDerWaalsContact OG1-OG 3.05Å; T115-K119 WeakPolarHBondContact O-CG 3.43Å; T115-K119 PolarHBondContact O-N 2.98Å
116G95.9Very high96.8Very high5 Ų542.2 Ų42.25%0.05222%0.22CC..Hα-helixtrans-55.7-38.6170.300000112.5K119 V120 E163G116-K119 PolarHBondContact O-N 3.39Å; G116-V120 WeakPolarHBondContact O-CB 3.29Å; G116-V120 WeakPolarHBondContact O-CG2 3.38Å; G116-V120 PolarHBondContact O-N 2.89Å; G116-E163 VanDerWaalsContact CA-CD 3.5Å; G116-E163 WeakPolarHBondContact CA-OE2 3.25Å; G116-E163 PolarHBondContact N-OE2 3.4Å
117E96Very high96.9Very high55 Ų5540.1 Ų40.126%0.25721%0.205SC..Hα-helixtrans-59.1-51.9176.6-165.5-175124.500112R43 T115 K119 V120 F121 L164 H168 I170R43-E117 IonicContact CZ-OE1 2.6Å; R43-E117 IonicContact NH1-OE1 3.06Å; R43-E117 PolarHBondContact NH1-OE1 2.92Å; R43-E117 IonicContact NH2-OE1 2.8Å; R43-E117 PolarHBondContact NH2-OE1 3.37Å; T115-E117 PolarHBondContact O-N 3.49Å; E117-K119 PolarHBondContact O-N 3.48Å; E117-V120 PolarHBondContact O-N 3.49Å; E117-F121 VanDerWaalsContact O-CB 3.26Å; E117-F121 WeakPolarHBondContact O-CB 3.49Å; E117-F121 PolarHBondContact O-N 3.46Å; E117-L164 HydrophobicContact CB-CD2 4.34Å; E117-H168 IonicContact OE2-CE1 3.35Å; E117-H168 IonicContact OE2-NE2 2.64Å; E117-I170 HydrophobicContact CG-CD1 3.34Å
118S97Very high97Very high5 Ų535.6 Ų35.64%0.03518%0.181CC..Hα-helixtrans-58.3-46.6176.4-67.70000111.7E37 T115 F121 Y122E37-S118 VanDerWaalsContact OE1-CB 3.22Å; E37-S118 WeakPolarHBondContact OE1-CB 3.33Å; E37-S118 PolarHBondContact OE1-OG 3.41Å; T115-S118 PolarHBondContact O-N 2.96Å; T115-S118 WeakPolarHBondContact OG1-CB 3.37Å; T115-S118 PolarHBondContact OG1-N 3.26Å; T115-S118 PolarHBondContact OG1-OG 2.69Å; T115-S118 VanDerWaalsContact OG1-OG 3.05Å; S118-F121 PolarHBondContact O-N 2.88Å; S118-Y122 WeakPolarHBondContact O-CD2 3.39Å; S118-Y122 VanDerWaalsContact O-CG 3.31Å; S118-Y122 PolarHBondContact O-N 2.9Å
119K98Very high97.1Very high62 Ų6233.2 Ų33.227%0.2717%0.169SC..Hα-helixtrans-60.6-51.5-179.7-70.4171.8-167.4163.70111.5A113 T115 G116 E117 F121 Y122 Y123 V159 E163A113-K119 HydrophobicContact CB-CG 3.83Å; A113-K119 WeakPolarHBondContact O-CE 3.46Å; T115-K119 WeakPolarHBondContact O-CG 3.43Å; T115-K119 PolarHBondContact O-N 2.98Å; G116-K119 PolarHBondContact O-N 3.39Å; E117-K119 PolarHBondContact O-N 3.48Å; K119-F121 VanDerWaalsContact C-N 3.28Å; K119-F121 PolarHBondContact O-N 3.5Å; K119-Y122 PolarHBondContact O-N 3.4Å; K119-Y123 HydrophobicContact CB-CD2 4.41Å; K119-Y123 WeakPolarHBondContact O-CB 3.13Å; K119-Y123 WeakPolarHBondContact O-CD2 3.3Å; K119-Y123 PolarHBondContact O-N 3.24Å; K119-V159 HydrophobicContact CB-CG1 4.15Å; K119-V159 HydrophobicContact CD-CG1 4.36Å; K119-E163 IonicContact NZ-OE1 2.67Å
120V98.5Very high97.2Very high0 Ų034.2 Ų34.20%017%0.174CC..Hα-helixtrans-61.1-42.3179.7179.50000110.1G116 E117 K124 A156 V159 A160 L164 I170 L174G116-V120 WeakPolarHBondContact O-CB 3.29Å; G116-V120 WeakPolarHBondContact O-CG2 3.38Å; G116-V120 PolarHBondContact O-N 2.89Å; E117-V120 PolarHBondContact O-N 3.49Å; V120-K124 WeakPolarHBondContact O-CB 3.48Å; V120-K124 PolarHBondContact O-N 2.98Å; V120-A156 HydrophobicContact CG1-CB 4.42Å; V120-V159 HydrophobicContact CG2-CB 3.79Å; V120-V159 HydrophobicContact CG2-CG1 3.67Å; V120-A160 HydrophobicContact CB-CB 4.49Å; V120-A160 HydrophobicContact CG1-CB 3.85Å; V120-A160 HydrophobicContact CG2-CB 3.72Å; V120-L164 HydrophobicContact CB-CD1 4.01Å; V120-L164 HydrophobicContact CG1-CD1 4.12Å; V120-L164 HydrophobicContact CG2-CD1 3.85Å; V120-L164 HydrophobicContact CG2-CG 4.49Å; V120-I170 HydrophobicContact CB-CG2 3.99Å; V120-I170 HydrophobicContact CG1-CG2 3.57Å; V120-L174 HydrophobicContact CG1-CD2 4.02Å
121F98Very high97.2Very high20 Ų2032.9 Ų32.99%0.08817%0.167CC..Hα-helixtrans-58.6-50.8177.8-169.4-82.7000112.2R43 E117 S118 K119 M125 I170R43-F121 HydrophobicContact CG-CD1 3.63Å; R43-F121 HydrophobicContact CG-CD2 4.47Å; R43-F121 HydrophobicContact CG-CE1 3.42Å; R43-F121 VanDerWaalsContact CG-CE1 3.42Å; R43-F121 HydrophobicContact CG-CE2 4.29Å; R43-F121 HydrophobicContact CG-CG 4.16Å; R43-F121 HydrophobicContact CG-CZ 3.78Å; E117-F121 VanDerWaalsContact O-CB 3.26Å; E117-F121 WeakPolarHBondContact O-CB 3.49Å; E117-F121 PolarHBondContact O-N 3.46Å; S118-F121 PolarHBondContact O-N 2.88Å; K119-F121 VanDerWaalsContact C-N 3.28Å; K119-F121 PolarHBondContact O-N 3.5Å; F121-M125 HydrophobicContact CE1-SD 4.35Å; F121-M125 WeakPolarHBondContact O-CB 3.5Å; F121-M125 PolarHBondContact O-N 2.73Å; F121-I170 HydrophobicContact CB-CD1 4.43Å; F121-I170 HydrophobicContact CD2-CD1 3.81Å; F121-I170 HydrophobicContact CD2-CG1 4.19Å
122Y98.4Very high97.4Very high0 Ų029.3 Ų29.30%014%0.142CC..Hα-helixtrans-72-39.3-177.1-60.4-41.8000113.2R43 L105 L109 A113 S118 K119 M125 K126R43-Y122 HydrophobicContact CG-CE1 3.95Å; L105-Y122 HydrophobicContact CD2-CD1 3.76Å; L105-Y122 HydrophobicContact CD2-CG 4.11Å; L109-Y122 HydrophobicContact CB-CD1 3.98Å; L109-Y122 HydrophobicContact CB-CD2 3.93Å; L109-Y122 HydrophobicContact CB-CE1 3.96Å; L109-Y122 HydrophobicContact CB-CE2 3.91Å; L109-Y122 HydrophobicContact CB-CG 4Å; L109-Y122 HydrophobicContact CD1-CD1 4.24Å; L109-Y122 HydrophobicContact CD1-CE1 3.98Å; L109-Y122 HydrophobicContact CD2-CE1 4.46Å; L109-Y122 HydrophobicContact CG-CE1 4.36Å; L109-Y122 WeakPolarHBondContact O-CD2 3.44Å; L109-Y122 WeakPolarHBondContact O-CE2 3.4Å; A113-Y122 HydrophobicContact CB-CD2 3.82Å; A113-Y122 HydrophobicContact CB-CE2 3.94Å; S118-Y122 WeakPolarHBondContact O-CD2 3.39Å; S118-Y122 VanDerWaalsContact O-CG 3.31Å; S118-Y122 PolarHBondContact O-N 2.9Å; K119-Y122 PolarHBondContact O-N 3.4Å; Y122-M125 PolarHBondContact O-N 2.85Å; Y122-K126 WeakPolarHBondContact O-CB 3.3Å; Y122-K126 PolarHBondContact O-N 2.93Å
123Y98.7Very high97.6Very high68 Ų6829.5 Ų29.527%0.26714%0.142SC..Hα-helixtrans-66.4-40.1174.3-78.2-60.8000112I110 K119 M125 K126 G127 A155I110-Y123 HydrophobicContact CD1-CD1 4.18Å; I110-Y123 HydrophobicContact CD1-CE1 4.13Å; I110-Y123 HydrophobicContact CG2-CE1 4.02Å; I110-Y123 HydrophobicContact CG2-CE2 4.36Å; K119-Y123 HydrophobicContact CB-CD2 4.41Å; K119-Y123 WeakPolarHBondContact O-CB 3.13Å; K119-Y123 WeakPolarHBondContact O-CD2 3.3Å; K119-Y123 PolarHBondContact O-N 3.24Å; Y123-M125 VanDerWaalsContact C-N 3.34Å; Y123-M125 PolarHBondContact O-N 2.97Å; Y123-K126 PolarHBondContact O-N 3.41Å; Y123-G127 PolarHBondContact O-N 2.9Å; Y123-A155 HydrophobicContact CD1-CB 3.91Å; Y123-A155 HydrophobicContact CD2-CB 4.37Å; Y123-A155 HydrophobicContact CE1-CB 4.07Å; Y123-A155 HydrophobicContact CG-CB 4.08Å
124K98.4Very high97.8Very high28 Ų2829 Ų2912%0.12214%0.137CC..Hα-helixtrans-58.3-48171.8178.4-169.6172-67.10110.7V120 K126 G127 D128 Y153 G173 L174 N177V120-K124 WeakPolarHBondContact O-CB 3.48Å; V120-K124 PolarHBondContact O-N 2.98Å; K124-K126 VanDerWaalsContact C-N 3.35Å; K124-K126 PolarHBondContact O-N 3.15Å; K124-G127 PolarHBondContact O-N 3.36Å; K124-D128 IonicContact NZ-OD2 2.89Å; K124-D128 PolarHBondContact NZ-OD2 3.33Å; K124-D128 PolarHBondContact O-N 3.33Å; K124-Y153 HydrophobicContact CG-CE1 4.49Å; K124-G173 WeakPolarHBondContact CE-O 3.38Å; K124-L174 HydrophobicContact CB-CD1 4.11Å; K124-L174 HydrophobicContact CD-CB 4.12Å; K124-L174 HydrophobicContact CG-CB 4.37Å; K124-L174 HydrophobicContact CG-CD1 4.09Å; K124-N177 PolarHBondContact NZ-ND2 3.43Å
125M98.3Very high97.9Very high10 Ų1023.1 Ų23.15%0.04911%0.11CC..Hα-helixtrans-60.5-44.6178.2-164.2176-169.500110.9I101 L105 F121 Y122 Y123 G127 D128 Y129I101-M125 HydrophobicContact CD1-CE 3.79Å; I101-M125 HydrophobicContact CD1-SD 4.17Å; I101-M125 HydrophobicContact CG1-CE 3.79Å; I101-M125 HydrophobicContact CG1-SD 4.28Å; L105-M125 HydrophobicContact CD1-CB 4.14Å; L105-M125 HydrophobicContact CD1-CG 4.07Å; L105-M125 HydrophobicContact CD1-SD 4.44Å; L105-M125 HydrophobicContact CD2-CB 4.36Å; L105-M125 HydrophobicContact CD2-SD 4.13Å; F121-M125 HydrophobicContact CE1-SD 4.35Å; F121-M125 WeakPolarHBondContact O-CB 3.5Å; F121-M125 PolarHBondContact O-N 2.73Å; Y122-M125 PolarHBondContact O-N 2.85Å; Y123-M125 VanDerWaalsContact C-N 3.34Å; Y123-M125 PolarHBondContact O-N 2.97Å; M125-G127 VanDerWaalsContact C-N 3.32Å; M125-G127 PolarHBondContact O-N 2.98Å; M125-D128 WeakPolarHBondContact O-CB 3.38Å; M125-D128 PolarHBondContact O-N 2.94Å; M125-D128 VanDerWaalsContact O-N 3.15Å; M125-Y129 HydrophobicContact CE-CE2 3.75Å; M125-Y129 HydrophobicContact CG-CD2 3.91Å; M125-Y129 HydrophobicContact CG-CE2 3.79Å; M125-Y129 VanDerWaalsContact O-CD2 3.3Å; M125-Y129 WeakPolarHBondContact O-CD2 3.4Å; M125-Y129 PolarHBondContact O-N 3.29Å
126K98.7Very high97.9Very high43 Ų4321 Ų2119%0.18710%0.095CC..Hα-helixtrans-56.6-45.3174-176.5174.4-179.7175.90111.8L102 L105 I110 Y122 Y123 K124 D128 Y129 H130 A152L102-K126 HydrophobicContact CD2-CB 4.42Å; L102-K126 HydrophobicContact CD2-CG 3.81Å; L105-K126 HydrophobicContact CD1-CB 4.09Å; I110-K126 HydrophobicContact CD1-CD 3.86Å; Y122-K126 WeakPolarHBondContact O-CB 3.3Å; Y122-K126 PolarHBondContact O-N 2.93Å; Y123-K126 PolarHBondContact O-N 3.41Å; K124-K126 VanDerWaalsContact C-N 3.35Å; K124-K126 PolarHBondContact O-N 3.15Å; K126-D128 PolarHBondContact O-N 3.43Å; K126-Y129 PolarHBondContact O-N 2.87Å; K126-H130 PolarHBondContact O-CD2 2.58Å; K126-H130 VanDerWaalsContact O-CD2 3.29Å; K126-H130 PolarHBondContact O-N 2.86Å; K126-H130 VanDerWaalsContact O-N 3.08Å; K126-A152 HydrophobicContact CB-CB 4.04Å; K126-A152 HydrophobicContact CD-CB 4.19Å; K126-A152 HydrophobicContact CG-CB 3.89Å
127G98.7Very high97.9Very high0 Ų021.7 Ų21.70%010%0.1CC..Hα-helixtrans-59.7-44.2174.900000112.8Y123 K124 M125 R131 S149 Y153Y123-G127 PolarHBondContact O-N 2.9Å; K124-G127 PolarHBondContact O-N 3.36Å; M125-G127 VanDerWaalsContact C-N 3.32Å; M125-G127 PolarHBondContact O-N 2.98Å; G127-R131 WeakPolarHBondContact O-CB 3.47Å; G127-R131 PolarHBondContact O-N 3.48Å; G127-S149 PolarHBondContact O-OG 3.12Å; G127-Y153 VanDerWaalsContact C-CZ 3.47Å
128D98.6Very high97.8Very high9 Ų925.5 Ų25.55%0.04812%0.12CC..Hα-helixtrans-60.7-46.4177.8-74.5-37.8000112.4K124 M125 K126 R131 Y132 Y153 N177K124-D128 IonicContact NZ-OD2 2.89Å; K124-D128 PolarHBondContact NZ-OD2 3.33Å; K124-D128 PolarHBondContact O-N 3.33Å; M125-D128 WeakPolarHBondContact O-CB 3.38Å; M125-D128 PolarHBondContact O-N 2.94Å; M125-D128 VanDerWaalsContact O-N 3.15Å; K126-D128 PolarHBondContact O-N 3.43Å; D128-R131 WeakPolarHBondContact O-CB 3.41Å; D128-R131 PolarHBondContact O-N 3.05Å; D128-R131 IonicContact OD1-CZ 3.67Å; D128-R131 IonicContact OD1-NE 3.68Å; D128-R131 IonicContact OD1-NH2 3.94Å; D128-R131 PolarHBondContact OD1-NH2 2.89Å; D128-Y132 HydrophobicContact CB-CE2 4.3Å; D128-Y132 WeakPolarHBondContact O-CD1 3.31Å; D128-Y132 VanDerWaalsContact O-CD2 3.31Å; D128-Y132 WeakPolarHBondContact O-CD2 3.35Å; D128-Y132 PolarHBondContact O-N 3.5Å; D128-Y153 WeakPolarHBondContact CA-OH 3.26Å; D128-Y153 PolarHBondContact N-OH 3.31Å; D128-Y153 PolarHBondContact OD1-OH 3.45Å; D128-N177 VanDerWaalsContact OD1-CB 3.31Å; D128-N177 WeakPolarHBondContact OD1-CB 3.37Å; D128-N177 PolarHBondContact OD1-ND2 3.06Å; D128-N177 PolarHBondContact OD2-ND2 3.12Å
129Y98.6Very high97.7Very high8 Ų829.1 Ų29.13%0.03115%0.151CC..Hα-helixtrans-73.7-33.7-178.7-79.4-86.8000113.2Y50 I54 C98 I101 M125 K126 R131 Y132 L133Y50-Y129 VanDerWaalsContact C-OH 3.23Å; Y50-Y129 VanDerWaalsContact CB-OH 3.29Å; Y50-Y129 WeakPolarHBondContact CB-OH 3.37Å; Y50-Y129 PolarHBondContact O-OH 3.16Å; Y50-Y129 VanDerWaalsContact O-OH 3.12Å; I54-Y129 HydrophobicContact CB-CE1 3.92Å; I54-Y129 HydrophobicContact CD1-CE1 4.21Å; I54-Y129 HydrophobicContact CG1-CD1 4.48Å; I54-Y129 HydrophobicContact CG1-CE1 3.88Å; I54-Y129 HydrophobicContact CG2-CE1 3.96Å; I54-Y129 WeakPolarHBondContact CG2-OH 3.49Å; C98-Y129 HydrophobicContact CB-CD1 4.2Å; I101-Y129 HydrophobicContact CG1-CD2 4.33Å; I101-Y129 HydrophobicContact CG1-CE2 4.26Å; I101-Y129 HydrophobicContact CG2-CD1 3.32Å; I101-Y129 HydrophobicContact CG2-CD2 3.71Å; I101-Y129 HydrophobicContact CG2-CE1 3.58Å; I101-Y129 HydrophobicContact CG2-CE2 3.98Å; I101-Y129 HydrophobicContact CG2-CG 3.4Å; M125-Y129 HydrophobicContact CE-CE2 3.75Å; M125-Y129 HydrophobicContact CG-CD2 3.91Å; M125-Y129 HydrophobicContact CG-CE2 3.79Å; M125-Y129 VanDerWaalsContact O-CD2 3.3Å; M125-Y129 WeakPolarHBondContact O-CD2 3.4Å; M125-Y129 PolarHBondContact O-N 3.29Å; K126-Y129 PolarHBondContact O-N 2.87Å; Y129-R131 VanDerWaalsContact C-N 3.34Å; Y129-Y132 AromaticContact CD1-CD2 3.83Å; Y129-Y132 HydrophobicContact CD1-CD2 3.83Å; Y129-Y132 HydrophobicContact CD1-CE2 4.29Å; Y129-Y132 HydrophobicContact CE1-CD2 4.11Å; Y129-Y132 HydrophobicContact CE1-CE2 4.26Å; Y129-Y132 HydrophobicContact CE2-CE2 4.46Å; Y129-Y132 HydrophobicContact CG-CD2 4.15Å; Y129-Y132 HydrophobicContact CG-CE2 4.44Å; Y129-Y132 PolarHBondContact O-N 3.15Å; Y129-L133 WeakPolarHBondContact O-CG 3.45Å; Y129-L133 PolarHBondContact O-N 3.49Å
130H98.8Very high97.7Very high20 Ų2032.7 Ų32.79%0.09317%0.168CC..Hα-helixtrans-66.3-36.6168.3-79.2-59.4000112.4K126 Y132 L133 A134 L148K126-H130 PolarHBondContact O-CD2 2.58Å; K126-H130 VanDerWaalsContact O-CD2 3.29Å; K126-H130 PolarHBondContact O-N 2.86Å; K126-H130 VanDerWaalsContact O-N 3.08Å; H130-Y132 VanDerWaalsContact C-N 3.33Å; H130-Y132 PolarHBondContact O-N 3.32Å; H130-L133 WeakPolarHBondContact O-CB 3.25Å; H130-L133 PolarHBondContact O-N 3.19Å; H130-A134 PolarHBondContact O-N 3.3Å; H130-L148 HydrophobicContact CB-CB 4.4Å; H130-L148 VanDerWaalsContact CE1-CD1 3.49Å; H130-L148 WeakPolarHBondContact CE1-CD1 3.33Å
131R98.5Very high97.6Very high3 Ų340 Ų401%0.01120%0.2CC..Hα-helixtrans-60.3-44.5172168.8168.865.485.32.9111.2G127 D128 Y129 L133 A134 E135 S149 Y153 F181 I185G127-R131 WeakPolarHBondContact O-CB 3.47Å; G127-R131 PolarHBondContact O-N 3.48Å; D128-R131 WeakPolarHBondContact O-CB 3.41Å; D128-R131 PolarHBondContact O-N 3.05Å; D128-R131 IonicContact OD1-CZ 3.67Å; D128-R131 IonicContact OD1-NE 3.68Å; D128-R131 IonicContact OD1-NH2 3.94Å; D128-R131 PolarHBondContact OD1-NH2 2.89Å; Y129-R131 VanDerWaalsContact C-N 3.34Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.48Å; R131-A134 WeakPolarHBondContact O-CB 3.22Å; R131-A134 PolarHBondContact O-N 3.36Å; R131-E135 IonicContact NH1-OE1 2.68Å; R131-E135 PolarHBondContact O-N 3Å; R131-E135 VanDerWaalsContact O-N 3.12Å; R131-S149 PolarHBondContact N-OG 3.17Å; R131-Y153 PolarHBondContact NE-OH 3.09Å; R131-F181 HydrophobicContact CB-CD2 4.15Å; R131-F181 HydrophobicContact CG-CD2 4.22Å; R131-I185 HydrophobicContact CG-CD1 4.2Å; R131-I185 HydrophobicContact CG-CG1 3.78Å
132Y98.2Very high97.6Very high27 Ų2743.1 Ų43.111%0.10621%0.211CC..Hα-helixtrans-60.8-40.2176.5-57.6-27.1000112.2I54 D128 Y129 H130 A134 E135 F136I54-Y132 HydrophobicContact CG1-CD2 3.97Å; I54-Y132 HydrophobicContact CG1-CE2 4.43Å; I54-Y132 HydrophobicContact CG2-CE2 4.17Å; D128-Y132 HydrophobicContact CB-CE2 4.3Å; D128-Y132 WeakPolarHBondContact O-CD1 3.31Å; D128-Y132 VanDerWaalsContact O-CD2 3.31Å; D128-Y132 WeakPolarHBondContact O-CD2 3.35Å; D128-Y132 PolarHBondContact O-N 3.5Å; Y129-Y132 AromaticContact CD1-CD2 3.83Å; Y129-Y132 HydrophobicContact CD1-CD2 3.83Å; Y129-Y132 HydrophobicContact CD1-CE2 4.29Å; Y129-Y132 HydrophobicContact CE1-CD2 4.11Å; Y129-Y132 HydrophobicContact CE1-CE2 4.26Å; Y129-Y132 HydrophobicContact CE2-CE2 4.46Å; Y129-Y132 HydrophobicContact CG-CD2 4.15Å; Y129-Y132 HydrophobicContact CG-CE2 4.44Å; Y129-Y132 PolarHBondContact O-N 3.15Å; H130-Y132 VanDerWaalsContact C-N 3.33Å; H130-Y132 PolarHBondContact O-N 3.32Å; Y132-A134 VanDerWaalsContact C-N 3.32Å; Y132-A134 PolarHBondContact O-N 2.84Å; Y132-E135 WeakPolarHBondContact CD1-OE1 3.3Å; Y132-E135 WeakPolarHBondContact O-CB 3.45Å; Y132-E135 PolarHBondContact O-N 2.85Å; Y132-F136 WeakPolarHBondContact O-CD1 3.48Å; Y132-F136 WeakPolarHBondContact O-CE1 3.46Å
133L98.4Very high97.5Very high25 Ų2548.9 Ų48.913%0.13124%0.236CC..Hα-helixtrans-60-42.3171.7-71.1173000111.7C98 L102 Y129 H130 R131 E135 F136 A137 A145C98-L133 HydrophobicContact CB-CD1 4.06Å; C98-L133 HydrophobicContact CB-CD2 3.62Å; C98-L133 HydrophobicContact CB-CG 3.67Å; L102-L133 HydrophobicContact CD1-CD1 3.74Å; Y129-L133 WeakPolarHBondContact O-CG 3.45Å; Y129-L133 PolarHBondContact O-N 3.49Å; H130-L133 WeakPolarHBondContact O-CB 3.25Å; H130-L133 PolarHBondContact O-N 3.19Å; R131-L133 VanDerWaalsContact C-N 3.32Å; R131-L133 PolarHBondContact O-N 3.48Å; L133-E135 PolarHBondContact O-N 3.33Å; L133-F136 HydrophobicContact CD2-CE1 4.4Å; L133-F136 HydrophobicContact CD2-CZ 3.79Å; L133-F136 PolarHBondContact O-N 2.92Å; L133-A137 WeakPolarHBondContact O-CB 3.31Å; L133-A137 PolarHBondContact O-N 2.9Å; L133-A145 HydrophobicContact CB-CB 3.91Å
134A98.3Very high97.5Very high0 Ų051.4 Ų51.40%025%0.251CS..Hα-helixtrans-65.3-25.2179.600000113.5H130 R131 Y132 F136 R142 A145 A146 I185H130-A134 PolarHBondContact O-N 3.3Å; R131-A134 WeakPolarHBondContact O-CB 3.22Å; R131-A134 PolarHBondContact O-N 3.36Å; Y132-A134 VanDerWaalsContact C-N 3.32Å; Y132-A134 PolarHBondContact O-N 2.84Å; A134-F136 VanDerWaalsContact C-N 3.31Å; A134-F136 PolarHBondContact O-N 3.45Å; A134-R142 PolarHBondContact O-NH1 3.01Å; A134-A145 HydrophobicContact CB-CB 3.88Å; A134-A146 HydrophobicContact CB-CB 4.49Å; A134-I185 HydrophobicContact CB-CD1 4.18Å; A134-I185 HydrophobicContact CB-CG1 4.5Å; A134-I185 HydrophobicContact CB-CG2 3.85Å
135E96.8Very high97.5Very high29 Ų2950.4 Ų50.414%0.13625%0.248CC..Hα-helixtrans-59.2-40179.6-72.5170.8-162.800112.6R58 W61 R62 R131 Y132 L133 I185R58-E135 IonicContact CZ-OE1 3.2Å; R58-E135 IonicContact CZ-OE2 2.79Å; R58-E135 IonicContact NE-OE1 3.26Å; R58-E135 IonicContact NE-OE2 3.79Å; R58-E135 PolarHBondContact NE-OE2 3.39Å; R58-E135 VanDerWaalsContact NH2-CD 3.27Å; R58-E135 IonicContact NH2-OE1 2.64Å; R58-E135 PolarHBondContact NH2-OE1 3.1Å; R58-E135 IonicContact NH2-OE2 3.36Å; R58-E135 PolarHBondContact NH2-OE2 3.5Å; W61-E135 HydrophobicContact CH2-CB 4.21Å; W61-E135 HydrophobicContact CZ3-CB 4.25Å; R62-E135 IonicContact NH2-OE2 3.66Å; R131-E135 IonicContact NH1-OE1 2.68Å; R131-E135 PolarHBondContact O-N 3Å; R131-E135 VanDerWaalsContact O-N 3.12Å; Y132-E135 WeakPolarHBondContact CD1-OE1 3.3Å; Y132-E135 WeakPolarHBondContact O-CB 3.45Å; Y132-E135 PolarHBondContact O-N 2.85Å; L133-E135 PolarHBondContact O-N 3.33Å; E135-I185 HydrophobicContact CG-CD1 4.04Å
136F95.8Very high97.5Very high24 Ų2450.3 Ų50.311%0.10525%0.249CC..Hα-helixtrans-117.8-11-173.964.5-94.9000114W61 E91 L94 S95 Y132 L133 A134W61-F136 HydrophobicContact CD2-CB 4.41Å; W61-F136 HydrophobicContact CH2-CB 4.16Å; W61-F136 HydrophobicContact CZ2-CB 3.42Å; W61-F136 VanDerWaalsContact CZ2-CB 3.42Å; E91-F136 HydrophobicContact CB-CD2 3.81Å; E91-F136 HydrophobicContact CB-CE2 4.09Å; E91-F136 HydrophobicContact CG-CB 4.07Å; E91-F136 HydrophobicContact CG-CD2 3.76Å; E91-F136 HydrophobicContact CG-CG 4.08Å; L94-F136 HydrophobicContact CB-CE1 3.77Å; L94-F136 HydrophobicContact CB-CZ 3.84Å; L94-F136 HydrophobicContact CD1-CD1 4.1Å; L94-F136 HydrophobicContact CD1-CE1 4.09Å; S95-F136 VanDerWaalsContact OG-CE2 3.24Å; S95-F136 WeakPolarHBondContact OG-CE2 3.42Å; S95-F136 WeakPolarHBondContact OG-CZ 3.31Å; Y132-F136 WeakPolarHBondContact O-CD1 3.48Å; Y132-F136 WeakPolarHBondContact O-CE1 3.46Å; L133-F136 HydrophobicContact CD2-CE1 4.4Å; L133-F136 HydrophobicContact CD2-CZ 3.79Å; L133-F136 PolarHBondContact O-N 2.92Å; A134-F136 VanDerWaalsContact C-N 3.31Å; A134-F136 PolarHBondContact O-N 3.45Å
137A96.3Very high97.5Very high20 Ų2052.4 Ų52.417%0.16526%0.262CS..  trans-66.2157.317400000112L133 K141 R142L133-A137 WeakPolarHBondContact O-CB 3.31Å; L133-A137 PolarHBondContact O-N 2.9Å; A137-K141 HydrophobicContact CB-CB 4.04Å; A137-R142 HydrophobicContact CB-CB 4.07Å; A137-R142 WeakPolarHBondContact O-CB 3.3Å
138I93.9Very high97.5Very high134 Ų13455 Ų5569%0.68728%0.275SS*.  trans-122.9152.7-179.858.8170.4000111.5E140 K141 R142I138-E140 PolarHBondContact O-N 3.49Å; I138-K141 PolarHBondContact O-N 3.37Å; I138-R142 PolarHBondContact O-N 3.48Å
139A94.6Very high97.5Very high81 Ų8154.5 Ų54.567%0.66927%0.273SS*.Hα-helixtrans48.1-126.9174.900000112.9K141 R142 K143A139-K141 VanDerWaalsContact C-N 3.31Å; A139-K141 PolarHBondContact O-N 2.83Å; A139-R142 WeakPolarHBondContact O-CB 3.34Å; A139-R142 PolarHBondContact O-N 3.3Å; A139-R142 VanDerWaalsContact O-N 3.14Å; A139-K143 PolarHBondContact O-N 3.32Å
140E96.8Very high97.5Very high137 Ų13755.7 Ų55.764%0.6428%0.279SS*.Hα-helixtrans-60.8-36-176.5-66.4-54.2122.900113.2I138 R142 K143 E144I138-E140 PolarHBondContact O-N 3.49Å; E140-R142 VanDerWaalsContact C-N 3.3Å; E140-R142 PolarHBondContact O-N 3.48Å; E140-K143 PolarHBondContact O-N 3.25Å; E140-E144 WeakPolarHBondContact O-CB 3.41Å; E140-E144 PolarHBondContact O-N 3.46Å
141K96.3Very high97.5Very high153 Ų15360.6 Ų60.667%0.66530%0.302SS*.Hα-helixtrans-64-36.9177.6-69-172.6175.3-172.30112A137 I138 A139 A145A137-K141 HydrophobicContact CB-CB 4.04Å; I138-K141 PolarHBondContact O-N 3.37Å; A139-K141 VanDerWaalsContact C-N 3.31Å; A139-K141 PolarHBondContact O-N 2.83Å; K141-A145 VanDerWaalsContact O-CB 3.32Å; K141-A145 WeakPolarHBondContact O-CB 3.4Å; K141-A145 PolarHBondContact O-N 3.49Å
142R97.8Very high97.6Very high86 Ų8660.6 Ų60.633%0.32530%0.303SS..Hα-helixtrans-64.6-44.8175.3-178177.7167.698.1-2.7110.7A134 A137 I138 A139 E140 A145 A146 I185A134-R142 PolarHBondContact O-NH1 3.01Å; A137-R142 HydrophobicContact CB-CB 4.07Å; A137-R142 WeakPolarHBondContact O-CB 3.3Å; I138-R142 PolarHBondContact O-N 3.48Å; A139-R142 WeakPolarHBondContact O-CB 3.34Å; A139-R142 PolarHBondContact O-N 3.3Å; A139-R142 VanDerWaalsContact O-N 3.14Å; E140-R142 VanDerWaalsContact C-N 3.3Å; E140-R142 PolarHBondContact O-N 3.48Å; R142-A145 PolarHBondContact O-N 2.84Å; R142-A146 WeakPolarHBondContact O-CB 3.32Å; R142-A146 PolarHBondContact O-N 3.46Å; R142-I185 PolarHBondContact NH2-O 2.87Å
143K98Very high97.6Very high121 Ų12159.3 Ų59.353%0.52630%0.298SS..Hα-helixtrans-62.7-48.6179.8-176.1-178.5173.6-170.40111.2A139 E140 A145 A146 D147A139-K143 PolarHBondContact O-N 3.32Å; E140-K143 PolarHBondContact O-N 3.25Å; K143-A145 PolarHBondContact O-N 3.17Å; K143-A146 PolarHBondContact O-N 2.92Å; K143-D147 WeakPolarHBondContact O-CB 3.47Å; K143-D147 PolarHBondContact O-N 3.14Å
144E98.3Very high97.6Very high121 Ų12163 Ų6357%0.56531%0.313SS*.Hα-helixtrans-57.6-48.2176.4-178.2179.9-172.300111.7E140 A146 D147 L148E140-E144 WeakPolarHBondContact O-CB 3.41Å; E140-E144 PolarHBondContact O-N 3.46Å; E144-A146 VanDerWaalsContact C-N 3.33Å; E144-A146 PolarHBondContact O-N 3.37Å; E144-D147 PolarHBondContact O-N 2.83Å; E144-L148 HydrophobicContact CG-CD1 3.95Å; E144-L148 WeakPolarHBondContact O-CB 3.48Å; E144-L148 VanDerWaalsContact O-CG 3.3Å; E144-L148 WeakPolarHBondContact O-CG 3.24Å; E144-L148 PolarHBondContact O-N 3.17Å
145A98.5Very high97.6Very high7 Ų764.4 Ų64.46%0.05833%0.325CS..Hα-helixtrans-61.8-40.2177.100000112.3L133 A134 K141 R142 K143 S149L133-A145 HydrophobicContact CB-CB 3.91Å; A134-A145 HydrophobicContact CB-CB 3.88Å; K141-A145 VanDerWaalsContact O-CB 3.32Å; K141-A145 WeakPolarHBondContact O-CB 3.4Å; K141-A145 PolarHBondContact O-N 3.49Å; R142-A145 PolarHBondContact O-N 2.84Å; K143-A145 PolarHBondContact O-N 3.17Å; A145-S149 VanDerWaalsContact O-CB 3.25Å; A145-S149 WeakPolarHBondContact O-CB 3.38Å; A145-S149 PolarHBondContact O-N 3.05Å
146A98.5Very high97.7Very high9 Ų963 Ų637%0.07432%0.318CS..Hα-helixtrans-66.2-42.7176.400000112.2A134 R142 K143 E144 S149 L150 F181 I185 L186A134-A146 HydrophobicContact CB-CB 4.49Å; R142-A146 WeakPolarHBondContact O-CB 3.32Å; R142-A146 PolarHBondContact O-N 3.46Å; K143-A146 PolarHBondContact O-N 2.92Å; E144-A146 VanDerWaalsContact C-N 3.33Å; E144-A146 PolarHBondContact O-N 3.37Å; A146-S149 PolarHBondContact O-N 3.31Å; A146-L150 WeakPolarHBondContact O-CB 3.42Å; A146-L150 PolarHBondContact O-N 3.32Å; A146-F181 WeakPolarHBondContact O-CZ 3.49Å; A146-I185 HydrophobicContact CB-CG2 3.76Å; A146-L186 HydrophobicContact CB-CD2 4.39Å
147D98.6Very high97.8Very high86 Ų8663.2 Ų63.246%0.4632%0.323SS..Hα-helixtrans-64.5-45.1178.7-72.4-21.4000111K143 E144 S149 L150 E151K143-D147 WeakPolarHBondContact O-CB 3.47Å; K143-D147 PolarHBondContact O-N 3.14Å; E144-D147 PolarHBondContact O-N 2.83Å; D147-S149 PolarHBondContact O-N 2.84Å; D147-L150 PolarHBondContact O-N 3.26Å; D147-E151 WeakPolarHBondContact O-CB 3.25Å; D147-E151 PolarHBondContact O-N 2.84Å
148L98.7Very high97.9Very high54 Ų5467.7 Ų67.728%0.28334%0.344SS..Hα-helixtrans-65.7-36.8176.1-69.4170.9000112.5H130 E144 A152H130-L148 HydrophobicContact CB-CB 4.4Å; H130-L148 VanDerWaalsContact CE1-CD1 3.49Å; H130-L148 WeakPolarHBondContact CE1-CD1 3.33Å; E144-L148 HydrophobicContact CG-CD1 3.95Å; E144-L148 WeakPolarHBondContact O-CB 3.48Å; E144-L148 VanDerWaalsContact O-CG 3.3Å; E144-L148 WeakPolarHBondContact O-CG 3.24Å; E144-L148 PolarHBondContact O-N 3.17Å; L148-A152 WeakPolarHBondContact O-CB 3.35Å; L148-A152 PolarHBondContact O-N 2.57Å
149S98.7Very high98.1Very high0 Ų062.5 Ų62.50%032%0.318CS..Hα-helixtrans-63.4-47.1173.8-175.10000111.2G127 R131 A145 A146 D147 E151 A152 Y153 F181G127-S149 PolarHBondContact O-OG 3.12Å; R131-S149 PolarHBondContact N-OG 3.17Å; A145-S149 VanDerWaalsContact O-CB 3.25Å; A145-S149 WeakPolarHBondContact O-CB 3.38Å; A145-S149 PolarHBondContact O-N 3.05Å; A146-S149 PolarHBondContact O-N 3.31Å; D147-S149 PolarHBondContact O-N 2.84Å; S149-E151 PolarHBondContact O-N 3.47Å; S149-A152 PolarHBondContact O-N 3.09Å; S149-Y153 WeakPolarHBondContact O-CD2 3.42Å; S149-Y153 PolarHBondContact O-N 2.68Å; S149-Y153 WeakPolarHBondContact OG-CE2 3.23Å; S149-F181 WeakPolarHBondContact OG-CD2 3.41Å; S149-F181 WeakPolarHBondContact OG-CE2 3.26Å
150L98.7Very high98.3Very high32 Ų3258.7 Ų58.717%0.16829%0.287CS..Hα-helixtrans-61.2-43.6177.3178.663000111.8A146 D147 K154 F178 F181 Y182 L186A146-L150 WeakPolarHBondContact O-CB 3.42Å; A146-L150 PolarHBondContact O-N 3.32Å; D147-L150 PolarHBondContact O-N 3.26Å; L150-K154 HydrophobicContact CD1-CD 4.3Å; L150-K154 HydrophobicContact CD1-CG 4.37Å; L150-K154 HydrophobicContact CG-CD 4.27Å; L150-K154 WeakPolarHBondContact O-CB 3.31Å; L150-K154 VanDerWaalsContact O-CG 3.32Å; L150-K154 WeakPolarHBondContact O-CG 3.41Å; L150-K154 PolarHBondContact O-N 2.65Å; L150-F178 HydrophobicContact CD1-CE2 3.76Å; L150-F178 HydrophobicContact CD1-CZ 3.78Å; L150-F181 HydrophobicContact CB-CE1 3.9Å; L150-F181 HydrophobicContact CB-CZ 3.93Å; L150-F181 HydrophobicContact CD1-CE1 3.97Å; L150-F181 HydrophobicContact CG-CE1 4.5Å; L150-Y182 HydrophobicContact CD1-CE1 4.29Å; L150-L186 HydrophobicContact CD1-CD1 4.49Å
151E98.7Very high98.3Very high123 Ų12356.7 Ų56.758%0.57528%0.284SS*.Hα-helixtrans-59-49.2176.3-174.2-173.8154.700111.1D147 S149 Y153 K154 A155D147-E151 WeakPolarHBondContact O-CB 3.25Å; D147-E151 PolarHBondContact O-N 2.84Å; S149-E151 PolarHBondContact O-N 3.47Å; E151-Y153 PolarHBondContact O-N 3.21Å; E151-K154 PolarHBondContact O-N 3.25Å; E151-A155 PolarHBondContact O-N 3.19Å
152A98.8Very high98.3Very high4 Ų454.7 Ų54.73%0.03329%0.285CS..Hα-helixtrans-64-42.6-179.600000112.4K126 L148 S149 K154 A155 A156K126-A152 HydrophobicContact CB-CB 4.04Å; K126-A152 HydrophobicContact CD-CB 4.19Å; K126-A152 HydrophobicContact CG-CB 3.89Å; L148-A152 WeakPolarHBondContact O-CB 3.35Å; L148-A152 PolarHBondContact O-N 2.57Å; S149-A152 PolarHBondContact O-N 3.09Å; A152-K154 PolarHBondContact O-N 3Å; A152-A155 PolarHBondContact O-N 3.39Å; A152-A156 WeakPolarHBondContact O-CB 3.46Å; A152-A156 PolarHBondContact O-N 3.42Å
153Y98.8Very high98.3Very high0 Ų055.3 Ų55.30%029%0.291CS..Hα-helixtrans-66.6-35.4176.5-74.3-51000113.1K124 G127 D128 R131 S149 E151 A156 S157 L174 N177 F178 F181K124-Y153 HydrophobicContact CG-CE1 4.49Å; G127-Y153 VanDerWaalsContact C-CZ 3.47Å; D128-Y153 WeakPolarHBondContact CA-OH 3.26Å; D128-Y153 PolarHBondContact N-OH 3.31Å; D128-Y153 PolarHBondContact OD1-OH 3.45Å; R131-Y153 PolarHBondContact NE-OH 3.09Å; S149-Y153 WeakPolarHBondContact O-CD2 3.42Å; S149-Y153 PolarHBondContact O-N 2.68Å; S149-Y153 WeakPolarHBondContact OG-CE2 3.23Å; E151-Y153 PolarHBondContact O-N 3.21Å; Y153-A156 PolarHBondContact O-N 3.21Å; Y153-S157 WeakPolarHBondContact O-CB 3.25Å; Y153-S157 PolarHBondContact O-N 3.5Å; Y153-S157 PolarHBondContact O-OG 3.23Å; Y153-L174 HydrophobicContact CD1-CD1 3.66Å; Y153-L174 HydrophobicContact CE1-CD1 4.37Å; Y153-N177 HydrophobicContact CE1-CB 4.24Å; Y153-F178 VanDerWaalsContact CB-CD2 3.49Å; Y153-F178 HydrophobicContact CD1-CB 4.11Å; Y153-F178 HydrophobicContact CD1-CD2 4.48Å; Y153-F178 HydrophobicContact CD1-CG 4.32Å; Y153-F178 HydrophobicContact CD2-CB 4.48Å; Y153-F178 AromaticContact CD2-CD2 3.54Å; Y153-F178 HydrophobicContact CD2-CD2 3.54Å; Y153-F178 AromaticContact CD2-CE2 3.96Å; Y153-F178 HydrophobicContact CD2-CE2 3.96Å; Y153-F178 HydrophobicContact CD2-CG 4.18Å; Y153-F178 HydrophobicContact CE2-CD2 4.34Å; Y153-F178 HydrophobicContact CG-CB 4.08Å; Y153-F178 HydrophobicContact CG-CD1 4.42Å; Y153-F178 AromaticContact CG-CD2 3.62Å; Y153-F178 HydrophobicContact CG-CD2 3.62Å; Y153-F178 HydrophobicContact CG-CE2 4.06Å; Y153-F178 AromaticContact CG-CG 3.82Å; Y153-F178 HydrophobicContact CG-CG 3.82Å; Y153-F181 HydrophobicContact CD2-CB 4.15Å; Y153-F181 HydrophobicContact CD2-CD1 4.14Å; Y153-F181 HydrophobicContact CD2-CG 4.01Å; Y153-F181 HydrophobicContact CE2-CB 3.61Å; Y153-F181 HydrophobicContact CE2-CD1 4.35Å; Y153-F181 HydrophobicContact CE2-CD2 4.09Å; Y153-F181 AromaticContact CE2-CG 3.75Å; Y153-F181 HydrophobicContact CE2-CG 3.75Å
154K98.6Very high98.2Very high102 Ų10250.2 Ų50.244%0.44327%0.27SS..Hα-helixtrans-65.2-47.7173.1-77.1177.1175.3174.90111.5L150 E151 A152 A156 S157 D158 F178L150-K154 HydrophobicContact CD1-CD 4.3Å; L150-K154 HydrophobicContact CD1-CG 4.37Å; L150-K154 HydrophobicContact CG-CD 4.27Å; L150-K154 WeakPolarHBondContact O-CB 3.31Å; L150-K154 VanDerWaalsContact O-CG 3.32Å; L150-K154 WeakPolarHBondContact O-CG 3.41Å; L150-K154 PolarHBondContact O-N 2.65Å; E151-K154 PolarHBondContact O-N 3.25Å; A152-K154 PolarHBondContact O-N 3Å; K154-A156 VanDerWaalsContact C-N 3.27Å; K154-A156 PolarHBondContact O-N 2.92Å; K154-S157 WeakPolarHBondContact O-CA 3.44Å; K154-S157 WeakPolarHBondContact O-CB 3.24Å; K154-S157 PolarHBondContact O-N 3Å; K154-D158 PolarHBondContact O-N 2.87Å; K154-F178 HydrophobicContact CG-CZ 4.21Å
155A98.4Very high98.1Very high29 Ų2947.4 Ų47.424%0.2426%0.262CS..Hα-helixtrans-57.6-41.3175.700000111.9Y123 E151 A152 V159Y123-A155 HydrophobicContact CD1-CB 3.91Å; Y123-A155 HydrophobicContact CD2-CB 4.37Å; Y123-A155 HydrophobicContact CE1-CB 4.07Å; Y123-A155 HydrophobicContact CG-CB 4.08Å; E151-A155 PolarHBondContact O-N 3.19Å; A152-A155 PolarHBondContact O-N 3.39Å; A155-V159 WeakPolarHBondContact O-CG2 3.42Å; A155-V159 PolarHBondContact O-N 3.25Å
156A98.7Very high98Very high0 Ų048.6 Ų48.60%027%0.269CS..Hα-helixtrans-62.4-42.117300000112.1V120 A152 Y153 K154 A160 L174V120-A156 HydrophobicContact CG1-CB 4.42Å; A152-A156 WeakPolarHBondContact O-CB 3.46Å; A152-A156 PolarHBondContact O-N 3.42Å; Y153-A156 PolarHBondContact O-N 3.21Å; K154-A156 VanDerWaalsContact C-N 3.27Å; K154-A156 PolarHBondContact O-N 2.92Å; A156-A160 VanDerWaalsContact O-CB 3.25Å; A156-A160 WeakPolarHBondContact O-CB 3.43Å; A156-A160 PolarHBondContact O-N 3.02Å; A156-L174 HydrophobicContact CB-CD1 3.66Å; A156-L174 HydrophobicContact CB-CD2 3.64Å; A156-L174 HydrophobicContact CB-CG 4.3Å
157S98.5Very high97.9Very high28 Ų2848.4 Ų48.420%0.19627%0.267CS..Hα-helixtrans-67.3-42.3-177.5-58.80000111.9Y153 K154 V159 A160 V161Y153-S157 WeakPolarHBondContact O-CB 3.25Å; Y153-S157 PolarHBondContact O-N 3.5Å; Y153-S157 PolarHBondContact O-OG 3.23Å; K154-S157 WeakPolarHBondContact O-CA 3.44Å; K154-S157 WeakPolarHBondContact O-CB 3.24Å; K154-S157 PolarHBondContact O-N 3Å; S157-V159 VanDerWaalsContact C-N 3.31Å; S157-V159 PolarHBondContact O-N 3.43Å; S157-A160 PolarHBondContact O-N 2.9Å; S157-V161 VanDerWaalsContact O-CG2 3.29Å; S157-V161 WeakPolarHBondContact O-CG2 3.49Å; S157-V161 PolarHBondContact O-N 3.4Å
158D98.1Very high97.7Very high115 Ų11545.9 Ų45.962%0.61525%0.252SS*.Hα-helixtrans-59.8-42.8179.3-67.8-19.5000111.3K154 T162K154-D158 PolarHBondContact O-N 2.87Å; D158-T162 PolarHBondContact O-OG1 3.28Å; D158-T162 VanDerWaalsContact O-OG1 3.09Å
159V98.4Very high97.6Very high25 Ų2543.8 Ų43.815%0.15224%0.242CC..Hα-helixtrans-70.8-44.8174.6-1770000111K119 V120 A155 S157 V161 T162 E163K119-V159 HydrophobicContact CB-CG1 4.15Å; K119-V159 HydrophobicContact CD-CG1 4.36Å; V120-V159 HydrophobicContact CG2-CB 3.79Å; V120-V159 HydrophobicContact CG2-CG1 3.67Å; A155-V159 WeakPolarHBondContact O-CG2 3.42Å; A155-V159 PolarHBondContact O-N 3.25Å; S157-V159 VanDerWaalsContact C-N 3.31Å; S157-V159 PolarHBondContact O-N 3.43Å; V159-V161 VanDerWaalsContact C-N 3.33Å; V159-V161 PolarHBondContact O-N 3.18Å; V159-T162 PolarHBondContact O-N 3.35Å; V159-T162 VanDerWaalsContact O-N 3.17Å; V159-T162 PolarHBondContact O-OG1 3.02Å; V159-T162 VanDerWaalsContact O-OG1 3.07Å; V159-E163 HydrophobicContact CG1-CB 4.29Å; V159-E163 HydrophobicContact CG1-CG 4.1Å; V159-E163 WeakPolarHBondContact O-CB 3.22Å; V159-E163 PolarHBondContact O-N 3.35Å
160A98.4Very high97.5Very high1 Ų144.4 Ų44.41%0.00825%0.245CC..Hα-helixtrans-63.9-36.7-175.300000113.2V120 A156 S157 T162 L164 R171 L174V120-A160 HydrophobicContact CB-CB 4.49Å; V120-A160 HydrophobicContact CG1-CB 3.85Å; V120-A160 HydrophobicContact CG2-CB 3.72Å; A156-A160 VanDerWaalsContact O-CB 3.25Å; A156-A160 WeakPolarHBondContact O-CB 3.43Å; A156-A160 PolarHBondContact O-N 3.02Å; S157-A160 PolarHBondContact O-N 2.9Å; A160-T162 PolarHBondContact O-N 3.4Å; A160-L164 HydrophobicContact CB-CD1 4.37Å; A160-L164 WeakPolarHBondContact O-CB 3.21Å; A160-L164 PolarHBondContact O-N 3.32Å; A160-L164 VanDerWaalsContact O-N 3.11Å; A160-R171 HydrophobicContact CB-CB 4.34Å; A160-R171 HydrophobicContact CB-CG 4.04Å; A160-L174 HydrophobicContact CB-CD2 3.97Å
161V96.9Very high97.4Very high95 Ų9545 Ų4558%0.57625%0.245SC*.Hα-helixtrans-65.5-30.3179169.30000111.9S157 V159S157-V161 VanDerWaalsContact O-CG2 3.29Å; S157-V161 WeakPolarHBondContact O-CG2 3.49Å; S157-V161 PolarHBondContact O-N 3.4Å; V159-V161 VanDerWaalsContact C-N 3.33Å; V159-V161 PolarHBondContact O-N 3.18Å
162T96.1Very high97.4Very high111 Ų11139.2 Ų39.268%0.68122%0.218SC*.Hα-helixtrans-98.4-32.4-174.453.10000113.6D158 V159 A160D158-T162 PolarHBondContact O-OG1 3.28Å; D158-T162 VanDerWaalsContact O-OG1 3.09Å; V159-T162 PolarHBondContact O-N 3.35Å; V159-T162 VanDerWaalsContact O-N 3.17Å; V159-T162 PolarHBondContact O-OG1 3.02Å; V159-T162 VanDerWaalsContact O-OG1 3.07Å; A160-T162 PolarHBondContact O-N 3.4Å
163E97.5Very high97.4Very high98 Ų9839.2 Ų39.246%0.45822%0.218SC..Hα-helixtrans-108.2-15.6-172.9-61-162-139.200114.1G116 K119 V159G116-E163 VanDerWaalsContact CA-CD 3.5Å; G116-E163 WeakPolarHBondContact CA-OE2 3.25Å; G116-E163 PolarHBondContact N-OE2 3.4Å; K119-E163 IonicContact NZ-OE1 2.67Å; V159-E163 HydrophobicContact CG1-CB 4.29Å; V159-E163 HydrophobicContact CG1-CG 4.1Å; V159-E163 WeakPolarHBondContact O-CB 3.22Å; V159-E163 PolarHBondContact O-N 3.35Å
164L96.4Very high97.4Very high15 Ų1539.4 Ų39.48%0.07922%0.219CC..SBendtrans-123.9136.4-176.7-56.5-179.9000112.3E117 V120 A160 H168 I170 R171E117-L164 HydrophobicContact CB-CD2 4.34Å; V120-L164 HydrophobicContact CB-CD1 4.01Å; V120-L164 HydrophobicContact CG1-CD1 4.12Å; V120-L164 HydrophobicContact CG2-CD1 3.85Å; V120-L164 HydrophobicContact CG2-CG 4.49Å; A160-L164 HydrophobicContact CB-CD1 4.37Å; A160-L164 WeakPolarHBondContact O-CB 3.21Å; A160-L164 PolarHBondContact O-N 3.32Å; A160-L164 VanDerWaalsContact O-N 3.11Å; L164-H168 HydrophobicContact CB-CB 4.03Å; L164-I170 HydrophobicContact CD1-CB 4.4Å; L164-I170 HydrophobicContact CD1-CG2 4.19Å; L164-R171 HydrophobicContact CB-CB 4.22Å; L164-R171 HydrophobicContact CD1-CB 4.29Å; L164-R171 PolarHBondContact O-NH1 2.75Å
165P95.8Very high97.4Very high62 Ų6235 Ų3540%0.40320%0.202SC..  trans-64.6153.9175.126.1-32000111.4T167 H168 R171P165-T167 PolarHBondContact O-N 2.82Å; P165-T167 VanDerWaalsContact O-N 3.12Å; P165-H168 HydrophobicContact CG-CB 4.01Å; P165-H168 WeakPolarHBondContact O-CB 3.32Å; P165-H168 PolarHBondContact O-N 3.19Å; P165-R171 WeakPolarHBondContact O-CD 3.32Å
166P96.6Very high97.4Very high31 Ų3133.7 Ų33.720%0.20119%0.191CC..THydrogen-bonded Turntrans-54.1-31179.5-27.135.4000114.6H168 D202P166-H168 VanDerWaalsContact C-N 3.31Å; P166-D202 HydrophobicContact CB-CB 4.01Å
167T95.7Very high97.3Very high5 Ų533.7 Ų33.73%0.03119%0.191CC..THydrogen-bonded Turntrans-83.3-2.5178.955.60000113.9P165 A203 D206 S218P165-T167 PolarHBondContact O-N 2.82Å; P165-T167 VanDerWaalsContact O-N 3.12Å; T167-A203 HydrophobicContact CG2-CB 4.4Å; T167-A203 WeakPolarHBondContact CG2-O 3.4Å; T167-D206 HydrophobicContact CG2-CB 4.02Å; T167-D206 WeakPolarHBondContact CG2-O 3.4Å; T167-S218 WeakPolarHBondContact O-CB 3.45Å; T167-S218 PolarHBondContact O-OG 3.21Å
168H95.5Very high97.4Very high33 Ų3332.8 Ų32.815%0.15318%0.183CC..  trans-66.2129.3-178.1-164.7-78.8000111.5E117 L164 P165 P166 I170 R171 L172E117-H168 IonicContact OE2-CE1 3.35Å; E117-H168 IonicContact OE2-NE2 2.64Å; L164-H168 HydrophobicContact CB-CB 4.03Å; P165-H168 HydrophobicContact CG-CB 4.01Å; P165-H168 WeakPolarHBondContact O-CB 3.32Å; P165-H168 PolarHBondContact O-N 3.19Å; P166-H168 VanDerWaalsContact C-N 3.31Å; H168-I170 VanDerWaalsContact C-N 3.31Å; H168-I170 PolarHBondContact ND1-N 2.94Å; H168-I170 PolarHBondContact O-N 3.03Å; H168-R171 HydrophobicContact CB-CB 4.18Å; H168-R171 PolarHBondContact O-N 2.95Å; H168-L172 PolarHBondContact O-N 3.5Å
169P96Very high97.4Very high10 Ų1027.3 Ų27.37%0.06515%0.154CC..Hα-helixtrans-55.7-40.8-176.1-23.427.9000114R171 L172 G173 D217 S218 I221 T257P169-R171 PolarHBondContact O-N 3Å; P169-L172 PolarHBondContact O-N 3.48Å; P169-G173 PolarHBondContact O-N 3.4Å; P169-D217 HydrophobicContact CB-CB 4.17Å; P169-D217 HydrophobicContact CG-CB 4.07Å; P169-S218 WeakPolarHBondContact CD-OG 3.49Å; P169-S218 WeakPolarHBondContact CG-OG 3.32Å; P169-I221 HydrophobicContact CB-CD1 4.08Å; P169-I221 VanDerWaalsContact O-CD1 3.27Å; P169-I221 WeakPolarHBondContact O-CD1 3.41Å; P169-T257 HydrophobicContact CB-CG2 3.81Å
170I96.7Very high97.3Very high14 Ų1426.1 Ų26.17%0.07215%0.147CC..Hα-helixtrans-65.3-38.1177.8-70.4169.6000112.5E117 V120 F121 L164 H168 G173 L174E117-I170 HydrophobicContact CG-CD1 3.34Å; V120-I170 HydrophobicContact CB-CG2 3.99Å; V120-I170 HydrophobicContact CG1-CG2 3.57Å; F121-I170 HydrophobicContact CB-CD1 4.43Å; F121-I170 HydrophobicContact CD2-CD1 3.81Å; F121-I170 HydrophobicContact CD2-CG1 4.19Å; L164-I170 HydrophobicContact CD1-CB 4.4Å; L164-I170 HydrophobicContact CD1-CG2 4.19Å; H168-I170 VanDerWaalsContact C-N 3.31Å; H168-I170 PolarHBondContact ND1-N 2.94Å; H168-I170 PolarHBondContact O-N 3.03Å; I170-G173 PolarHBondContact O-N 2.89Å; I170-L174 WeakPolarHBondContact O-CB 3.18Å; I170-L174 PolarHBondContact O-N 3.04Å
171R97.8Very high97.4Very high44 Ų4426.1 Ų26.117%0.16615%0.147CC..Hα-helixtrans-69.5-44.7177.7178.3174.6170.9171.5-5.3111A160 L164 P165 H168 P169 G173 L174 A175A160-R171 HydrophobicContact CB-CB 4.34Å; A160-R171 HydrophobicContact CB-CG 4.04Å; L164-R171 HydrophobicContact CB-CB 4.22Å; L164-R171 HydrophobicContact CD1-CB 4.29Å; L164-R171 PolarHBondContact O-NH1 2.75Å; P165-R171 WeakPolarHBondContact O-CD 3.32Å; H168-R171 HydrophobicContact CB-CB 4.18Å; H168-R171 PolarHBondContact O-N 2.95Å; P169-R171 PolarHBondContact O-N 3Å; R171-G173 VanDerWaalsContact C-N 3.33Å; R171-G173 PolarHBondContact O-N 3.49Å; R171-L174 WeakPolarHBondContact O-CB 3.43Å; R171-L174 PolarHBondContact O-N 3.3Å; R171-A175 PolarHBondContact O-N 3.29Å
172L98.1Very high97.4Very high2 Ų222.9 Ų22.91%0.0112%0.124CC..Hα-helixtrans-59.9-44.6173.1-74.5170.4000111.4H168 P169 L174 A175 L176 A203 I221 M222 L225H168-L172 PolarHBondContact O-N 3.5Å; P169-L172 PolarHBondContact O-N 3.48Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 3.32Å; L172-A175 PolarHBondContact O-N 3.03Å; L172-L176 PolarHBondContact O-N 3.42Å; L172-A203 HydrophobicContact CD2-CB 3.75Å; L172-I221 HydrophobicContact CB-CB 4.14Å; L172-I221 HydrophobicContact CB-CD1 4.44Å; L172-I221 HydrophobicContact CB-CG2 3.63Å; L172-M222 HydrophobicContact CD1-CG 3.94Å; L172-M222 HydrophobicContact CD1-SD 4.43Å; L172-M222 HydrophobicContact CD2-CG 4.08Å; L172-L225 HydrophobicContact CD2-CD1 3.99Å
173G98Very high97.5Very high3 Ų319.1 Ų19.13%0.03110%0.098CC..Hα-helixtrans-65.2-34.3178.900000112.8K124 P169 I170 R171 N177K124-G173 WeakPolarHBondContact CE-O 3.38Å; P169-G173 PolarHBondContact O-N 3.4Å; I170-G173 PolarHBondContact O-N 2.89Å; R171-G173 VanDerWaalsContact C-N 3.33Å; R171-G173 PolarHBondContact O-N 3.49Å; G173-N177 PolarHBondContact O-N 3.38Å; G173-N177 VanDerWaalsContact O-N 3.08Å
174L98.7Very high97.4Very high5 Ų517 Ų173%0.0269%0.088CC..Hα-helixtrans-62.2-51170.3168.663.8000110.9V120 K124 Y153 A156 A160 I170 R171 L172 L176 N177 F178V120-L174 HydrophobicContact CG1-CD2 4.02Å; K124-L174 HydrophobicContact CB-CD1 4.11Å; K124-L174 HydrophobicContact CD-CB 4.12Å; K124-L174 HydrophobicContact CG-CB 4.37Å; K124-L174 HydrophobicContact CG-CD1 4.09Å; Y153-L174 HydrophobicContact CD1-CD1 3.66Å; Y153-L174 HydrophobicContact CE1-CD1 4.37Å; A156-L174 HydrophobicContact CB-CD1 3.66Å; A156-L174 HydrophobicContact CB-CD2 3.64Å; A156-L174 HydrophobicContact CB-CG 4.3Å; A160-L174 HydrophobicContact CB-CD2 3.97Å; I170-L174 WeakPolarHBondContact O-CB 3.18Å; I170-L174 PolarHBondContact O-N 3.04Å; R171-L174 WeakPolarHBondContact O-CB 3.43Å; R171-L174 PolarHBondContact O-N 3.3Å; L172-L174 VanDerWaalsContact C-N 3.31Å; L172-L174 PolarHBondContact O-N 3.32Å; L174-L176 VanDerWaalsContact C-N 3.29Å; L174-L176 PolarHBondContact O-N 3.07Å; L174-N177 PolarHBondContact O-N 2.94Å; L174-F178 WeakPolarHBondContact O-CB 3.2Å; L174-F178 PolarHBondContact O-N 3.27Å
175A98.6Very high97.5Very high10 Ų1016.9 Ų16.98%0.0839%0.087CC..Hα-helixtrans-59.1-42.6179.500000111.8R171 L172 F178 S179 A199R171-A175 PolarHBondContact O-N 3.29Å; L172-A175 PolarHBondContact O-N 3.03Å; A175-F178 PolarHBondContact O-N 2.95Å; A175-S179 VanDerWaalsContact O-CB 3.3Å; A175-S179 WeakPolarHBondContact O-CB 3.39Å; A175-S179 PolarHBondContact O-N 2.67Å; A175-S179 PolarHBondContact O-OG 3.08Å; A175-A199 HydrophobicContact CB-CB 3.37Å
176L98.4Very high97.5Very high0 Ų016.4 Ų16.40%08%0.081CC..Hα-helixtrans-57.7-54.8175.8-179.855000111L172 L174 F178 S179 V180 I221 L224 L225 N228 P252 A254L172-L176 PolarHBondContact O-N 3.42Å; L174-L176 VanDerWaalsContact C-N 3.29Å; L174-L176 PolarHBondContact O-N 3.07Å; L176-F178 PolarHBondContact O-N 3.27Å; L176-S179 PolarHBondContact O-N 3.34Å; L176-S179 PolarHBondContact O-OG 3.45Å; L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 3.27Å; L176-V180 VanDerWaalsContact O-N 3.15Å; L176-I221 HydrophobicContact CB-CG2 4.25Å; L176-I221 HydrophobicContact CD2-CG2 3.96Å; L176-L224 HydrophobicContact CD1-CB 4.3Å; L176-L224 HydrophobicContact CD2-CB 3.56Å; L176-L224 HydrophobicContact CD2-CD1 3.79Å; L176-L224 HydrophobicContact CD2-CG 4.34Å; L176-L225 HydrophobicContact CB-CD2 3.9Å; L176-L225 HydrophobicContact CB-CG 4.19Å; L176-L225 HydrophobicContact CD1-CD2 3.92Å; L176-L225 HydrophobicContact CD1-CG 4.16Å; L176-N228 WeakPolarHBondContact CD1-ND2 3.44Å; L176-P252 WeakPolarHBondContact CD1-O 3.46Å; L176-A254 HydrophobicContact CB-CB 4.3Å; L176-A254 HydrophobicContact CD2-CB 3.8Å; L176-A254 HydrophobicContact CG-CB 4.28Å
177N98.3Very high97.5Very high1 Ų121.1 Ų21.11%0.00511%0.105CC..Hα-helixtrans-68.5-36-177.2-73.914.7000113.3K124 D128 Y153 G173 L174 V180 F181 A253 A254K124-N177 PolarHBondContact NZ-ND2 3.43Å; D128-N177 VanDerWaalsContact OD1-CB 3.31Å; D128-N177 WeakPolarHBondContact OD1-CB 3.37Å; D128-N177 PolarHBondContact OD1-ND2 3.06Å; D128-N177 PolarHBondContact OD2-ND2 3.12Å; Y153-N177 HydrophobicContact CE1-CB 4.24Å; G173-N177 PolarHBondContact O-N 3.38Å; G173-N177 VanDerWaalsContact O-N 3.08Å; L174-N177 PolarHBondContact O-N 2.94Å; N177-V180 PolarHBondContact O-N 3.48Å; N177-F181 PolarHBondContact O-N 3.49Å; N177-A253 WeakPolarHBondContact OD1-CB 3.41Å; N177-A254 WeakPolarHBondContact OD1-CB 3.43Å; N177-A254 PolarHBondContact OD1-N 3.12Å
178F98.7Very high97.5Very high8 Ų822.5 Ų22.54%0.03511%0.114CC..Hα-helixtrans-71.4-33.3178.7-168.1-169.2000111.5L150 Y153 K154 L174 A175 L176 F181 Y182 L195L150-F178 HydrophobicContact CD1-CE2 3.76Å; L150-F178 HydrophobicContact CD1-CZ 3.78Å; Y153-F178 VanDerWaalsContact CB-CD2 3.49Å; Y153-F178 HydrophobicContact CD1-CB 4.11Å; Y153-F178 HydrophobicContact CD1-CD2 4.48Å; Y153-F178 HydrophobicContact CD1-CG 4.32Å; Y153-F178 HydrophobicContact CD2-CB 4.48Å; Y153-F178 AromaticContact CD2-CD2 3.54Å; Y153-F178 HydrophobicContact CD2-CD2 3.54Å; Y153-F178 AromaticContact CD2-CE2 3.96Å; Y153-F178 HydrophobicContact CD2-CE2 3.96Å; Y153-F178 HydrophobicContact CD2-CG 4.18Å; Y153-F178 HydrophobicContact CE2-CD2 4.34Å; Y153-F178 HydrophobicContact CG-CB 4.08Å; Y153-F178 HydrophobicContact CG-CD1 4.42Å; Y153-F178 AromaticContact CG-CD2 3.62Å; Y153-F178 HydrophobicContact CG-CD2 3.62Å; Y153-F178 HydrophobicContact CG-CE2 4.06Å; Y153-F178 AromaticContact CG-CG 3.82Å; Y153-F178 HydrophobicContact CG-CG 3.82Å; K154-F178 HydrophobicContact CG-CZ 4.21Å; L174-F178 WeakPolarHBondContact O-CB 3.2Å; L174-F178 PolarHBondContact O-N 3.27Å; A175-F178 PolarHBondContact O-N 2.95Å; L176-F178 PolarHBondContact O-N 3.27Å; F178-F181 HydrophobicContact CD2-CB 4.29Å; F178-F181 AromaticContact CD2-CD1 3.78Å; F178-F181 HydrophobicContact CD2-CD1 3.78Å; F178-F181 HydrophobicContact CD2-CG 4.43Å; F178-F181 AromaticContact CE2-CD1 3.74Å; F178-F181 HydrophobicContact CE2-CD1 3.74Å; F178-F181 HydrophobicContact CE2-CE1 4.18Å; F178-F181 WeakPolarHBondContact O-CB 3.39Å; F178-F181 PolarHBondContact O-N 3.34Å; F178-Y182 HydrophobicContact CD1-CE2 4.2Å; F178-Y182 AromaticContact CD2-CD2 3.89Å; F178-Y182 HydrophobicContact CD2-CD2 3.89Å; F178-Y182 AromaticContact CD2-CE2 3.59Å; F178-Y182 HydrophobicContact CD2-CE2 3.59Å; F178-Y182 AromaticContact CE1-CE2 3.95Å; F178-Y182 HydrophobicContact CE1-CE2 3.95Å; F178-Y182 AromaticContact CE2-CD2 3.97Å; F178-Y182 HydrophobicContact CE2-CD2 3.97Å; F178-Y182 HydrophobicContact CE2-CE1 4.35Å; F178-Y182 AromaticContact CE2-CE2 3.28Å; F178-Y182 HydrophobicContact CE2-CE2 3.28Å; F178-Y182 AromaticContact CE2-CZ 3.51Å; F178-Y182 HydrophobicContact CG-CD2 4.4Å; F178-Y182 HydrophobicContact CG-CE2 4.05Å; F178-Y182 AromaticContact CZ-CE2 3.49Å; F178-Y182 HydrophobicContact CZ-CE2 3.49Å; F178-Y182 VanDerWaalsContact CZ-CE2 3.49Å; F178-Y182 AromaticContact CZ-CZ 3.58Å; F178-Y182 WeakPolarHBondContact CZ-OH 3.5Å; F178-Y182 VanDerWaalsContact O-CD2 3.25Å; F178-Y182 WeakPolarHBondContact O-CD2 3.3Å; F178-Y182 PolarHBondContact O-N 3.5Å; F178-L195 HydrophobicContact CB-CD2 3.77Å; F178-L195 HydrophobicContact CD1-CD2 3.64Å; F178-L195 HydrophobicContact CE1-CD2 4.45Å; F178-L195 HydrophobicContact CG-CD2 3.72Å
179S98.3Very high97.5Very high0 Ų022.8 Ų22.80%012%0.119CC..Hα-helixtrans-64.1-43.1171.470.90000111.7A175 L176 F181 Y182 Y183 A192 W232A175-S179 VanDerWaalsContact O-CB 3.3Å; A175-S179 WeakPolarHBondContact O-CB 3.39Å; A175-S179 PolarHBondContact O-N 2.67Å; A175-S179 PolarHBondContact O-OG 3.08Å; L176-S179 PolarHBondContact O-N 3.34Å; L176-S179 PolarHBondContact O-OG 3.45Å; S179-F181 VanDerWaalsContact C-N 3.31Å; S179-F181 PolarHBondContact O-N 2.94Å; S179-Y182 PolarHBondContact O-N 3.29Å; S179-Y183 PolarHBondContact O-N 3.02Å; S179-A192 WeakPolarHBondContact CB-O 3.35Å; S179-A192 WeakPolarHBondContact O-CB 3.25Å; S179-W232 WeakPolarHBondContact OG-CH2 3.2Å
180V97.8Very high97.5Very high1 Ų129 Ų291%0.00615%0.152CC..Hα-helixtrans-60.3-40.8174175.80000111.1L176 N177 Y183 E184 W232 A251 P252L176-V180 WeakPolarHBondContact O-CG2 3.41Å; L176-V180 PolarHBondContact O-N 3.27Å; L176-V180 VanDerWaalsContact O-N 3.15Å; N177-V180 PolarHBondContact O-N 3.48Å; V180-Y183 PolarHBondContact O-N 3.45Å; V180-E184 VanDerWaalsContact CG1-CD 3.45Å; V180-E184 HydrophobicContact CG1-CG 3.99Å; V180-E184 WeakPolarHBondContact CG1-OE2 3.33Å; V180-E184 WeakPolarHBondContact O-CB 3.43Å; V180-E184 PolarHBondContact O-N 2.95Å; V180-W232 HydrophobicContact CG2-CH2 4.3Å; V180-W232 HydrophobicContact CG2-CZ2 4.23Å; V180-A251 HydrophobicContact CG2-CB 3.92Å; V180-P252 WeakPolarHBondContact CG2-O 3.14Å
181F98.6Very high97.5Very high0 Ų035.5 Ų35.50%018%0.175CC..Hα-helixtrans-58.4-48.6173.4171-102.1000112.8R131 A146 S149 L150 Y153 N177 F178 S179 Y183 I185 L186R131-F181 HydrophobicContact CB-CD2 4.15Å; R131-F181 HydrophobicContact CG-CD2 4.22Å; A146-F181 WeakPolarHBondContact O-CZ 3.49Å; S149-F181 WeakPolarHBondContact OG-CD2 3.41Å; S149-F181 WeakPolarHBondContact OG-CE2 3.26Å; L150-F181 HydrophobicContact CB-CE1 3.9Å; L150-F181 HydrophobicContact CB-CZ 3.93Å; L150-F181 HydrophobicContact CD1-CE1 3.97Å; L150-F181 HydrophobicContact CG-CE1 4.5Å; Y153-F181 HydrophobicContact CD2-CB 4.15Å; Y153-F181 HydrophobicContact CD2-CD1 4.14Å; Y153-F181 HydrophobicContact CD2-CG 4.01Å; Y153-F181 HydrophobicContact CE2-CB 3.61Å; Y153-F181 HydrophobicContact CE2-CD1 4.35Å; Y153-F181 HydrophobicContact CE2-CD2 4.09Å; Y153-F181 AromaticContact CE2-CG 3.75Å; Y153-F181 HydrophobicContact CE2-CG 3.75Å; N177-F181 PolarHBondContact O-N 3.49Å; F178-F181 HydrophobicContact CD2-CB 4.29Å; F178-F181 AromaticContact CD2-CD1 3.78Å; F178-F181 HydrophobicContact CD2-CD1 3.78Å; F178-F181 HydrophobicContact CD2-CG 4.43Å; F178-F181 AromaticContact CE2-CD1 3.74Å; F178-F181 HydrophobicContact CE2-CD1 3.74Å; F178-F181 HydrophobicContact CE2-CE1 4.18Å; F178-F181 WeakPolarHBondContact O-CB 3.39Å; F178-F181 PolarHBondContact O-N 3.34Å; S179-F181 VanDerWaalsContact C-N 3.31Å; S179-F181 PolarHBondContact O-N 2.94Å; F181-Y183 PolarHBondContact O-N 2.77Å; F181-I185 HydrophobicContact CD2-CB 3.71Å; F181-I185 HydrophobicContact CD2-CG1 3.71Å; F181-I185 HydrophobicContact CD2-CG2 4.18Å; F181-I185 HydrophobicContact CE2-CB 3.7Å; F181-I185 HydrophobicContact CE2-CG1 4.08Å; F181-I185 HydrophobicContact CE2-CG2 3.66Å; F181-I185 HydrophobicContact CZ-CG2 4.42Å; F181-I185 WeakPolarHBondContact O-CB 3.36Å; F181-I185 PolarHBondContact O-N 3.37Å; F181-L186 HydrophobicContact CD1-CD1 4.2Å; F181-L186 HydrophobicContact CD1-CG 4.33Å; F181-L186 HydrophobicContact CE1-CD1 3.35Å; F181-L186 HydrophobicContact CE1-CD2 4.33Å; F181-L186 HydrophobicContact CE1-CG 3.58Å; F181-L186 HydrophobicContact CE2-CG 4.44Å; F181-L186 HydrophobicContact CZ-CD1 3.82Å; F181-L186 HydrophobicContact CZ-CD2 3.94Å; F181-L186 HydrophobicContact CZ-CG 3.64Å; F181-L186 PolarHBondContact O-N 3.39Å
182Y98.4Very high97.4Very high28 Ų2833.4 Ų33.411%0.1117%0.167CC..Hα-helixtrans-59.1-40177.7-83-61.5000111.7L150 F178 S179 L186 N187 S188 R191 L195L150-Y182 HydrophobicContact CD1-CE1 4.29Å; F178-Y182 HydrophobicContact CD1-CE2 4.2Å; F178-Y182 AromaticContact CD2-CD2 3.89Å; F178-Y182 HydrophobicContact CD2-CD2 3.89Å; F178-Y182 AromaticContact CD2-CE2 3.59Å; F178-Y182 HydrophobicContact CD2-CE2 3.59Å; F178-Y182 AromaticContact CE1-CE2 3.95Å; F178-Y182 HydrophobicContact CE1-CE2 3.95Å; F178-Y182 AromaticContact CE2-CD2 3.97Å; F178-Y182 HydrophobicContact CE2-CD2 3.97Å; F178-Y182 HydrophobicContact CE2-CE1 4.35Å; F178-Y182 AromaticContact CE2-CE2 3.28Å; F178-Y182 HydrophobicContact CE2-CE2 3.28Å; F178-Y182 AromaticContact CE2-CZ 3.51Å; F178-Y182 HydrophobicContact CG-CD2 4.4Å; F178-Y182 HydrophobicContact CG-CE2 4.05Å; F178-Y182 AromaticContact CZ-CE2 3.49Å; F178-Y182 HydrophobicContact CZ-CE2 3.49Å; F178-Y182 VanDerWaalsContact CZ-CE2 3.49Å; F178-Y182 AromaticContact CZ-CZ 3.58Å; F178-Y182 WeakPolarHBondContact CZ-OH 3.5Å; F178-Y182 VanDerWaalsContact O-CD2 3.25Å; F178-Y182 WeakPolarHBondContact O-CD2 3.3Å; F178-Y182 PolarHBondContact O-N 3.5Å; S179-Y182 PolarHBondContact O-N 3.29Å; Y182-L186 HydrophobicContact CD1-CB 4.49Å; Y182-L186 HydrophobicContact CD1-CD1 3.72Å; Y182-L186 HydrophobicContact CE1-CD1 3.81Å; Y182-L186 CarbonylContact O-C 3.42Å; Y182-N187 PolarHBondContact O-N 3.44Å; Y182-S188 PolarHBondContact O-N 3.31Å; Y182-R191 HydrophobicContact CD1-CB 3.92Å; Y182-R191 HydrophobicContact CD2-CB 4.47Å; Y182-R191 HydrophobicContact CE1-CB 4.36Å; Y182-R191 HydrophobicContact CG-CB 4Å; Y182-L195 HydrophobicContact CD2-CD2 4.02Å; Y182-L195 HydrophobicContact CE2-CD2 3.96Å
183Y97.4Very high97.4Very high32 Ų3234.5 Ų34.513%0.12518%0.175CC..Hα-helixtrans-70.4-59.5179.6-169.6-92000111.8S179 V180 F181 N187 P189 A192 W232 L235S179-Y183 PolarHBondContact O-N 3.02Å; V180-Y183 PolarHBondContact O-N 3.45Å; F181-Y183 PolarHBondContact O-N 2.77Å; Y183-N187 WeakPolarHBondContact O-CA 3.35Å; Y183-N187 PolarHBondContact O-N 3.17Å; Y183-P189 HydrophobicContact CD2-CB 3.94Å; Y183-P189 HydrophobicContact CE2-CB 3.95Å; Y183-A192 HydrophobicContact CD2-CB 4.42Å; Y183-W232 HydrophobicContact CD1-CZ2 4.42Å; Y183-W232 AromaticContact CD1-NE1 3.45Å; Y183-W232 HydrophobicContact CD2-CB 4.3Å; Y183-W232 AromaticContact CD2-CD1 3.49Å; Y183-W232 VanDerWaalsContact CD2-CD1 3.49Å; Y183-W232 AromaticContact CD2-CD2 3.72Å; Y183-W232 HydrophobicContact CD2-CD2 3.72Å; Y183-W232 AromaticContact CD2-CE2 3.64Å; Y183-W232 AromaticContact CD2-CG 3.6Å; Y183-W232 HydrophobicContact CD2-CG 3.6Å; Y183-W232 HydrophobicContact CD2-CZ2 4.35Å; Y183-W232 AromaticContact CD2-NE1 3.48Å; Y183-W232 AromaticContact CE1-CD1 3.73Å; Y183-W232 AromaticContact CE1-NE1 3.53Å; Y183-W232 HydrophobicContact CE2-CB 3.91Å; Y183-W232 AromaticContact CE2-CD1 3.14Å; Y183-W232 HydrophobicContact CE2-CD2 4.1Å; Y183-W232 AromaticContact CE2-CG 3.46Å; Y183-W232 HydrophobicContact CE2-CG 3.46Å; Y183-W232 VanDerWaalsContact CE2-CG 3.46Å; Y183-W232 AromaticContact CE2-NE1 3.57Å; Y183-W232 AromaticContact CG-CD1 3.93Å; Y183-W232 HydrophobicContact CG-CD2 4.15Å; Y183-W232 AromaticContact CG-CE2 3.58Å; Y183-W232 HydrophobicContact CG-CG 4.32Å; Y183-W232 AromaticContact CG-CZ2 3.93Å; Y183-W232 HydrophobicContact CG-CZ2 3.93Å; Y183-W232 AromaticContact CG-NE1 3.43Å; Y183-W232 AromaticContact CZ-CD1 3.27Å; Y183-W232 AromaticContact CZ-NE1 3.59Å; Y183-L235 VanDerWaalsContact OH-CD1 3.32Å; Y183-L235 WeakPolarHBondContact OH-CD1 3.44Å
184E95.5Very high97.3Very high53 Ų5340.5 Ų40.525%0.24820%0.202CC..Hα-helixtrans-81.4-33-167.7-63.1-176.2164.900113.8V180V180-E184 VanDerWaalsContact CG1-CD 3.45Å; V180-E184 HydrophobicContact CG1-CG 3.99Å; V180-E184 WeakPolarHBondContact CG1-OE2 3.33Å; V180-E184 WeakPolarHBondContact O-CB 3.43Å; V180-E184 PolarHBondContact O-N 2.95Å
185I97.6Very high97.3Very high13 Ų1342.1 Ų42.17%0.06721%0.21CC..THydrogen-bonded Turntrans-100.3-47.5-174.1-54.3-53.8000111.9R131 A134 E135 R142 A146 F181R131-I185 HydrophobicContact CG-CD1 4.2Å; R131-I185 HydrophobicContact CG-CG1 3.78Å; A134-I185 HydrophobicContact CB-CD1 4.18Å; A134-I185 HydrophobicContact CB-CG1 4.5Å; A134-I185 HydrophobicContact CB-CG2 3.85Å; E135-I185 HydrophobicContact CG-CD1 4.04Å; R142-I185 PolarHBondContact NH2-O 2.87Å; A146-I185 HydrophobicContact CB-CG2 3.76Å; F181-I185 HydrophobicContact CD2-CB 3.71Å; F181-I185 HydrophobicContact CD2-CG1 3.71Å; F181-I185 HydrophobicContact CD2-CG2 4.18Å; F181-I185 HydrophobicContact CE2-CB 3.7Å; F181-I185 HydrophobicContact CE2-CG1 4.08Å; F181-I185 HydrophobicContact CE2-CG2 3.66Å; F181-I185 HydrophobicContact CZ-CG2 4.42Å; F181-I185 WeakPolarHBondContact O-CB 3.36Å; F181-I185 PolarHBondContact O-N 3.37Å
186L97.2Very high97.3Very high52 Ų5241.6 Ų41.627%0.27221%0.206SC..THydrogen-bonded Turntrans-90.7-0.7-178.1-62.8-171.1000113.8A146 L150 F181 Y182 S188A146-L186 HydrophobicContact CB-CD2 4.39Å; L150-L186 HydrophobicContact CD1-CD1 4.49Å; F181-L186 HydrophobicContact CD1-CD1 4.2Å; F181-L186 HydrophobicContact CD1-CG 4.33Å; F181-L186 HydrophobicContact CE1-CD1 3.35Å; F181-L186 HydrophobicContact CE1-CD2 4.33Å; F181-L186 HydrophobicContact CE1-CG 3.58Å; F181-L186 HydrophobicContact CE2-CG 4.44Å; F181-L186 HydrophobicContact CZ-CD1 3.82Å; F181-L186 HydrophobicContact CZ-CD2 3.94Å; F181-L186 HydrophobicContact CZ-CG 3.64Å; F181-L186 PolarHBondContact O-N 3.39Å; Y182-L186 HydrophobicContact CD1-CB 4.49Å; Y182-L186 HydrophobicContact CD1-CD1 3.72Å; Y182-L186 HydrophobicContact CE1-CD1 3.81Å; Y182-L186 CarbonylContact O-C 3.42Å; L186-S188 PolarHBondContact O-N 3.41Å; L186-S188 VanDerWaalsContact O-N 3.12Å; L186-S188 PolarHBondContact O-OG 2.95Å
187N95.9Very high97.2Very high130 Ų13047.4 Ų47.470%0.69523%0.232SC*.  trans46.744.4-179.1-167.133.2000112Y182 Y183 P189Y182-N187 PolarHBondContact O-N 3.44Å; Y183-N187 WeakPolarHBondContact O-CA 3.35Å; Y183-N187 PolarHBondContact O-N 3.17Å; N187-P189 VanDerWaalsContact O-CD 3.3Å; N187-P189 WeakPolarHBondContact O-CD 3.39Å
188S96.7Very high97.2Very high33 Ų3351.7 Ų51.723%0.23125%0.252CS..  trans-121.268-173.3-680000110.1Y182 L186 D190 R191 A192Y182-S188 PolarHBondContact O-N 3.31Å; L186-S188 PolarHBondContact O-N 3.41Å; L186-S188 VanDerWaalsContact O-N 3.12Å; L186-S188 PolarHBondContact O-OG 2.95Å; S188-D190 VanDerWaalsContact C-N 3.28Å; S188-D190 PolarHBondContact O-N 3.3Å; S188-R191 PolarHBondContact O-N 2.81Å; S188-R191 VanDerWaalsContact O-N 3.11Å; S188-A192 PolarHBondContact O-N 2.88Å
189P95Very high97.2Very high39 Ų3952.1 Ų52.125%0.25326%0.256SS..Hα-helixtrans-59.3-36.3-175.123.8-34.3000112.9Y183 N187 R191 A192 C193Y183-P189 HydrophobicContact CD2-CB 3.94Å; Y183-P189 HydrophobicContact CE2-CB 3.95Å; N187-P189 VanDerWaalsContact O-CD 3.3Å; N187-P189 WeakPolarHBondContact O-CD 3.39Å; P189-R191 VanDerWaalsContact C-N 3.34Å; P189-R191 PolarHBondContact O-N 3.01Å; P189-A192 WeakPolarHBondContact O-CB 3.33Å; P189-A192 PolarHBondContact O-N 2.84Å; P189-C193 WeakPolarHBondContact O-CB 3.33Å; P189-C193 PolarHBondContact O-N 3.47Å; P189-C193 PolarHBondContact O-SG 2.96Å
190D95.1Very high97.1Very high140 Ų14054.3 Ų54.375%0.74927%0.266SS*.Hα-helixtrans-59.8-43.9176.3-64.2-40.5000112S188 H194S188-D190 VanDerWaalsContact C-N 3.28Å; S188-D190 PolarHBondContact O-N 3.3Å; D190-H194 VanDerWaalsContact O-CB 3.25Å; D190-H194 WeakPolarHBondContact O-CB 3.08Å; D190-H194 PolarHBondContact O-N 3.18Å
191R96.7Very high97.1Very high151 Ų15158 Ų5857%0.5729%0.286SS*.Hα-helixtrans-69.6-39.3177.8-70.4-172.5178.6176.11.6111.6Y182 S188 P189 H194 L195Y182-R191 HydrophobicContact CD1-CB 3.92Å; Y182-R191 HydrophobicContact CD2-CB 4.47Å; Y182-R191 HydrophobicContact CE1-CB 4.36Å; Y182-R191 HydrophobicContact CG-CB 4Å; S188-R191 PolarHBondContact O-N 2.81Å; S188-R191 VanDerWaalsContact O-N 3.11Å; P189-R191 VanDerWaalsContact C-N 3.34Å; P189-R191 PolarHBondContact O-N 3.01Å; R191-H194 PolarHBondContact O-N 3.27Å; R191-L195 WeakPolarHBondContact O-CB 3.5Å; R191-L195 PolarHBondContact O-N 3.04Å
192A97.1Very high97Very high0 Ų060.8 Ų60.80%030%0.301CS..Hα-helixtrans-59.8-50.617600000111.1S179 Y183 S188 P189 L195 A196 W232S179-A192 WeakPolarHBondContact CB-O 3.35Å; S179-A192 WeakPolarHBondContact O-CB 3.25Å; Y183-A192 HydrophobicContact CD2-CB 4.42Å; S188-A192 PolarHBondContact O-N 2.88Å; P189-A192 WeakPolarHBondContact O-CB 3.33Å; P189-A192 PolarHBondContact O-N 2.84Å; A192-L195 PolarHBondContact O-N 3.4Å; A192-A196 WeakPolarHBondContact O-CB 3.41Å; A192-A196 PolarHBondContact O-N 3.45Å; A192-W232 HydrophobicContact CB-CE3 4.14Å; A192-W232 HydrophobicContact CB-CH2 4.22Å; A192-W232 HydrophobicContact CB-CZ3 3.85Å
193C96.9Very high96.9Very high25 Ų2559.5 Ų59.517%0.16930%0.296CS..Hα-helixtrans-65.2-42.6179.2-64.30000111.8P189 L195 A196 K197 L229P189-C193 WeakPolarHBondContact O-CB 3.33Å; P189-C193 PolarHBondContact O-N 3.47Å; P189-C193 PolarHBondContact O-SG 2.96Å; C193-L195 PolarHBondContact O-N 3.44Å; C193-A196 PolarHBondContact O-N 3.23Å; C193-K197 WeakPolarHBondContact O-CB 3.45Å; C193-K197 PolarHBondContact O-N 3.01Å; C193-L229 HydrophobicContact CB-CD2 4.09Å; C193-L229 WeakPolarHBondContact O-CD2 3.38Å
194H97.2Very high96.8Very high129 Ų12961.4 Ų61.460%0.59731%0.311SS*.Hα-helixtrans-59.4-48177.3-178.562.5000111.7D190 R191 Q198D190-H194 VanDerWaalsContact O-CB 3.25Å; D190-H194 WeakPolarHBondContact O-CB 3.08Å; D190-H194 PolarHBondContact O-N 3.18Å; R191-H194 PolarHBondContact O-N 3.27Å; H194-Q198 VanDerWaalsContact O-CB 3.3Å; H194-Q198 WeakPolarHBondContact O-CB 3.38Å; H194-Q198 PolarHBondContact O-N 3.06Å
195L98Very high96.8Very high39 Ų3963.2 Ų63.220%0.20434%0.335CS..Hα-helixtrans-64.4-47.7179.5179.562.5000112.1F178 Y182 R191 A192 C193 K197 Q198 A199F178-L195 HydrophobicContact CB-CD2 3.77Å; F178-L195 HydrophobicContact CD1-CD2 3.64Å; F178-L195 HydrophobicContact CE1-CD2 4.45Å; F178-L195 HydrophobicContact CG-CD2 3.72Å; Y182-L195 HydrophobicContact CD2-CD2 4.02Å; Y182-L195 HydrophobicContact CE2-CD2 3.96Å; R191-L195 WeakPolarHBondContact O-CB 3.5Å; R191-L195 PolarHBondContact O-N 3.04Å; A192-L195 PolarHBondContact O-N 3.4Å; C193-L195 PolarHBondContact O-N 3.44Å; L195-K197 VanDerWaalsContact C-N 3.35Å; L195-K197 PolarHBondContact O-N 2.86Å; L195-Q198 PolarHBondContact O-N 3.05Å; L195-A199 WeakPolarHBondContact O-CB 3.38Å; L195-A199 PolarHBondContact O-N 2.77Å
196A97.6Very high96.6Very high0 Ų065 Ų650%034%0.344CS..Hα-helixtrans-63.6-41.8-179.500000111.8A192 C193 F200 L225 L229 W232A192-A196 WeakPolarHBondContact O-CB 3.41Å; A192-A196 PolarHBondContact O-N 3.45Å; C193-A196 PolarHBondContact O-N 3.23Å; A196-F200 WeakPolarHBondContact O-CB 3.46Å; A196-F200 PolarHBondContact O-N 3.32Å; A196-L225 HydrophobicContact CB-CD2 3.82Å; A196-L229 HydrophobicContact CB-CD1 4.43Å; A196-L229 HydrophobicContact CB-CD2 3.87Å; A196-L229 HydrophobicContact CB-CG 4Å; A196-W232 HydrophobicContact CB-CZ3 4.29Å
197K97.3Very high96.3Very high122 Ų12265 Ų6553%0.5334%0.344SS..Hα-helixtrans-66-46.5177.6-177173.1-179.1176.90111.9C193 L195 A199 F200 D201 L229C193-K197 WeakPolarHBondContact O-CB 3.45Å; C193-K197 PolarHBondContact O-N 3.01Å; L195-K197 VanDerWaalsContact C-N 3.35Å; L195-K197 PolarHBondContact O-N 2.86Å; K197-A199 VanDerWaalsContact C-N 3.34Å; K197-A199 PolarHBondContact O-N 3.48Å; K197-F200 PolarHBondContact O-N 2.98Å; K197-D201 WeakPolarHBondContact CE-OD2 3.36Å; K197-D201 WeakPolarHBondContact CG-OD2 3.3Å; K197-D201 WeakPolarHBondContact O-CB 3.45Å; K197-D201 VanDerWaalsContact O-CG 3.29Å; K197-D201 PolarHBondContact O-N 2.82Å; K197-L229 HydrophobicContact CB-CD1 4.13Å; K197-L229 HydrophobicContact CB-CD2 4.06Å
198Q98.1Very high96Very high91 Ų9168.3 Ų68.343%0.42536%0.355SS..Hα-helixtrans-58.5-47.2177.5-176.9-175.9-20.200111.1H194 L195 F200 D201 D202H194-Q198 VanDerWaalsContact O-CB 3.3Å; H194-Q198 WeakPolarHBondContact O-CB 3.38Å; H194-Q198 PolarHBondContact O-N 3.06Å; L195-Q198 PolarHBondContact O-N 3.05Å; Q198-F200 VanDerWaalsContact C-N 3.32Å; Q198-F200 PolarHBondContact O-N 3.11Å; Q198-D201 PolarHBondContact O-N 3.4Å; Q198-D202 VanDerWaalsContact O-CB 3.32Å; Q198-D202 WeakPolarHBondContact O-CB 3.28Å; Q198-D202 PolarHBondContact O-N 2.96Å
199A97.9Very high95.3Very high16 Ų1671.2 Ų71.213%0.13237%0.372CS..Hα-helixtrans-63-38.1178.600000112.8A175 L195 K197 A203 L225A175-A199 HydrophobicContact CB-CB 3.37Å; L195-A199 WeakPolarHBondContact O-CB 3.38Å; L195-A199 PolarHBondContact O-N 2.77Å; K197-A199 VanDerWaalsContact C-N 3.34Å; K197-A199 PolarHBondContact O-N 3.48Å; A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.4Å; A199-A203 PolarHBondContact O-N 3.12Å; A199-A203 VanDerWaalsContact O-N 3.16Å; A199-L225 HydrophobicContact CB-CD1 4.34Å
200F97.4Very high95Very high47 Ų4770.5 Ų70.521%0.20637%0.366CS..Hα-helixtrans-65.4-49.6175.2-175-89.8000111.6A196 K197 Q198 A203 V204 M222 L225 R226A196-F200 WeakPolarHBondContact O-CB 3.46Å; A196-F200 PolarHBondContact O-N 3.32Å; K197-F200 PolarHBondContact O-N 2.98Å; Q198-F200 VanDerWaalsContact C-N 3.32Å; Q198-F200 PolarHBondContact O-N 3.11Å; F200-A203 PolarHBondContact O-N 2.83Å; F200-V204 HydrophobicContact CD1-CG2 3.96Å; F200-V204 HydrophobicContact CE1-CG2 3.61Å; F200-V204 HydrophobicContact CZ-CG2 3.97Å; F200-V204 VanDerWaalsContact O-CG2 3.31Å; F200-V204 WeakPolarHBondContact O-CG2 3.35Å; F200-V204 PolarHBondContact O-N 2.83Å; F200-M222 HydrophobicContact CD2-CB 4.16Å; F200-M222 WeakPolarHBondContact CD2-O 3.31Å; F200-M222 HydrophobicContact CE2-CB 4.1Å; F200-M222 HydrophobicContact CE2-CE 4.45Å; F200-M222 WeakPolarHBondContact CE2-O 3.45Å; F200-L225 HydrophobicContact CD2-CB 4.45Å; F200-R226 HydrophobicContact CD2-CB 4.41Å; F200-R226 HydrophobicContact CE2-CB 4.01Å
201D97.6Very high94.6Very high78 Ų7866.7 Ų66.742%0.41735%0.35SS..Hα-helixtrans-64-43.5-178.7-69-17000111.4K197 Q198 A203 V204 A205K197-D201 WeakPolarHBondContact CE-OD2 3.36Å; K197-D201 WeakPolarHBondContact CG-OD2 3.3Å; K197-D201 WeakPolarHBondContact O-CB 3.45Å; K197-D201 VanDerWaalsContact O-CG 3.29Å; K197-D201 PolarHBondContact O-N 2.82Å; Q198-D201 PolarHBondContact O-N 3.4Å; D201-A203 VanDerWaalsContact C-N 3.32Å; D201-A203 PolarHBondContact O-N 3.29Å; D201-V204 PolarHBondContact O-N 3.03Å; D201-A205 PolarHBondContact O-N 3.5Å
202D96.9Very high94.1Very high59 Ų5968.2 Ų68.232%0.31636%0.364SS..Hα-helixtrans-60.8-41176.3-72-12.5000111.3P166 Q198 D206P166-D202 HydrophobicContact CB-CB 4.01Å; Q198-D202 VanDerWaalsContact O-CB 3.32Å; Q198-D202 WeakPolarHBondContact O-CB 3.28Å; Q198-D202 PolarHBondContact O-N 2.96Å; D202-D206 PolarHBondContact O-N 3.37Å
203A96.1Very high93.6Very high0 Ų075.2 Ų75.20%040%0.401CS..Hα-helixtrans-74.7-33.8178.900000113.1T167 L172 A199 F200 D201 A205 D206 L207 M222T167-A203 HydrophobicContact CG2-CB 4.4Å; T167-A203 WeakPolarHBondContact CG2-O 3.4Å; L172-A203 HydrophobicContact CD2-CB 3.75Å; A199-A203 VanDerWaalsContact O-CB 3.31Å; A199-A203 WeakPolarHBondContact O-CB 3.4Å; A199-A203 PolarHBondContact O-N 3.12Å; A199-A203 VanDerWaalsContact O-N 3.16Å; F200-A203 PolarHBondContact O-N 2.83Å; D201-A203 VanDerWaalsContact C-N 3.32Å; D201-A203 PolarHBondContact O-N 3.29Å; A203-A205 VanDerWaalsContact C-N 3.32Å; A203-D206 PolarHBondContact O-N 3.24Å; A203-L207 WeakPolarHBondContact O-CA 3.48Å; A203-L207 WeakPolarHBondContact O-CB 3.25Å; A203-L207 PolarHBondContact O-N 2.91Å; A203-M222 HydrophobicContact CB-CE 3.87Å; A203-M222 HydrophobicContact CB-CG 4.32Å; A203-M222 HydrophobicContact CB-SD 3.96Å
204V95.7Very high93.2Very high73 Ų7375.6 Ų75.644%0.44240%0.404SS..Hα-helixtrans-63.2-40.9172.4167.60000110.8F200 D201 D206 L207 M222F200-V204 HydrophobicContact CD1-CG2 3.96Å; F200-V204 HydrophobicContact CE1-CG2 3.61Å; F200-V204 HydrophobicContact CZ-CG2 3.97Å; F200-V204 VanDerWaalsContact O-CG2 3.31Å; F200-V204 WeakPolarHBondContact O-CG2 3.35Å; F200-V204 PolarHBondContact O-N 2.83Å; D201-V204 PolarHBondContact O-N 3.03Å; V204-D206 PolarHBondContact O-N 3.27Å; V204-L207 PolarHBondContact O-N 2.9Å; V204-M222 HydrophobicContact CG2-CE 3.6Å
205A95.3Very high92.9Very high91 Ų9175.2 Ų75.275%0.75240%0.398SS*.Hα-helixtrans-64.8-24.5-179.800000113.6D201 A203D201-A205 PolarHBondContact O-N 3.5Å; A203-A205 VanDerWaalsContact C-N 3.32Å
206D93.9Very high92.7Very high49 Ų4980.1 Ų80.126%0.26242%0.418SS..THydrogen-bonded Turntrans-115.912-176.4-16423000112.5T167 D202 A203 V204 E208 T209T167-D206 HydrophobicContact CG2-CB 4.02Å; T167-D206 WeakPolarHBondContact CG2-O 3.4Å; D202-D206 PolarHBondContact O-N 3.37Å; A203-D206 PolarHBondContact O-N 3.24Å; V204-D206 PolarHBondContact O-N 3.27Å; D206-E208 PolarHBondContact O-N 3.25Å; D206-E208 VanDerWaalsContact O-N 3.16Å; D206-T209 VanDerWaalsContact CG-OG1 3.24Å; D206-T209 PolarHBondContact O-N 3.32Å; D206-T209 VanDerWaalsContact O-N 3.12Å; D206-T209 PolarHBondContact O-OG1 3.49Å; D206-T209 WeakPolarHBondContact OD1-CG2 3.48Å; D206-T209 PolarHBondContact OD1-OG1 2.97Å
207L90.3Very high92.5Very high52 Ų5281.5 Ų81.527%0.27243%0.425SS..G310 helixtrans-62.8-27.9-172.7-166.565.3000113.3A203 V204 T209 L210 T219 M222A203-L207 WeakPolarHBondContact O-CA 3.48Å; A203-L207 WeakPolarHBondContact O-CB 3.25Å; A203-L207 PolarHBondContact O-N 2.91Å; V204-L207 PolarHBondContact O-N 2.9Å; L207-T209 PolarHBondContact O-N 3.48Å; L207-L210 HydrophobicContact CD1-CD2 3.82Å; L207-L210 VanDerWaalsContact O-CB 3.26Å; L207-L210 WeakPolarHBondContact O-CB 3.4Å; L207-L210 PolarHBondContact O-N 3.48Å; L207-T219 HydrophobicContact CD1-CG2 4.47Å; L207-M222 HydrophobicContact CD1-CE 4.25Å; L207-M222 HydrophobicContact CD1-SD 3.92Å
208E88.6Confident92.3Very high200 Ų20075.7 Ų75.794%0.93540%0.4SS*.G310 helixtrans-67-19.1179.3-62.3-175.7174.500113.3D206D206-E208 PolarHBondContact O-N 3.25Å; D206-E208 VanDerWaalsContact O-N 3.16Å
209T83.7Confident92.2Very high94 Ų9473.3 Ų73.358%0.57739%0.392SS*.G310 helixtrans-90.1-3.618067.80000113.2D206 L207 S211D206-T209 VanDerWaalsContact CG-OG1 3.24Å; D206-T209 PolarHBondContact O-N 3.32Å; D206-T209 VanDerWaalsContact O-N 3.12Å; D206-T209 PolarHBondContact O-OG1 3.49Å; D206-T209 WeakPolarHBondContact OD1-CG2 3.48Å; D206-T209 PolarHBondContact OD1-OG1 2.97Å; L207-T209 PolarHBondContact O-N 3.48Å; T209-S211 PolarHBondContact O-N 2.92Å
210L86.9Confident92.1Very high25 Ų2577.2 Ų77.213%0.13141%0.41CS..  trans-70.4129.4-174.2-170.554.7000111.6L207 Y215L207-L210 HydrophobicContact CD1-CD2 3.82Å; L207-L210 VanDerWaalsContact O-CB 3.26Å; L207-L210 WeakPolarHBondContact O-CB 3.4Å; L207-L210 PolarHBondContact O-N 3.48Å; L210-Y215 HydrophobicContact CD2-CD2 3.88Å; L210-Y215 HydrophobicContact CD2-CG 4.4Å; L210-Y215 HydrophobicContact CG-CD2 4.29Å
211S87.3Confident92.1Very high60 Ų6075.3 Ų75.342%0.4240%0.402SS..  trans-69.1153.7175.2650000111.7T209 D213 S214 Y215T209-S211 PolarHBondContact O-N 2.92Å; S211-D213 PolarHBondContact O-N 3.37Å; S211-S214 PolarHBondContact O-N 2.94Å; S211-S214 PolarHBondContact OG-N 2.95Å; S211-Y215 WeakPolarHBondContact O-CB 3.14Å; S211-Y215 PolarHBondContact O-N 3.42Å
212E86.9Confident92.1Very high183 Ų18372.1 Ų72.186%0.85539%0.385SS*.Hα-helixtrans-57.6-38.3177.2-164.9172-176.600111.6S214 Y215E212-S214 PolarHBondContact O-N 3.19Å; E212-Y215 PolarHBondContact O-N 2.91Å
213D86Confident92.1Very high146 Ų14672.3 Ų72.378%0.78138%0.384SS*.Hα-helixtrans-64.1-35.9179.9-60.1-28.5000113.2S211S211-D213 PolarHBondContact O-N 3.37Å
214S89.5Confident92.1Very high33 Ų3374 Ų7423%0.23139%0.393CS..Hα-helixtrans-93.9-12.2179.8-65.80000113.4S211 E212 K216 D217 S218S211-S214 PolarHBondContact O-N 2.94Å; S211-S214 PolarHBondContact OG-N 2.95Å; E212-S214 PolarHBondContact O-N 3.19Å; S214-K216 PolarHBondContact O-N 3.48Å; S214-D217 PolarHBondContact O-N 3.31Å; S214-S218 PolarHBondContact O-N 2.78Å; S214-S218 PolarHBondContact O-OG 3.2Å
215Y90.6Very high92.2Very high121 Ų12170.6 Ų70.648%0.47537%0.372SS..Hα-helixtrans-56-49.8-171.1-172-90.1000112.9L210 S211 E212 D217 T219L210-Y215 HydrophobicContact CD2-CD2 3.88Å; L210-Y215 HydrophobicContact CD2-CG 4.4Å; L210-Y215 HydrophobicContact CG-CD2 4.29Å; S211-Y215 WeakPolarHBondContact O-CB 3.14Å; S211-Y215 PolarHBondContact O-N 3.42Å; E212-Y215 PolarHBondContact O-N 2.91Å; Y215-D217 VanDerWaalsContact C-N 3.34Å; Y215-D217 PolarHBondContact O-N 3.39Å; Y215-T219 HydrophobicContact CD1-CG2 4.23Å; Y215-T219 HydrophobicContact CD2-CG2 4.49Å; Y215-T219 HydrophobicContact CE1-CG2 3.93Å; Y215-T219 HydrophobicContact CE2-CG2 4.21Å; Y215-T219 WeakPolarHBondContact O-CB 3.3Å; Y215-T219 VanDerWaalsContact O-CG2 3.25Å; Y215-T219 WeakPolarHBondContact O-CG2 3.34Å; Y215-T219 PolarHBondContact O-N 3.45Å; Y215-T219 VanDerWaalsContact O-N 3.07Å; Y215-T219 PolarHBondContact O-OG1 3.02Å
216K92.7Very high92.3Very high143 Ų14372 Ų7262%0.62236%0.358SS*.Hα-helixtrans-61.7-43.6-177.6-175.6-172.4172.7-161.30111.8S214 T219 L220S214-K216 PolarHBondContact O-N 3.48Å; K216-T219 PolarHBondContact O-OG1 2.72Å; K216-L220 WeakPolarHBondContact O-CB 3.46Å; K216-L220 PolarHBondContact O-N 2.88Å; K216-L220 VanDerWaalsContact O-N 3.12Å
217D92.8Very high92.4Very high28 Ų2872.7 Ų72.715%0.1536%0.361CS..Hα-helixtrans-73.2-47.3-174.7-76-28.7000112.1P169 S214 Y215 T219 L220 I221 T257P169-D217 HydrophobicContact CB-CB 4.17Å; P169-D217 HydrophobicContact CG-CB 4.07Å; S214-D217 PolarHBondContact O-N 3.31Å; Y215-D217 VanDerWaalsContact C-N 3.34Å; Y215-D217 PolarHBondContact O-N 3.39Å; D217-T219 PolarHBondContact O-N 3.14Å; D217-L220 PolarHBondContact O-N 3.02Å; D217-I221 VanDerWaalsContact O-CG1 3.31Å; D217-I221 WeakPolarHBondContact O-CG1 3.16Å; D217-I221 PolarHBondContact O-N 3.28Å; D217-T257 HydrophobicContact CB-CG2 3.43Å; D217-T257 VanDerWaalsContact CB-CG2 3.43Å; D217-T257 VanDerWaalsContact CG-CB 3.46Å; D217-T257 VanDerWaalsContact OD2-CB 3.29Å; D217-T257 WeakPolarHBondContact OD2-CB 3.47Å
218S95.1Very high92.6Very high0 Ų070.2 Ų70.20%035%0.348CS..Hα-helixtrans-63.1-44.1178.2-61.60000111.7T167 P169 S214 L220 I221 M222T167-S218 WeakPolarHBondContact O-CB 3.45Å; T167-S218 PolarHBondContact O-OG 3.21Å; P169-S218 WeakPolarHBondContact CD-OG 3.49Å; P169-S218 WeakPolarHBondContact CG-OG 3.32Å; S214-S218 PolarHBondContact O-N 2.78Å; S214-S218 PolarHBondContact O-OG 3.2Å; S218-L220 VanDerWaalsContact C-N 3.34Å; S218-L220 PolarHBondContact O-N 3.47Å; S218-I221 PolarHBondContact O-N 2.98Å; S218-M222 WeakPolarHBondContact O-CB 3.5Å; S218-M222 VanDerWaalsContact O-CG 3.24Å; S218-M222 WeakPolarHBondContact O-CG 3.24Å; S218-M222 PolarHBondContact O-N 3.28Å
219T95Very high92.8Very high42 Ų4262 Ų6226%0.25831%0.311SS..Hα-helixtrans-65.8-35.917954.50000112.4L207 Y215 K216 D217 M222 Q223L207-T219 HydrophobicContact CD1-CG2 4.47Å; Y215-T219 HydrophobicContact CD1-CG2 4.23Å; Y215-T219 HydrophobicContact CD2-CG2 4.49Å; Y215-T219 HydrophobicContact CE1-CG2 3.93Å; Y215-T219 HydrophobicContact CE2-CG2 4.21Å; Y215-T219 WeakPolarHBondContact O-CB 3.3Å; Y215-T219 VanDerWaalsContact O-CG2 3.25Å; Y215-T219 WeakPolarHBondContact O-CG2 3.34Å; Y215-T219 PolarHBondContact O-N 3.45Å; Y215-T219 VanDerWaalsContact O-N 3.07Å; Y215-T219 PolarHBondContact O-OG1 3.02Å; K216-T219 PolarHBondContact O-OG1 2.72Å; D217-T219 PolarHBondContact O-N 3.14Å; T219-M222 PolarHBondContact O-N 3.36Å; T219-Q223 WeakPolarHBondContact O-CB 3.44Å; T219-Q223 PolarHBondContact O-N 3.13Å
220L96Very high93.3Very high98 Ų9860.7 Ų60.751%0.51330%0.303SS..Hα-helixtrans-61.6-44.7171.7178.162.2000111.4K216 D217 S218 Q223 L224K216-L220 WeakPolarHBondContact O-CB 3.46Å; K216-L220 PolarHBondContact O-N 2.88Å; K216-L220 VanDerWaalsContact O-N 3.12Å; D217-L220 PolarHBondContact O-N 3.02Å; S218-L220 VanDerWaalsContact C-N 3.34Å; S218-L220 PolarHBondContact O-N 3.47Å; L220-Q223 WeakPolarHBondContact O-CB 3.13Å; L220-Q223 PolarHBondContact O-N 2.73Å; L220-L224 WeakPolarHBondContact O-CG 3.42Å; L220-L224 PolarHBondContact O-N 3.2Å; L220-L224 VanDerWaalsContact O-N 3.12Å
221I97.3Very high93.5Very high7 Ų761.9 Ų61.94%0.03631%0.309CS..Hα-helixtrans-68.6-39.6179.4-61.1165.3000111.2P169 L172 L176 D217 S218 Q223 L224 L225 T257P169-I221 HydrophobicContact CB-CD1 4.08Å; P169-I221 VanDerWaalsContact O-CD1 3.27Å; P169-I221 WeakPolarHBondContact O-CD1 3.41Å; L172-I221 HydrophobicContact CB-CB 4.14Å; L172-I221 HydrophobicContact CB-CD1 4.44Å; L172-I221 HydrophobicContact CB-CG2 3.63Å; L176-I221 HydrophobicContact CB-CG2 4.25Å; L176-I221 HydrophobicContact CD2-CG2 3.96Å; D217-I221 VanDerWaalsContact O-CG1 3.31Å; D217-I221 WeakPolarHBondContact O-CG1 3.16Å; D217-I221 PolarHBondContact O-N 3.28Å; S218-I221 PolarHBondContact O-N 2.98Å; I221-Q223 VanDerWaalsContact C-N 3.27Å; I221-Q223 PolarHBondContact O-N 3.29Å; I221-L224 PolarHBondContact O-N 3.3Å; I221-L224 VanDerWaalsContact O-N 3.16Å; I221-L225 PolarHBondContact O-N 2.89Å; I221-T257 HydrophobicContact CD1-CG2 4.31Å
222M97Very high93.7Very high11 Ų1159 Ų595%0.05429%0.289CS..Hα-helixtrans-60.1-38.8173.7-70.4171.173.900111.8L172 F200 A203 V204 L207 S218 T219 L225 R226L172-M222 HydrophobicContact CD1-CG 3.94Å; L172-M222 HydrophobicContact CD1-SD 4.43Å; L172-M222 HydrophobicContact CD2-CG 4.08Å; F200-M222 HydrophobicContact CD2-CB 4.16Å; F200-M222 WeakPolarHBondContact CD2-O 3.31Å; F200-M222 HydrophobicContact CE2-CB 4.1Å; F200-M222 HydrophobicContact CE2-CE 4.45Å; F200-M222 WeakPolarHBondContact CE2-O 3.45Å; A203-M222 HydrophobicContact CB-CE 3.87Å; A203-M222 HydrophobicContact CB-CG 4.32Å; A203-M222 HydrophobicContact CB-SD 3.96Å; V204-M222 HydrophobicContact CG2-CE 3.6Å; L207-M222 HydrophobicContact CD1-CE 4.25Å; L207-M222 HydrophobicContact CD1-SD 3.92Å; S218-M222 WeakPolarHBondContact O-CB 3.5Å; S218-M222 VanDerWaalsContact O-CG 3.24Å; S218-M222 WeakPolarHBondContact O-CG 3.24Å; S218-M222 PolarHBondContact O-N 3.28Å; T219-M222 PolarHBondContact O-N 3.36Å; M222-L225 WeakPolarHBondContact O-CB 3.39Å; M222-L225 PolarHBondContact O-N 3Å; M222-R226 PolarHBondContact O-N 3.43Å
223Q96.8Very high93.7Very high62 Ų6253.3 Ų53.329%0.2927%0.266SS..Hα-helixtrans-60.3-46.4173.5176.65638.800111.4T219 L220 I221 L225 R226 D227T219-Q223 WeakPolarHBondContact O-CB 3.44Å; T219-Q223 PolarHBondContact O-N 3.13Å; L220-Q223 WeakPolarHBondContact O-CB 3.13Å; L220-Q223 PolarHBondContact O-N 2.73Å; I221-Q223 VanDerWaalsContact C-N 3.27Å; I221-Q223 PolarHBondContact O-N 3.29Å; Q223-L225 PolarHBondContact O-N 2.78Å; Q223-R226 WeakPolarHBondContact O-CB 3.43Å; Q223-R226 PolarHBondContact O-N 3.22Å; Q223-D227 PolarHBondContact NE2-OD1 3.21Å; Q223-D227 PolarHBondContact NE2-OD2 3.4Å; Q223-D227 PolarHBondContact O-N 3.25Å
224L97.4Very high93.5Very high37 Ų3750.9 Ų50.919%0.19425%0.253CS..Hα-helixtrans-64.1-38.2177.4-62.4176.5000112.7L176 L220 I221 R226 D227 N228 P252L176-L224 HydrophobicContact CD1-CB 4.3Å; L176-L224 HydrophobicContact CD2-CB 3.56Å; L176-L224 HydrophobicContact CD2-CD1 3.79Å; L176-L224 HydrophobicContact CD2-CG 4.34Å; L220-L224 WeakPolarHBondContact O-CG 3.42Å; L220-L224 PolarHBondContact O-N 3.2Å; L220-L224 VanDerWaalsContact O-N 3.12Å; I221-L224 PolarHBondContact O-N 3.3Å; I221-L224 VanDerWaalsContact O-N 3.16Å; L224-R226 VanDerWaalsContact C-N 3.35Å; L224-D227 PolarHBondContact O-N 3.21Å; L224-N228 PolarHBondContact O-N 3.42Å; L224-P252 HydrophobicContact CB-CB 4.41Å; L224-P252 HydrophobicContact CD2-CB 3.82Å; L224-P252 HydrophobicContact CD2-CG 4.15Å; L224-P252 HydrophobicContact CG-CB 4.5Å
225L97.5Very high92.7Very high0 Ų051.1 Ų51.10%025%0.252CS..Hα-helixtrans-59.1-45.9172.9-78.7167.2000111.5L172 L176 A196 A199 F200 I221 M222 Q223 D227 N228 L229L172-L225 HydrophobicContact CD2-CD1 3.99Å; L176-L225 HydrophobicContact CB-CD2 3.9Å; L176-L225 HydrophobicContact CB-CG 4.19Å; L176-L225 HydrophobicContact CD1-CD2 3.92Å; L176-L225 HydrophobicContact CD1-CG 4.16Å; A196-L225 HydrophobicContact CB-CD2 3.82Å; A199-L225 HydrophobicContact CB-CD1 4.34Å; F200-L225 HydrophobicContact CD2-CB 4.45Å; I221-L225 PolarHBondContact O-N 2.89Å; M222-L225 WeakPolarHBondContact O-CB 3.39Å; M222-L225 PolarHBondContact O-N 3Å; Q223-L225 PolarHBondContact O-N 2.78Å; L225-D227 VanDerWaalsContact C-N 3.34Å; L225-D227 PolarHBondContact O-N 3.19Å; L225-N228 PolarHBondContact O-N 3.38Å; L225-L229 WeakPolarHBondContact O-CG 3.39Å; L225-L229 PolarHBondContact O-N 2.86Å
226R96.3Very high91.6Very high122 Ų12249.5 Ų49.546%0.4626%0.258SS..Hα-helixtrans-63-40.8176.9-171.9-173.774.5-169.75.1112.2F200 M222 Q223 L224 N228 L229 T230F200-R226 HydrophobicContact CD2-CB 4.41Å; F200-R226 HydrophobicContact CE2-CB 4.01Å; M222-R226 PolarHBondContact O-N 3.43Å; Q223-R226 WeakPolarHBondContact O-CB 3.43Å; Q223-R226 PolarHBondContact O-N 3.22Å; L224-R226 VanDerWaalsContact C-N 3.35Å; R226-N228 VanDerWaalsContact C-N 3.35Å; R226-L229 PolarHBondContact O-N 3.31Å; R226-T230 PolarHBondContact O-N 3.45Å; R226-T230 PolarHBondContact O-OG1 3.18Å
227D95.9Very high90.1Very high62 Ų6250.6 Ų50.633%0.33227%0.266SS..Hα-helixtrans-66.2-39.8179.9-64.6-13.8000110.8Q223 L224 L225 T230 L231Q223-D227 PolarHBondContact NE2-OD1 3.21Å; Q223-D227 PolarHBondContact NE2-OD2 3.4Å; Q223-D227 PolarHBondContact O-N 3.25Å; L224-D227 PolarHBondContact O-N 3.21Å; L225-D227 VanDerWaalsContact C-N 3.34Å; L225-D227 PolarHBondContact O-N 3.19Å; D227-T230 PolarHBondContact O-N 3.46Å; D227-L231 WeakPolarHBondContact O-CB 3.34Å; D227-L231 PolarHBondContact O-N 3.14Å
228N94.4Very high88.3Confident0 Ų051.2 Ų51.20%028%0.275CS..Hα-helixtrans-61.3-46.6171.7-80.1-3.4000112.8L176 L224 L225 R226 T230 L231 W232 A251 P252L176-N228 WeakPolarHBondContact CD1-ND2 3.44Å; L224-N228 PolarHBondContact O-N 3.42Å; L225-N228 PolarHBondContact O-N 3.38Å; R226-N228 VanDerWaalsContact C-N 3.35Å; N228-T230 VanDerWaalsContact C-N 3.3Å; N228-T230 PolarHBondContact O-N 3.47Å; N228-L231 PolarHBondContact O-N 3.21Å; N228-W232 HydrophobicContact CB-CD2 4.32Å; N228-W232 HydrophobicContact CB-CE3 4.11Å; N228-W232 HydrophobicContact CB-CH2 3.8Å; N228-W232 HydrophobicContact CB-CZ2 4.03Å; N228-W232 HydrophobicContact CB-CZ3 3.83Å; N228-W232 WeakPolarHBondContact O-CB 3.47Å; N228-W232 VanDerWaalsContact O-CD2 3.24Å; N228-W232 PolarHBondContact O-N 2.99Å; N228-A251 WeakPolarHBondContact OD1-CA 3.38Å; N228-A251 VanDerWaalsContact OD1-CB 3.25Å; N228-A251 WeakPolarHBondContact OD1-CB 3.38Å; N228-P252 PolarHBondContact ND2-O 3.1Å; N228-P252 WeakPolarHBondContact OD1-CD 3.49Å; N228-P252 WeakPolarHBondContact OD1-CG 3.36Å; N228-P252 VanDerWaalsContact OD1-N 3.14Å
229L94.7Very high85.9Confident29 Ų2957.3 Ų57.315%0.15231%0.314CS..Hα-helixtrans-57.2-47.1178-75.1168.1000111C193 A196 K197 L225 R226 W232 T233C193-L229 HydrophobicContact CB-CD2 4.09Å; C193-L229 WeakPolarHBondContact O-CD2 3.38Å; A196-L229 HydrophobicContact CB-CD1 4.43Å; A196-L229 HydrophobicContact CB-CD2 3.87Å; A196-L229 HydrophobicContact CB-CG 4Å; K197-L229 HydrophobicContact CB-CD1 4.13Å; K197-L229 HydrophobicContact CB-CD2 4.06Å; L225-L229 WeakPolarHBondContact O-CG 3.39Å; L225-L229 PolarHBondContact O-N 2.86Å; R226-L229 PolarHBondContact O-N 3.31Å; L229-W232 PolarHBondContact O-N 3.02Å; L229-T233 WeakPolarHBondContact O-CG2 3.34Å; L229-T233 PolarHBondContact O-N 2.88Å; L229-T233 PolarHBondContact O-OG1 3.32Å
230T93.5Very high83.6Confident66 Ų6660.1 Ų60.141%0.40534%0.342SS..Hα-helixtrans-59.9-48.6178.1-51.80000110.8R226 D227 N228 W232 T233 D234R226-T230 PolarHBondContact O-N 3.45Å; R226-T230 PolarHBondContact O-OG1 3.18Å; D227-T230 PolarHBondContact O-N 3.46Å; N228-T230 VanDerWaalsContact C-N 3.3Å; N228-T230 PolarHBondContact O-N 3.47Å; T230-W232 VanDerWaalsContact C-N 3.34Å; T230-W232 PolarHBondContact O-N 3.47Å; T230-T233 PolarHBondContact O-N 2.86Å; T230-T233 PolarHBondContact O-OG1 3.23Å; T230-D234 WeakPolarHBondContact O-CB 3.48Å; T230-D234 PolarHBondContact O-N 3.47Å
231L91.4Very high81.2Confident49 Ų4956.4 Ų56.426%0.25733%0.325SS..Hα-helixtrans-58.1-45.4-180-17665.2000112.4D227 N228 L235D227-L231 WeakPolarHBondContact O-CB 3.34Å; D227-L231 PolarHBondContact O-N 3.14Å; N228-L231 PolarHBondContact O-N 3.21Å; L231-L235 HydrophobicContact CD1-CD1 4.44Å; L231-L235 HydrophobicContact CG-CD1 4.23Å; L231-L235 WeakPolarHBondContact O-CD1 3.37Å; L231-L235 VanDerWaalsContact O-CG 3.24Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.11Å
232W91.7Very high78.6Confident0 Ų060.2 Ų60.20%035%0.349CS..Hα-helixtrans-77-31.7-175.8-60.4-28.1000113.2S179 V180 Y183 A192 A196 N228 L229 T230 S236 A251S179-W232 WeakPolarHBondContact OG-CH2 3.2Å; V180-W232 HydrophobicContact CG2-CH2 4.3Å; V180-W232 HydrophobicContact CG2-CZ2 4.23Å; Y183-W232 HydrophobicContact CD1-CZ2 4.42Å; Y183-W232 AromaticContact CD1-NE1 3.45Å; Y183-W232 HydrophobicContact CD2-CB 4.3Å; Y183-W232 AromaticContact CD2-CD1 3.49Å; Y183-W232 VanDerWaalsContact CD2-CD1 3.49Å; Y183-W232 AromaticContact CD2-CD2 3.72Å; Y183-W232 HydrophobicContact CD2-CD2 3.72Å; Y183-W232 AromaticContact CD2-CE2 3.64Å; Y183-W232 AromaticContact CD2-CG 3.6Å; Y183-W232 HydrophobicContact CD2-CG 3.6Å; Y183-W232 HydrophobicContact CD2-CZ2 4.35Å; Y183-W232 AromaticContact CD2-NE1 3.48Å; Y183-W232 AromaticContact CE1-CD1 3.73Å; Y183-W232 AromaticContact CE1-NE1 3.53Å; Y183-W232 HydrophobicContact CE2-CB 3.91Å; Y183-W232 AromaticContact CE2-CD1 3.14Å; Y183-W232 HydrophobicContact CE2-CD2 4.1Å; Y183-W232 AromaticContact CE2-CG 3.46Å; Y183-W232 HydrophobicContact CE2-CG 3.46Å; Y183-W232 VanDerWaalsContact CE2-CG 3.46Å; Y183-W232 AromaticContact CE2-NE1 3.57Å; Y183-W232 AromaticContact CG-CD1 3.93Å; Y183-W232 HydrophobicContact CG-CD2 4.15Å; Y183-W232 AromaticContact CG-CE2 3.58Å; Y183-W232 HydrophobicContact CG-CG 4.32Å; Y183-W232 AromaticContact CG-CZ2 3.93Å; Y183-W232 HydrophobicContact CG-CZ2 3.93Å; Y183-W232 AromaticContact CG-NE1 3.43Å; Y183-W232 AromaticContact CZ-CD1 3.27Å; Y183-W232 AromaticContact CZ-NE1 3.59Å; A192-W232 HydrophobicContact CB-CE3 4.14Å; A192-W232 HydrophobicContact CB-CH2 4.22Å; A192-W232 HydrophobicContact CB-CZ3 3.85Å; A196-W232 HydrophobicContact CB-CZ3 4.29Å; N228-W232 HydrophobicContact CB-CD2 4.32Å; N228-W232 HydrophobicContact CB-CE3 4.11Å; N228-W232 HydrophobicContact CB-CH2 3.8Å; N228-W232 HydrophobicContact CB-CZ2 4.03Å; N228-W232 HydrophobicContact CB-CZ3 3.83Å; N228-W232 WeakPolarHBondContact O-CB 3.47Å; N228-W232 VanDerWaalsContact O-CD2 3.24Å; N228-W232 PolarHBondContact O-N 2.99Å; L229-W232 PolarHBondContact O-N 3.02Å; T230-W232 VanDerWaalsContact C-N 3.34Å; T230-W232 PolarHBondContact O-N 3.47Å; W232-S236 PolarHBondContact O-N 3.34Å; W232-S236 PolarHBondContact O-OG 2.81Å; W232-A251 HydrophobicContact CH2-CB 4.39Å; W232-A251 HydrophobicContact CZ2-CB 3.32Å
233T86.5Confident76.2Confident63 Ų6367 Ų6739%0.38738%0.38SS..Hα-helixtrans-70-43173.451.90000111.4L229 T230 L235 S236 E237L229-T233 WeakPolarHBondContact O-CG2 3.34Å; L229-T233 PolarHBondContact O-N 2.88Å; L229-T233 PolarHBondContact O-OG1 3.32Å; T230-T233 PolarHBondContact O-N 2.86Å; T230-T233 PolarHBondContact O-OG1 3.23Å; T233-L235 VanDerWaalsContact C-N 3.32Å; T233-L235 PolarHBondContact O-N 3.17Å; T233-S236 WeakPolarHBondContact O-CB 3.39Å; T233-S236 PolarHBondContact O-N 2.88Å; T233-S236 VanDerWaalsContact O-N 3.09Å; T233-E237 PolarHBondContact O-N 2.96Å
234D81.9Confident73.5Confident95 Ų9571.1 Ų71.151%0.50840%0.4SS..Hα-helixtrans-62.6-40.1179.6-69.7-4.7000111.6T230 S236 E237 A238T230-D234 WeakPolarHBondContact O-CB 3.48Å; T230-D234 PolarHBondContact O-N 3.47Å; D234-S236 VanDerWaalsContact C-N 3.3Å; D234-S236 PolarHBondContact O-N 2.64Å; D234-E237 PolarHBondContact O-N 3.26Å; D234-A238 PolarHBondContact O-N 2.72Å
235L73.2Confident70.9Confident38 Ų3874.2 Ų74.220%0.19941%0.413CS..Hα-helixtrans-67.7-28.7175.6-71.8169.3000113.3Y183 L231 T233 E237 S249Y183-L235 VanDerWaalsContact OH-CD1 3.32Å; Y183-L235 WeakPolarHBondContact OH-CD1 3.44Å; L231-L235 HydrophobicContact CD1-CD1 4.44Å; L231-L235 HydrophobicContact CG-CD1 4.23Å; L231-L235 WeakPolarHBondContact O-CD1 3.37Å; L231-L235 VanDerWaalsContact O-CG 3.24Å; L231-L235 WeakPolarHBondContact O-CG 3.48Å; L231-L235 PolarHBondContact O-N 3.11Å; T233-L235 VanDerWaalsContact C-N 3.32Å; T233-L235 PolarHBondContact O-N 3.17Å; L235-E237 VanDerWaalsContact C-N 3.33Å; L235-S249 WeakPolarHBondContact CD1-OG 3.44Å
236S66.3Low68.3Low87 Ų8779.1 Ų79.161%0.60844%0.436SS*.Hα-helixtrans-75.5-24.5177.2-58.30000112.2W232 T233 D234W232-S236 PolarHBondContact O-N 3.34Å; W232-S236 PolarHBondContact O-OG 2.81Å; T233-S236 WeakPolarHBondContact O-CB 3.39Å; T233-S236 PolarHBondContact O-N 2.88Å; T233-S236 VanDerWaalsContact O-N 3.09Å; D234-S236 VanDerWaalsContact C-N 3.3Å; D234-S236 PolarHBondContact O-N 2.64Å
237E62Low65.8Low167 Ų16778.6 Ų78.678%0.7844%0.439SS*.Hα-helixtrans-90.7-16.6177.9-66.7-173.9-17800113.6T233 D234 L235T233-E237 PolarHBondContact O-N 2.96Å; D234-E237 PolarHBondContact O-N 3.26Å; L235-E237 VanDerWaalsContact C-N 3.33Å
238A54.6Low63.5Low41 Ų4180.2 Ų80.234%0.33946%0.455SS..SBendtrans-72.4136.2176.400000111.7D234 A240D234-A238 PolarHBondContact O-N 2.72Å; A238-A240 PolarHBondContact O-N 3.5Å
239P44.4Very low61.4Low128 Ų12881.3 Ų81.383%0.83146%0.462SS*.SBendtrans-61115.7174.622.7-30.4000109.9A241P239-A241 PolarHBondContact O-N 3.43Å
240A47.8Very low60Low101 Ų10184.4 Ų84.484%0.83548%0.476SS*.  trans14.675.4177.200000113.9A238 T242A238-A240 PolarHBondContact O-N 3.5Å; A240-T242 PolarHBondContact O-N 2.9Å
241A44Very low59.2Low19 Ų1981.6 Ų81.616%0.15746%0.46CS..  trans-52.6132.2169.700000109.5P239 Q245P239-A241 PolarHBondContact O-N 3.43Å; A241-Q245 HydrophobicContact CB-CB 3.95Å
242T43.5Very low58.5Low88 Ų8881.5 Ų81.554%0.5446%0.462SS..  trans-58.5151.6173.9400000110.2A240 E244 Q245A240-T242 PolarHBondContact O-N 2.9Å; T242-E244 PolarHBondContact O-N 3.39Å; T242-Q245 PolarHBondContact O-N 2.95Å
243E45.9Very low57.8Low153 Ų15382.9 Ų82.972%0.71547%0.473SS*.Hα-helixtrans-48-28.8178.9-69.7179.7165.500113Q245 Q246 Q247E243-Q245 PolarHBondContact O-N 3.37Å; E243-Q246 PolarHBondContact O-N 2.89Å; E243-Q247 WeakPolarHBondContact O-CG 3.45Å; E243-Q247 PolarHBondContact O-N 3.25Å
244E40.6Very low57.2Low149 Ų14980.6 Ų80.670%0.69646%0.461SS*.Hα-helixtrans-61.1-37.1174.4-65.1-176.9163.400114.2T242 S248T242-E244 PolarHBondContact O-N 3.39Å; E244-S248 WeakPolarHBondContact O-CB 3.35Å; E244-S248 PolarHBondContact O-N 3.42Å
245Q43.8Very low56.3Low101 Ų10182.2 Ų82.247%0.47247%0.466SS..Hα-helixtrans-73.8-41179.9-78.2-178.4-5.600111.5A241 T242 E243 Q247 S248 S249A241-Q245 HydrophobicContact CB-CB 3.95Å; T242-Q245 PolarHBondContact O-N 2.95Å; E243-Q245 PolarHBondContact O-N 3.37Å; Q245-Q247 VanDerWaalsContact C-N 3.31Å; Q245-Q247 PolarHBondContact O-N 2.88Å; Q245-S248 PolarHBondContact O-N 3.18Å; Q245-S248 PolarHBondContact O-OG 3.49Å; Q245-S249 PolarHBondContact O-N 2.99Å; Q245-S249 PolarHBondContact O-OG 3.29Å
246Q43.2Very low55Low103 Ų10382.1 Ų82.148%0.48147%0.467SS..Hα-helixtrans-63.9-33.6177.7-70.5-178.7-11.300112.8E243E243-Q246 PolarHBondContact O-N 2.89Å
247Q43.8Very low54Low112 Ų11279.5 Ų79.552%0.52345%0.447SS..Hα-helixtrans-77.3-25.5176-69.7-178.911.500113.3E243 Q245E243-Q247 WeakPolarHBondContact O-CG 3.45Å; E243-Q247 PolarHBondContact O-N 3.25Å; Q245-Q247 VanDerWaalsContact C-N 3.31Å; Q245-Q247 PolarHBondContact O-N 2.88Å
248S45.7Very low52.9Low95 Ų9579.4 Ų79.466%0.66445%0.447SS*.Hα-helixtrans-80.3-27.2-175.977.70000114.1E244 Q245 Q250E244-S248 WeakPolarHBondContact O-CB 3.35Å; E244-S248 PolarHBondContact O-N 3.42Å; Q245-S248 PolarHBondContact O-N 3.18Å; Q245-S248 PolarHBondContact O-OG 3.49Å; S248-Q250 PolarHBondContact O-N 3.28Å
249S52.1Low52Low23 Ų2379.7 Ų79.716%0.16145%0.454CS..  trans-9881.7-17758.90000111.3L235 Q245L235-S249 WeakPolarHBondContact CD1-OG 3.44Å; Q245-S249 PolarHBondContact O-N 2.99Å; Q245-S249 PolarHBondContact O-OG 3.29Å
250Q63.6Low51.3Low94 Ų9482.1 Ų82.144%0.43945%0.452SS..PPolyproline II helixtrans-75.4132.2175.5-82.9170.92600111.2S248S248-Q250 PolarHBondContact O-N 3.28Å
251A76.6Confident50.6Low8 Ų880.4 Ų80.47%0.06644%0.437CS..PPolyproline II helixtrans-72.2129.717300000109.8V180 N228 W232 A253V180-A251 HydrophobicContact CG2-CB 3.92Å; N228-A251 WeakPolarHBondContact OD1-CA 3.38Å; N228-A251 VanDerWaalsContact OD1-CB 3.25Å; N228-A251 WeakPolarHBondContact OD1-CB 3.38Å; W232-A251 HydrophobicContact CH2-CB 4.39Å; W232-A251 HydrophobicContact CZ2-CB 3.32Å; A251-A253 PolarHBondContact O-N 3.39Å
252P77.2Confident49.8Very low46 Ų4686.7 Ų86.730%0.29947%0.468SS..PPolyproline II helixtrans-51.8140.9168.415.3-30.5000112.7L176 V180 L224 N228L176-P252 WeakPolarHBondContact CD1-O 3.46Å; V180-P252 WeakPolarHBondContact CG2-O 3.14Å; L224-P252 HydrophobicContact CB-CB 4.41Å; L224-P252 HydrophobicContact CD2-CB 3.82Å; L224-P252 HydrophobicContact CD2-CG 4.15Å; L224-P252 HydrophobicContact CG-CB 4.5Å; N228-P252 PolarHBondContact ND2-O 3.1Å; N228-P252 WeakPolarHBondContact OD1-CD 3.49Å; N228-P252 WeakPolarHBondContact OD1-CG 3.36Å; N228-P252 VanDerWaalsContact OD1-N 3.14Å
253A77.1Confident49.2Very low29 Ų2991.8 Ų91.824%0.2449%0.486CS..  trans-113.8152.8171.200000109.5N177 A251 Q255N177-A253 WeakPolarHBondContact OD1-CB 3.41Å; A251-A253 PolarHBondContact O-N 3.39Å; A253-Q255 PolarHBondContact O-N 3.44Å
254A74.5Confident48.6Very low15 Ų1596.9 Ų96.912%0.12451%0.51CS..PPolyproline II helixtrans-59.2127.9177.900000110.5L176 N177L176-A254 HydrophobicContact CB-CB 4.3Å; L176-A254 HydrophobicContact CD2-CB 3.8Å; L176-A254 HydrophobicContact CG-CB 4.28Å; N177-A254 WeakPolarHBondContact OD1-CB 3.43Å; N177-A254 PolarHBondContact OD1-N 3.12Å
255Q61.9Low49Very low130 Ų13094.3 Ų94.361%0.60750%0.501SS*.PPolyproline II helixtrans-89.9150.4164.8-60.2-166.418.300108.6A253 T257A253-Q255 PolarHBondContact O-N 3.44Å; Q255-T257 PolarHBondContact O-N 3.32Å
256P46.3Very low49.3Very low36 Ų3693.9 Ų93.923%0.23450%0.502CS..PPolyproline II helixtrans-55.3137.3171-19.831.3000109.5S47 K51 E258S47-P256 WeakPolarHBondContact OG-CG 3.4Å; K51-P256 HydrophobicContact CD-CG 4.15Å; P256-E258 PolarHBondContact O-N 3.2Å
257T46.1Very low49.6Very low31 Ų3193.4 Ų93.419%0.1950%0.503CS..  trans-64.5115.7172.149.40000108.4P169 D217 I221 Q255 G259P169-T257 HydrophobicContact CB-CG2 3.81Å; D217-T257 HydrophobicContact CB-CG2 3.43Å; D217-T257 VanDerWaalsContact CB-CG2 3.43Å; D217-T257 VanDerWaalsContact CG-CB 3.46Å; D217-T257 VanDerWaalsContact OD2-CB 3.29Å; D217-T257 WeakPolarHBondContact OD2-CB 3.47Å; I221-T257 HydrophobicContact CD1-CG2 4.31Å; Q255-T257 PolarHBondContact O-N 3.32Å; T257-G259 PolarHBondContact O-N 2.98Å
258E37.7Very low49.9Very low165 Ų16592.3 Ų92.377%0.77150%0.502SS*.  trans-66.482.8163.5-73.1175-170.600107P256 K260P256-E258 PolarHBondContact O-N 3.2Å; E258-K260 VanDerWaalsContact C-N 3.31Å; E258-K260 PolarHBondContact O-N 3.36Å
259G35.6Very low50.2Low48 Ų4892.1 Ų92.150%0.49549%0.492SS..  trans-56.910815700000104.8T257 A261T257-G259 PolarHBondContact O-N 2.98Å; G259-A261 PolarHBondContact O-N 2.76Å
260K30.5Very low50.1Low178 Ų17896.7 Ų96.777%0.77451%0.514SS*.  trans-50.7113.3177.8-77.4-178.1174.1-178.60106.6E258 D262E258-K260 VanDerWaalsContact C-N 3.31Å; E258-K260 PolarHBondContact O-N 3.36Å; K260-D262 PolarHBondContact O-N 3.13Å; K260-D262 VanDerWaalsContact O-N 3.11Å
261A32.9Very low49.1Very low65 Ų6596.9 Ų96.954%0.53752%0.519SS..  trans-59.6116.1158.800000104.8G259 Q263G259-A261 PolarHBondContact O-N 2.76Å; A261-Q263 PolarHBondContact O-N 2.95Å
262D28.2Very low47Very low151 Ų151103.8 Ų103.881%0.80755%0.554SS**  trans-48.5113175.9-76-45.8000108.2K260 E264K260-D262 PolarHBondContact O-N 3.13Å; K260-D262 VanDerWaalsContact O-N 3.11Å; D262-E264 PolarHBondContact O-N 3.02Å
263Q29.3Very low44.5Very low195 Ų195108.6 Ų108.691%0.91158%0.575SS**  trans-75.198.3162.7-71.7-177.714.300105.4A261A261-Q263 PolarHBondContact O-N 2.95Å
264E33.4Very low41.5Very low260 Ų260115.8 Ų115.8100%1.21561%0.606SS**  trans-65.60153.5-72-170.5150.200110.5D262D262-E264 PolarHBondContact O-N 3.02Å

Retrieved 264 of 264 residues in 468.5 ms (Link to these results)

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