A0A087X3X6_POEFO Loading...

14-3-3 protein epsilon

AlphaFold DB , UniProt , Accession A0A087X3X6, Species POEFO (Poecilia formosa, Amazon molly), Gene YWHAE, Length 253 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
1M60.2Low89.6Confident195 Ų19582.3 Ų82.396%0.96141%0.412SS*.  0-64.50-67.9179.7-158.700110.5D3 R4 E5M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.4Å; M1-R4 PolarHBondContact O-N 2.92Å; M1-R4 VanDerWaalsContact O-N 3.08Å; M1-E5 PolarHBondContact O-N 3.35Å
2A71.4Confident90.3Very high67 Ų6780.9 Ų80.955%0.55440%0.402SS*.Hα-helixtrans-54.4-39.6178.700000114.5N6A2-N6 WeakPolarHBondContact O-CB 3.35Å; A2-N6 PolarHBondContact O-N 3.41Å; A2-N6 PolarHBondContact O-ND2 3.05Å
3D88.6Confident90.8Very high109 Ų10981.6 Ų81.658%0.58341%0.407SS*.Hα-helixtrans-70.3-35.9179.2-160.341.6000113.1M1 N6 L7M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.4Å; D3-N6 PolarHBondContact O-N 3.42Å; D3-L7 VanDerWaalsContact O-CG 3.3Å; D3-L7 WeakPolarHBondContact O-CG 3.43Å; D3-L7 PolarHBondContact O-N 3.04Å
4R93.4Very high91.3Very high40 Ų4076.6 Ų76.615%0.15139%0.385CS..Hα-helixtrans-65.7-47.7174.9-173.6174.9175.7163.5-2.8110.9M1 N6 L7 V8 V30 M33 E36 E41M1-R4 PolarHBondContact O-N 2.92Å; M1-R4 VanDerWaalsContact O-N 3.08Å; R4-N6 VanDerWaalsContact C-N 3.31Å; R4-N6 PolarHBondContact O-N 3.42Å; R4-L7 PolarHBondContact O-N 3.38Å; R4-V8 WeakPolarHBondContact O-CG2 3.36Å; R4-V8 PolarHBondContact O-N 3.06Å; R4-V30 HydrophobicContact CG-CG1 4.1Å; R4-M33 HydrophobicContact CB-CE 4.19Å; R4-M33 HydrophobicContact CB-SD 3.73Å; R4-M33 HydrophobicContact CG-SD 3.95Å; R4-E36 PolarHBondContact NH2-O 3.14Å; R4-E41 IonicContact CZ-OE1 3.76Å; R4-E41 IonicContact CZ-OE2 2.91Å; R4-E41 IonicContact NE-OE1 2.78Å; R4-E41 PolarHBondContact NE-OE1 3.08Å; R4-E41 IonicContact NE-OE2 2.72Å; R4-E41 VanDerWaalsContact NH2-CD 3.31Å; R4-E41 IonicContact NH2-OE1 2.66Å; R4-E41 PolarHBondContact NH2-OE1 3.28Å; R4-E41 IonicContact NH2-OE2 3.66Å; R4-E41 PolarHBondContact NH2-OE2 3.34Å
5E93.8Very high91.6Very high133 Ų13375.4 Ų75.462%0.62138%0.377SS*.Hα-helixtrans-61.4-40.1177.7-71173-174.600111.8M1 V8 Y9M1-E5 PolarHBondContact O-N 3.35Å; E5-V8 PolarHBondContact O-N 3.34Å; E5-Y9 WeakPolarHBondContact O-CB 3.49Å; E5-Y9 PolarHBondContact O-N 3.25Å
6N95.4Very high91.9Very high96 Ų9680.6 Ų80.651%0.51340%0.4SS..Hα-helixtrans-62.3-43.5175-72.8-19.9000112.2A2 D3 R4 Y9 Q10A2-N6 WeakPolarHBondContact O-CB 3.35Å; A2-N6 PolarHBondContact O-N 3.41Å; A2-N6 PolarHBondContact O-ND2 3.05Å; D3-N6 PolarHBondContact O-N 3.42Å; R4-N6 VanDerWaalsContact C-N 3.31Å; R4-N6 PolarHBondContact O-N 3.42Å; N6-Y9 PolarHBondContact O-N 3.27Å; N6-Q10 WeakPolarHBondContact O-CB 3.32Å; N6-Q10 VanDerWaalsContact O-CG 3.31Å; N6-Q10 WeakPolarHBondContact O-CG 3.48Å; N6-Q10 PolarHBondContact O-N 3.5Å
7L96.4Very high92.2Very high11 Ų1179.4 Ų79.46%0.05841%0.406CS..Hα-helixtrans-64.6-42.1177.2-72.1165.8000112D3 R4 Y9 Q10 A11 K29 V30 M33D3-L7 VanDerWaalsContact O-CG 3.3Å; D3-L7 WeakPolarHBondContact O-CG 3.43Å; D3-L7 PolarHBondContact O-N 3.04Å; R4-L7 PolarHBondContact O-N 3.38Å; L7-Y9 VanDerWaalsContact C-N 3.34Å; L7-Q10 PolarHBondContact O-N 3.34Å; L7-A11 PolarHBondContact O-N 2.69Å; L7-K29 HydrophobicContact CD1-CB 3.65Å; L7-K29 HydrophobicContact CD2-CB 4.03Å; L7-K29 HydrophobicContact CD2-CD 3.63Å; L7-K29 HydrophobicContact CD2-CG 4.5Å; L7-K29 HydrophobicContact CG-CB 4.47Å; L7-V30 HydrophobicContact CB-CG2 3.54Å; L7-V30 HydrophobicContact CD1-CG2 4.12Å; L7-V30 HydrophobicContact CG-CG2 4.49Å; L7-M33 HydrophobicContact CD1-CE 3.53Å
8V96.6Very high92.4Very high12 Ų1283.2 Ų83.27%0.07342%0.422CS..Hα-helixtrans-63.7-41.8175.3173.30000110.8R4 E5 A11 K12 V30 E41 L44R4-V8 WeakPolarHBondContact O-CG2 3.36Å; R4-V8 PolarHBondContact O-N 3.06Å; E5-V8 PolarHBondContact O-N 3.34Å; V8-A11 PolarHBondContact O-N 3.12Å; V8-K12 WeakPolarHBondContact O-CG 3.01Å; V8-K12 PolarHBondContact O-N 3.47Å; V8-V30 HydrophobicContact CG2-CG1 4.39Å; V8-V30 HydrophobicContact CG2-CG2 3.99Å; V8-E41 HydrophobicContact CG2-CG 3.8Å; V8-L44 HydrophobicContact CG1-CD1 3.88Å
9Y96.4Very high92.7Very high145 Ų14586.4 Ų86.457%0.56943%0.428SS*.Hα-helixtrans-64.6-40.7175.9-172.7-107.3000112.2E5 N6 L7 A11 K12 L13E5-Y9 WeakPolarHBondContact O-CB 3.49Å; E5-Y9 PolarHBondContact O-N 3.25Å; N6-Y9 PolarHBondContact O-N 3.27Å; L7-Y9 VanDerWaalsContact C-N 3.34Å; Y9-A11 PolarHBondContact O-N 3.32Å; Y9-K12 PolarHBondContact O-N 3.44Å; Y9-L13 HydrophobicContact CD1-CD1 3.96Å; Y9-L13 HydrophobicContact CD1-CG 4.33Å; Y9-L13 HydrophobicContact CE1-CD1 3.64Å; Y9-L13 HydrophobicContact CE1-CD2 4.35Å; Y9-L13 HydrophobicContact CE1-CG 4.05Å; Y9-L13 WeakPolarHBondContact O-CG 3.27Å; Y9-L13 PolarHBondContact O-N 3.06Å
10Q96.5Very high92.9Very high97 Ų9785 Ų8545%0.45342%0.418SS..Hα-helixtrans-61.3-42.1173-75.8174.7-4.600112.1N6 L7 K12 L13 A14N6-Q10 WeakPolarHBondContact O-CB 3.32Å; N6-Q10 VanDerWaalsContact O-CG 3.31Å; N6-Q10 WeakPolarHBondContact O-CG 3.48Å; N6-Q10 PolarHBondContact O-N 3.5Å; L7-Q10 PolarHBondContact O-N 3.34Å; Q10-K12 VanDerWaalsContact C-N 3.33Å; Q10-K12 PolarHBondContact O-N 2.99Å; Q10-L13 PolarHBondContact O-N 3.3Å; Q10-A14 WeakPolarHBondContact O-CB 3.48Å; Q10-A14 PolarHBondContact O-N 3.03Å
11A97.4Very high93Very high0 Ų084.6 Ų84.60%042%0.418CS..Hα-helixtrans-61.1-41.5175.400000111.9L7 V8 Y9 A14 E15 M23 M27L7-A11 PolarHBondContact O-N 2.69Å; V8-A11 PolarHBondContact O-N 3.12Å; Y9-A11 PolarHBondContact O-N 3.32Å; A11-A14 PolarHBondContact O-N 3.28Å; A11-E15 PolarHBondContact O-N 3.44Å; A11-M23 HydrophobicContact CB-CG 4.09Å; A11-M27 HydrophobicContact CB-CG 3.71Å; A11-M27 HydrophobicContact CB-SD 3.43Å; A11-M27 WeakPolarHBondContact CB-SD 3.29Å
12K97.2Very high94.7Very high66 Ų6678.3 Ų78.329%0.28739%0.386SS..Hα-helixtrans-62.9-43174.2-70.1174.4178.4-179.40112.1V8 Y9 Q10 A14 E15 Q16 E40 L44V8-K12 WeakPolarHBondContact O-CG 3.01Å; V8-K12 PolarHBondContact O-N 3.47Å; Y9-K12 PolarHBondContact O-N 3.44Å; Q10-K12 VanDerWaalsContact C-N 3.33Å; Q10-K12 PolarHBondContact O-N 2.99Å; K12-A14 VanDerWaalsContact C-N 3.32Å; K12-A14 PolarHBondContact O-N 3.44Å; K12-E15 WeakPolarHBondContact O-CB 3.34Å; K12-E15 PolarHBondContact O-N 3.35Å; K12-Q16 WeakPolarHBondContact O-CG 3.41Å; K12-Q16 PolarHBondContact O-N 3.5Å; K12-Q16 VanDerWaalsContact O-N 3.08Å; K12-E40 WeakPolarHBondContact CE-OE1 3.33Å; K12-E40 IonicContact NZ-OE1 2.63Å; K12-E40 PolarHBondContact NZ-OE1 3.02Å; K12-E40 IonicContact NZ-OE2 3.08Å; K12-E40 PolarHBondContact NZ-OE2 3.14Å; K12-E40 VanDerWaalsContact NZ-OE2 3.08Å; K12-L44 HydrophobicContact CG-CD1 4.13Å; K12-L44 HydrophobicContact CG-CD2 4.16Å
13L97.6Very high95.9Very high90 Ų9075.1 Ų75.147%0.47136%0.36SS..Hα-helixtrans-62.6-40.6174.9-69.1177.3000111.9Y9 Q10 Q16 A17Y9-L13 HydrophobicContact CD1-CD1 3.96Å; Y9-L13 HydrophobicContact CD1-CG 4.33Å; Y9-L13 HydrophobicContact CE1-CD1 3.64Å; Y9-L13 HydrophobicContact CE1-CD2 4.35Å; Y9-L13 HydrophobicContact CE1-CG 4.05Å; Y9-L13 WeakPolarHBondContact O-CG 3.27Å; Y9-L13 PolarHBondContact O-N 3.06Å; Q10-L13 PolarHBondContact O-N 3.3Å; L13-Q16 PolarHBondContact O-N 3.32Å; L13-A17 WeakPolarHBondContact O-CB 3.31Å; L13-A17 PolarHBondContact O-N 3Å; L13-A17 VanDerWaalsContact O-N 3.08Å
14A97.3Very high96.3Very high11 Ų1170.5 Ų70.59%0.09134%0.336CS..Hα-helixtrans-65.1-40.7177.300000111.7Q10 A11 K12 A17 E18 R19 E22 M23Q10-A14 WeakPolarHBondContact O-CB 3.48Å; Q10-A14 PolarHBondContact O-N 3.03Å; A11-A14 PolarHBondContact O-N 3.28Å; K12-A14 VanDerWaalsContact C-N 3.32Å; K12-A14 PolarHBondContact O-N 3.44Å; A14-A17 CarbonylContact O-C 3.46Å; A14-A17 PolarHBondContact O-N 3.44Å; A14-E18 PolarHBondContact O-N 2.97Å; A14-E18 VanDerWaalsContact O-N 3.07Å; A14-R19 HydrophobicContact CB-CB 4.38Å; A14-R19 PolarHBondContact O-N 3.22Å; A14-E22 HydrophobicContact CB-CB 4.38Å; A14-M23 HydrophobicContact CB-CB 3.86Å; A14-M23 HydrophobicContact CB-CG 4.47Å
15E96.4Very high96.4Very high59 Ų5974.3 Ų74.328%0.27636%0.355SS..Hα-helixtrans-57.9-48.7172.9-176.7-178.3-140.100111.7A11 K12 A17 E18 M23A11-E15 PolarHBondContact O-N 3.44Å; K12-E15 WeakPolarHBondContact O-CB 3.34Å; K12-E15 PolarHBondContact O-N 3.35Å; E15-A17 PolarHBondContact O-N 3.21Å; E15-E18 PolarHBondContact O-N 3.05Å; E15-M23 HydrophobicContact CB-CE 3.83Å; E15-M23 HydrophobicContact CB-SD 3.86Å; E15-M23 HydrophobicContact CG-CE 4.16Å; E15-M23 HydrophobicContact CG-SD 4.36Å
16Q96.3Very high96.6Very high158 Ų15868.5 Ų68.574%0.73833%0.329SS*.Hα-helixtrans-64.7-25.7178.5-64.6-59.2-53.400113.1K12 L13K12-Q16 WeakPolarHBondContact O-CG 3.41Å; K12-Q16 PolarHBondContact O-N 3.5Å; K12-Q16 VanDerWaalsContact O-N 3.08Å; L13-Q16 PolarHBondContact O-N 3.32Å
17A96.7Very high96.6Very high61 Ų6164 Ų6450%0.50431%0.305SS..THydrogen-bonded Turntrans-92.3417600000113.3L13 A14 E15 R19L13-A17 WeakPolarHBondContact O-CB 3.31Å; L13-A17 PolarHBondContact O-N 3Å; L13-A17 VanDerWaalsContact O-N 3.08Å; A14-A17 CarbonylContact O-C 3.46Å; A14-A17 PolarHBondContact O-N 3.44Å; E15-A17 PolarHBondContact O-N 3.21Å; A17-R19 HydrophobicContact CB-CB 4.37Å; A17-R19 HydrophobicContact CB-CG 4.18Å; A17-R19 PolarHBondContact O-N 2.93Å; A17-R19 VanDerWaalsContact O-N 3.14Å
18E96Very high96.5Very high148 Ų14866 Ų6669%0.69231%0.314SS*.THydrogen-bonded Turntrans54.527.8-174.4-57.6-177.7-178.200113.5A14 E15 Y20A14-E18 PolarHBondContact O-N 2.97Å; A14-E18 VanDerWaalsContact O-N 3.07Å; E15-E18 PolarHBondContact O-N 3.05Å; E18-Y20 HydrophobicContact CB-CE2 4Å; E18-Y20 WeakPolarHBondContact O-CD2 2.9Å; E18-Y20 PolarHBondContact O-N 3.15Å
19R97.4Very high96.4Very high144 Ų14470.9 Ų70.954%0.54333%0.334SS..  trans-9566.4-179.5-80.5-166.278.8174.39.6110.6A14 A17 D21 E22 M23A14-R19 HydrophobicContact CB-CB 4.38Å; A14-R19 PolarHBondContact O-N 3.22Å; A17-R19 HydrophobicContact CB-CB 4.37Å; A17-R19 HydrophobicContact CB-CG 4.18Å; A17-R19 PolarHBondContact O-N 2.93Å; A17-R19 VanDerWaalsContact O-N 3.14Å; R19-D21 VanDerWaalsContact C-N 3.31Å; R19-D21 PolarHBondContact O-N 3.35Å; R19-E22 VanDerWaalsContact CB-OE2 3.24Å; R19-E22 WeakPolarHBondContact CB-OE2 3.46Å; R19-E22 IonicContact CZ-OE1 3.76Å; R19-E22 IonicContact NE-OE1 2.96Å; R19-E22 PolarHBondContact NE-OE1 3.33Å; R19-E22 VanDerWaalsContact NE-OE1 3.09Å; R19-E22 IonicContact NE-OE2 3.2Å; R19-E22 PolarHBondContact NE-OE2 2.98Å; R19-E22 IonicContact NH2-OE1 3.67Å; R19-E22 PolarHBondContact NH2-OE1 3.46Å; R19-E22 PolarHBondContact O-N 2.89Å; R19-M23 PolarHBondContact O-N 3.07Å
20Y97.1Very high96.3Very high57 Ų5764 Ų6422%0.22431%0.307CS..Hα-helixtrans-68.4-26.6-170.1-57.1-69.6000114.2E18 M23 V24 N51E18-Y20 HydrophobicContact CB-CE2 4Å; E18-Y20 WeakPolarHBondContact O-CD2 2.9Å; E18-Y20 PolarHBondContact O-N 3.15Å; Y20-M23 HydrophobicContact CD1-SD 4.06Å; Y20-M23 WeakPolarHBondContact O-CB 3.4Å; Y20-M23 PolarHBondContact O-N 2.74Å; Y20-V24 WeakPolarHBondContact O-CG2 3.49Å; Y20-V24 PolarHBondContact O-N 3.46Å; Y20-N51 HydrophobicContact CD1-CB 3.59Å; Y20-N51 HydrophobicContact CD2-CB 3.54Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.44Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.4Å; Y20-N51 VanDerWaalsContact CG-CB 3.4Å
21D94.7Very high96Very high77 Ų7759.4 Ų59.441%0.41229%0.285SS..Hα-helixtrans-64.9-44.4175.4-70.1-39.7000110.3R19 M23 V24 E25 V52 R56R19-D21 VanDerWaalsContact C-N 3.31Å; R19-D21 PolarHBondContact O-N 3.35Å; D21-M23 VanDerWaalsContact C-N 3.35Å; D21-V24 WeakPolarHBondContact O-CB 3.28Å; D21-V24 PolarHBondContact O-N 3.45Å; D21-E25 PolarHBondContact O-N 2.91Å; D21-E25 VanDerWaalsContact O-N 3.14Å; D21-V52 WeakPolarHBondContact OD1-CG1 3.47Å; D21-V52 WeakPolarHBondContact OD1-CG2 3.15Å; D21-R56 IonicContact OD1-NH1 2.94Å; D21-R56 IonicContact OD2-NH1 3.28Å; D21-R56 IonicContact OD2-NH2 3.09Å
22E96.6Very high95.7Very high63 Ų6362 Ų6229%0.29430%0.303SS..Hα-helixtrans-69.8-32174.8-6579178.900112.8A14 R19 V24 E25 S26A14-E22 HydrophobicContact CB-CB 4.38Å; R19-E22 VanDerWaalsContact CB-OE2 3.24Å; R19-E22 WeakPolarHBondContact CB-OE2 3.46Å; R19-E22 IonicContact CZ-OE1 3.76Å; R19-E22 IonicContact NE-OE1 2.96Å; R19-E22 PolarHBondContact NE-OE1 3.33Å; R19-E22 VanDerWaalsContact NE-OE1 3.09Å; R19-E22 IonicContact NE-OE2 3.2Å; R19-E22 PolarHBondContact NE-OE2 2.98Å; R19-E22 IonicContact NH2-OE1 3.67Å; R19-E22 PolarHBondContact NH2-OE1 3.46Å; R19-E22 PolarHBondContact O-N 2.89Å; E22-V24 VanDerWaalsContact C-N 3.34Å; E22-E25 PolarHBondContact O-N 2.94Å; E22-S26 PolarHBondContact O-N 3.49Å; E22-S26 PolarHBondContact O-OG 3.47Å
23M97Very high95.4Very high0 Ų062 Ų620%031%0.305CS..Hα-helixtrans-62-43.5172.7-166.9-172.9-178.500110.7A11 A14 E15 R19 Y20 D21 S26 M27 L44 V47 A48A11-M23 HydrophobicContact CB-CG 4.09Å; A14-M23 HydrophobicContact CB-CB 3.86Å; A14-M23 HydrophobicContact CB-CG 4.47Å; E15-M23 HydrophobicContact CB-CE 3.83Å; E15-M23 HydrophobicContact CB-SD 3.86Å; E15-M23 HydrophobicContact CG-CE 4.16Å; E15-M23 HydrophobicContact CG-SD 4.36Å; R19-M23 PolarHBondContact O-N 3.07Å; Y20-M23 HydrophobicContact CD1-SD 4.06Å; Y20-M23 WeakPolarHBondContact O-CB 3.4Å; Y20-M23 PolarHBondContact O-N 2.74Å; D21-M23 VanDerWaalsContact C-N 3.35Å; M23-S26 PolarHBondContact O-N 2.86Å; M23-M27 WeakPolarHBondContact O-CB 3.11Å; M23-M27 WeakPolarHBondContact O-CG 3.33Å; M23-M27 PolarHBondContact O-N 3.32Å; M23-L44 HydrophobicContact CE-CB 3.95Å; M23-L44 HydrophobicContact CE-CD2 3.45Å; M23-L44 VanDerWaalsContact CE-CD2 3.45Å; M23-L44 HydrophobicContact CE-CG 4.32Å; M23-L44 VanDerWaalsContact CE-O 3.3Å; M23-L44 WeakPolarHBondContact CE-O 3.46Å; M23-V47 HydrophobicContact CE-CB 4.34Å; M23-V47 HydrophobicContact CE-CG1 4.22Å; M23-V47 HydrophobicContact SD-CG1 4.47Å; M23-A48 HydrophobicContact CB-CB 3.97Å; M23-A48 HydrophobicContact CE-CB 4.29Å; M23-A48 HydrophobicContact CG-CB 3.64Å; M23-A48 HydrophobicContact SD-CB 3.63Å
24V96.4Very high94.7Very high13 Ų1362.8 Ų62.88%0.07931%0.31CS..Hα-helixtrans-59.3-49.7174.1165.10000110.3Y20 D21 E22 S26 M27 K28 A48 Y49 V52Y20-V24 WeakPolarHBondContact O-CG2 3.49Å; Y20-V24 PolarHBondContact O-N 3.46Å; D21-V24 WeakPolarHBondContact O-CB 3.28Å; D21-V24 PolarHBondContact O-N 3.45Å; E22-V24 VanDerWaalsContact C-N 3.34Å; V24-S26 VanDerWaalsContact C-N 3.29Å; V24-S26 PolarHBondContact O-N 3.45Å; V24-M27 PolarHBondContact O-N 3.2Å; V24-K28 HydrophobicContact CG1-CD 3.68Å; V24-K28 HydrophobicContact CG1-CG 4.09Å; V24-K28 WeakPolarHBondContact O-CB 3.43Å; V24-K28 WeakPolarHBondContact O-CG 3.43Å; V24-K28 PolarHBondContact O-N 2.84Å; V24-A48 HydrophobicContact CB-CB 4.5Å; V24-A48 HydrophobicContact CG2-CB 3.65Å; V24-Y49 HydrophobicContact CG1-CD1 4.34Å; V24-Y49 HydrophobicContact CG1-CD2 4.4Å; V24-Y49 HydrophobicContact CG1-CE1 3.73Å; V24-Y49 HydrophobicContact CG1-CE2 3.8Å; V24-Y49 VanDerWaalsContact CG1-CZ 3.45Å; V24-Y49 HydrophobicContact CG2-CD1 4.13Å; V24-Y49 HydrophobicContact CG2-CD2 4.04Å; V24-Y49 HydrophobicContact CG2-CE1 4.34Å; V24-Y49 HydrophobicContact CG2-CE2 4.26Å; V24-Y49 HydrophobicContact CG2-CG 3.98Å; V24-V52 HydrophobicContact CG2-CG2 3.85Å
25E96Very high94.1Very high119 Ų11966 Ų6656%0.55633%0.328SS*.Hα-helixtrans-56.7-42.4179.4-69.8-173.2174.700113.1D21 E22 K29D21-E25 PolarHBondContact O-N 2.91Å; D21-E25 VanDerWaalsContact O-N 3.14Å; E22-E25 PolarHBondContact O-N 2.94Å; E25-K29 WeakPolarHBondContact O-CG 3.45Å; E25-K29 PolarHBondContact O-N 3.1Å
26S96.4Very high93.5Very high12 Ų1267.4 Ų67.48%0.08434%0.335CS..Hα-helixtrans-66.6-48179.7-57.20000111E22 M23 V24 K28 K29 V30E22-S26 PolarHBondContact O-N 3.49Å; E22-S26 PolarHBondContact O-OG 3.47Å; M23-S26 PolarHBondContact O-N 2.86Å; V24-S26 VanDerWaalsContact C-N 3.29Å; V24-S26 PolarHBondContact O-N 3.45Å; S26-K28 PolarHBondContact O-N 2.66Å; S26-K29 PolarHBondContact O-N 3.3Å; S26-V30 PolarHBondContact O-N 3Å
27M96Very high93.2Very high0 Ų060.4 Ų60.40%030%0.302CS..Hα-helixtrans-71.3-28.5-178-67.1-52-53.600113.3A11 M23 V24 V30 A31 E41 L44 L45A11-M27 HydrophobicContact CB-CG 3.71Å; A11-M27 HydrophobicContact CB-SD 3.43Å; A11-M27 WeakPolarHBondContact CB-SD 3.29Å; M23-M27 WeakPolarHBondContact O-CB 3.11Å; M23-M27 WeakPolarHBondContact O-CG 3.33Å; M23-M27 PolarHBondContact O-N 3.32Å; V24-M27 PolarHBondContact O-N 3.2Å; M27-V30 HydrophobicContact CE-CB 4.35Å; M27-V30 HydrophobicContact CE-CG1 4.43Å; M27-V30 PolarHBondContact O-N 3.31Å; M27-A31 PolarHBondContact O-N 3.1Å; M27-E41 HydrophobicContact CE-CB 3.9Å; M27-E41 HydrophobicContact CE-CG 4.33Å; M27-E41 WeakPolarHBondContact CE-O 3.44Å; M27-L44 HydrophobicContact CE-CB 3.91Å; M27-L44 HydrophobicContact CG-CB 4.15Å; M27-L44 HydrophobicContact SD-CB 3.79Å; M27-L44 HydrophobicContact SD-CD1 4.19Å; M27-L45 HydrophobicContact CB-CB 4.26Å; M27-L45 HydrophobicContact CB-CD1 3.56Å; M27-L45 HydrophobicContact CE-CB 4.33Å
28K94.5Very high92.8Very high55 Ų5561 Ų6124%0.23930%0.3CS..Hα-helixtrans-61.7-44.3170.3-75.6174.174.7172.70112V24 S26 V30 A31 S32 Y49 D99 V103V24-K28 HydrophobicContact CG1-CD 3.68Å; V24-K28 HydrophobicContact CG1-CG 4.09Å; V24-K28 WeakPolarHBondContact O-CB 3.43Å; V24-K28 WeakPolarHBondContact O-CG 3.43Å; V24-K28 PolarHBondContact O-N 2.84Å; S26-K28 PolarHBondContact O-N 2.66Å; K28-V30 VanDerWaalsContact C-N 3.25Å; K28-V30 PolarHBondContact O-N 2.66Å; K28-A31 PolarHBondContact O-N 2.92Å; K28-A31 VanDerWaalsContact O-N 3.16Å; K28-S32 WeakPolarHBondContact O-CB 3.39Å; K28-S32 PolarHBondContact O-N 3.17Å; K28-S32 PolarHBondContact O-OG 3.07Å; K28-Y49 WeakPolarHBondContact CD-OH 3.48Å; K28-Y49 HydrophobicContact CG-CE2 4.28Å; K28-Y49 WeakPolarHBondContact CG-OH 3.4Å; K28-D99 WeakPolarHBondContact CD-OD2 3.16Å; K28-D99 WeakPolarHBondContact CE-OD1 3.37Å; K28-D99 VanDerWaalsContact CE-OD2 3.23Å; K28-D99 WeakPolarHBondContact CE-OD2 3.49Å; K28-D99 IonicContact NZ-OD1 2.66Å; K28-D99 PolarHBondContact NZ-OD1 3.07Å; K28-D99 IonicContact NZ-OD2 3.44Å; K28-D99 PolarHBondContact NZ-OD2 3.05Å; K28-V103 HydrophobicContact CG-CG2 4.21Å
29K94.2Very high92.3Very high114 Ų11458.3 Ų58.350%0.49629%0.293SS..Hα-helixtrans-61.8-37.6177.5-69.3170.2-175169.70111.3L7 E25 S26 M33L7-K29 HydrophobicContact CD1-CB 3.65Å; L7-K29 HydrophobicContact CD2-CB 4.03Å; L7-K29 HydrophobicContact CD2-CD 3.63Å; L7-K29 HydrophobicContact CD2-CG 4.5Å; L7-K29 HydrophobicContact CG-CB 4.47Å; E25-K29 WeakPolarHBondContact O-CG 3.45Å; E25-K29 PolarHBondContact O-N 3.1Å; S26-K29 PolarHBondContact O-N 3.3Å; K29-M33 WeakPolarHBondContact O-CG 3.42Å
30V93.9Very high92Very high0 Ų056.4 Ų56.40%029%0.29CS..Hα-helixtrans-64.2-46.6173.5178.90000110.9R4 L7 V8 S26 M27 K28 S32 M33 L37 E41R4-V30 HydrophobicContact CG-CG1 4.1Å; L7-V30 HydrophobicContact CB-CG2 3.54Å; L7-V30 HydrophobicContact CD1-CG2 4.12Å; L7-V30 HydrophobicContact CG-CG2 4.49Å; V8-V30 HydrophobicContact CG2-CG1 4.39Å; V8-V30 HydrophobicContact CG2-CG2 3.99Å; S26-V30 PolarHBondContact O-N 3Å; M27-V30 HydrophobicContact CE-CB 4.35Å; M27-V30 HydrophobicContact CE-CG1 4.43Å; M27-V30 PolarHBondContact O-N 3.31Å; K28-V30 VanDerWaalsContact C-N 3.25Å; K28-V30 PolarHBondContact O-N 2.66Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.44Å; V30-M33 WeakPolarHBondContact O-CB 3.46Å; V30-M33 PolarHBondContact O-N 3.41Å; V30-L37 HydrophobicContact CG1-CD2 3.69Å; V30-E41 HydrophobicContact CG1-CG 4.37Å
31A91.5Very high91.8Very high1 Ų154.2 Ų54.21%0.00828%0.283CS..Hα-helixtrans-61.8-39177.900000112.5M27 K28 M33 D34 V103 H107 L108M27-A31 PolarHBondContact O-N 3.1Å; K28-A31 PolarHBondContact O-N 2.92Å; K28-A31 VanDerWaalsContact O-N 3.16Å; A31-M33 PolarHBondContact O-N 3.25Å; A31-M33 VanDerWaalsContact O-N 3.14Å; A31-D34 PolarHBondContact O-N 3.11Å; A31-V103 HydrophobicContact CB-CG1 3.62Å; A31-H107 WeakPolarHBondContact O-CB 3.22Å; A31-L108 HydrophobicContact CB-CD2 3.93Å; A31-L108 HydrophobicContact CB-CG 4.41Å
32S90.6Very high91.5Very high54 Ų5452.6 Ų52.638%0.37827%0.271SS..THydrogen-bonded Turntrans-73.95.5178.5-63.10000114.7K28 V30 H107K28-S32 WeakPolarHBondContact O-CB 3.39Å; K28-S32 PolarHBondContact O-N 3.17Å; K28-S32 PolarHBondContact O-OG 3.07Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.44Å; S32-H107 PolarHBondContact OG-CD2 3Å; S32-H107 PolarHBondContact OG-NE2 3.26Å; S32-H107 VanDerWaalsContact OG-NE2 3.07Å
33M89.9Confident91.2Very high67 Ų6754 Ų5433%0.3328%0.28SS..THydrogen-bonded Turntrans-80.8-0.9171.2-62-170.6174.800113.2R4 L7 K29 V30 A31 V35R4-M33 HydrophobicContact CB-CE 4.19Å; R4-M33 HydrophobicContact CB-SD 3.73Å; R4-M33 HydrophobicContact CG-SD 3.95Å; L7-M33 HydrophobicContact CD1-CE 3.53Å; K29-M33 WeakPolarHBondContact O-CG 3.42Å; V30-M33 WeakPolarHBondContact O-CB 3.46Å; V30-M33 PolarHBondContact O-N 3.41Å; A31-M33 PolarHBondContact O-N 3.25Å; A31-M33 VanDerWaalsContact O-N 3.14Å; M33-V35 PolarHBondContact O-N 2.87Å
34D83.4Confident91Very high106 Ų10654.5 Ų54.557%0.56728%0.283SS*.  trans55.132.3178-62-40000114A31 H107A31-D34 PolarHBondContact O-N 3.11Å; D34-H107 IonicContact OD1-CE1 3.86Å; D34-H107 IonicContact OD1-CG 2.59Å; D34-H107 IonicContact OD1-ND1 3.17Å; D34-H107 PolarHBondContact OD1-ND1 3.14Å
35V85.3Confident90.9Very high78 Ų7854 Ų5447%0.47328%0.28SS..SBendtrans-120.1143.4173.4-179.70000108.2M33 L37M33-V35 PolarHBondContact O-N 2.87Å; V35-L37 PolarHBondContact O-N 3.29Å
36E84.3Confident90.6Very high88 Ų8850.5 Ų50.541%0.41127%0.268SS..PPolyproline II helixtrans-51.9132.2176.3-167.1166.7-148.600111R4 T113R4-E36 PolarHBondContact NH2-O 3.14Å; E36-T113 PolarHBondContact OE1-N 3.31Å; E36-T113 PolarHBondContact OE1-OG1 3.49Å
37L88.3Confident90.4Very high11 Ų1152.2 Ų52.26%0.05828%0.278CS..PPolyproline II helixtrans-78136177.4-66.2-172000109.6V30 V35 E41 R42 L45 L108V30-L37 HydrophobicContact CG1-CD2 3.69Å; V35-L37 PolarHBondContact O-N 3.29Å; L37-E41 HydrophobicContact CB-CB 4.1Å; L37-E41 HydrophobicContact CD2-CB 4.13Å; L37-E41 HydrophobicContact CG-CB 4.5Å; L37-R42 HydrophobicContact CB-CG 3.47Å; L37-R42 VanDerWaalsContact CB-CG 3.47Å; L37-R42 HydrophobicContact CD1-CG 4.14Å; L37-R42 HydrophobicContact CG-CG 4.44Å; L37-L45 HydrophobicContact CD1-CD2 4.12Å; L37-L108 HydrophobicContact CD1-CD1 4.5Å; L37-L108 HydrophobicContact CD1-CD2 3.53Å; L37-L108 HydrophobicContact CG-CD2 3.78Å
38T90.2Very high90.4Very high73 Ų7352.2 Ų52.245%0.44828%0.278SS..PPolyproline II helixtrans-63.4161.9167.762.20000110.8E40 E41 R42T38-E40 PolarHBondContact O-N 3.41Å; T38-E41 WeakPolarHBondContact CB-OE2 3.28Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.3Å; T38-E41 PolarHBondContact N-OE2 3.46Å; T38-E41 PolarHBondContact O-N 2.85Å; T38-E41 VanDerWaalsContact O-N 3.14Å; T38-E41 VanDerWaalsContact OG1-CG 3.24Å; T38-E41 WeakPolarHBondContact OG1-CG 3.41Å; T38-E41 PolarHBondContact OG1-N 3.47Å; T38-E41 PolarHBondContact OG1-OE2 3.04Å; T38-R42 WeakPolarHBondContact O-CG 3.49Å; T38-R42 PolarHBondContact O-N 2.87Å
39V85.1Confident90.4Very high93 Ų9349.7 Ų49.756%0.56427%0.267SS*.Hα-helixtrans-54.3-42.7176.1178.80000111.4R42 N43V39-R42 PolarHBondContact O-N 2.95Å; V39-N43 WeakPolarHBondContact O-CB 3.26Å; V39-N43 PolarHBondContact O-N 2.91Å; V39-N43 PolarHBondContact O-ND2 3.22Å
40E90.1Very high90.3Very high103 Ų10351.3 Ų51.348%0.48127%0.274SS..Hα-helixtrans-62.2-46.1177.4-176.4174.9-140.200112.1K12 T38 R42 N43 L44K12-E40 WeakPolarHBondContact CE-OE1 3.33Å; K12-E40 IonicContact NZ-OE1 2.63Å; K12-E40 PolarHBondContact NZ-OE1 3.02Å; K12-E40 IonicContact NZ-OE2 3.08Å; K12-E40 PolarHBondContact NZ-OE2 3.14Å; K12-E40 VanDerWaalsContact NZ-OE2 3.08Å; T38-E40 PolarHBondContact O-N 3.41Å; E40-R42 PolarHBondContact O-N 3.28Å; E40-N43 PolarHBondContact O-N 2.92Å; E40-L44 HydrophobicContact CG-CD1 4.2Å; E40-L44 WeakPolarHBondContact O-CG 3.34Å; E40-L44 PolarHBondContact O-N 3.23Å
41E92.9Very high90.3Very high12 Ų1254.2 Ų54.26%0.05629%0.29CS..Hα-helixtrans-66.8-37.8179.6-69.4162.6142.400112.4R4 V8 M27 V30 L37 T38 N43 L44 L45R4-E41 IonicContact CZ-OE1 3.76Å; R4-E41 IonicContact CZ-OE2 2.91Å; R4-E41 IonicContact NE-OE1 2.78Å; R4-E41 PolarHBondContact NE-OE1 3.08Å; R4-E41 IonicContact NE-OE2 2.72Å; R4-E41 VanDerWaalsContact NH2-CD 3.31Å; R4-E41 IonicContact NH2-OE1 2.66Å; R4-E41 PolarHBondContact NH2-OE1 3.28Å; R4-E41 IonicContact NH2-OE2 3.66Å; R4-E41 PolarHBondContact NH2-OE2 3.34Å; V8-E41 HydrophobicContact CG2-CG 3.8Å; M27-E41 HydrophobicContact CE-CB 3.9Å; M27-E41 HydrophobicContact CE-CG 4.33Å; M27-E41 WeakPolarHBondContact CE-O 3.44Å; V30-E41 HydrophobicContact CG1-CG 4.37Å; L37-E41 HydrophobicContact CB-CB 4.1Å; L37-E41 HydrophobicContact CD2-CB 4.13Å; L37-E41 HydrophobicContact CG-CB 4.5Å; T38-E41 WeakPolarHBondContact CB-OE2 3.28Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.3Å; T38-E41 PolarHBondContact N-OE2 3.46Å; T38-E41 PolarHBondContact O-N 2.85Å; T38-E41 VanDerWaalsContact O-N 3.14Å; T38-E41 VanDerWaalsContact OG1-CG 3.24Å; T38-E41 WeakPolarHBondContact OG1-CG 3.41Å; T38-E41 PolarHBondContact OG1-N 3.47Å; T38-E41 PolarHBondContact OG1-OE2 3.04Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 3.22Å; E41-L44 PolarHBondContact O-N 2.94Å; E41-L45 WeakPolarHBondContact O-CB 3.42Å; E41-L45 PolarHBondContact O-N 3.4Å
42R89.6Confident90.5Very high43 Ų4354.6 Ų54.616%0.16229%0.291CS..Hα-helixtrans-63.1-40.2174.1-68.6-170.9-58.7172.716.2111.5L37 T38 V39 E40 S46 T114 E116L37-R42 HydrophobicContact CB-CG 3.47Å; L37-R42 VanDerWaalsContact CB-CG 3.47Å; L37-R42 HydrophobicContact CD1-CG 4.14Å; L37-R42 HydrophobicContact CG-CG 4.44Å; T38-R42 WeakPolarHBondContact O-CG 3.49Å; T38-R42 PolarHBondContact O-N 2.87Å; V39-R42 PolarHBondContact O-N 2.95Å; E40-R42 PolarHBondContact O-N 3.28Å; R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 3Å; R42-S46 PolarHBondContact O-OG 3.34Å; R42-T114 PolarHBondContact NH1-OG1 3.17Å; R42-T114 VanDerWaalsContact NH1-OG1 3.14Å; R42-E116 VanDerWaalsContact CZ-CD 3.41Å; R42-E116 IonicContact CZ-OE1 3.31Å; R42-E116 VanDerWaalsContact CZ-OE1 3.31Å; R42-E116 IonicContact CZ-OE2 3.6Å; R42-E116 IonicContact NE-OE2 2.68Å; R42-E116 PolarHBondContact NE-OE2 3.44Å; R42-E116 VanDerWaalsContact NH1-CD 3.34Å; R42-E116 IonicContact NH1-OE1 3.25Å; R42-E116 PolarHBondContact NH1-OE1 3.48Å; R42-E116 IonicContact NH1-OE2 3.22Å; R42-E116 PolarHBondContact NH1-OE2 2.87Å; R42-E116 IonicContact NH2-OE1 2.78Å; R42-E116 PolarHBondContact NH2-OE1 3.26Å; R42-E116 IonicContact NH2-OE2 3.76Å; R42-E116 PolarHBondContact NH2-OE2 3.16Å
43N88.4Confident90.6Very high91 Ų9152.1 Ų52.149%0.48727%0.274SS..Hα-helixtrans-64.7-47.7175.9-72.2-13.9000111.1V39 E40 E41 L45 S46 V47V39-N43 WeakPolarHBondContact O-CB 3.26Å; V39-N43 PolarHBondContact O-N 2.91Å; V39-N43 PolarHBondContact O-ND2 3.22Å; E40-N43 PolarHBondContact O-N 2.92Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 3.22Å; N43-L45 PolarHBondContact O-N 2.91Å; N43-S46 PolarHBondContact O-N 3.04Å; N43-V47 WeakPolarHBondContact O-CB 3.49Å; N43-V47 VanDerWaalsContact O-CG2 3.31Å; N43-V47 WeakPolarHBondContact O-CG2 3.48Å; N43-V47 PolarHBondContact O-N 2.8Å
44L94.7Very high90.7Very high11 Ų1150.4 Ų50.46%0.05827%0.273CS..Hα-helixtrans-58.8-46.3176.9-71.8169.1000111.7V8 K12 M23 M27 E40 E41 S46 V47 A48V8-L44 HydrophobicContact CG1-CD1 3.88Å; K12-L44 HydrophobicContact CG-CD1 4.13Å; K12-L44 HydrophobicContact CG-CD2 4.16Å; M23-L44 HydrophobicContact CE-CB 3.95Å; M23-L44 HydrophobicContact CE-CD2 3.45Å; M23-L44 VanDerWaalsContact CE-CD2 3.45Å; M23-L44 HydrophobicContact CE-CG 4.32Å; M23-L44 VanDerWaalsContact CE-O 3.3Å; M23-L44 WeakPolarHBondContact CE-O 3.46Å; M27-L44 HydrophobicContact CE-CB 3.91Å; M27-L44 HydrophobicContact CG-CB 4.15Å; M27-L44 HydrophobicContact SD-CB 3.79Å; M27-L44 HydrophobicContact SD-CD1 4.19Å; E40-L44 HydrophobicContact CG-CD1 4.2Å; E40-L44 WeakPolarHBondContact O-CG 3.34Å; E40-L44 PolarHBondContact O-N 3.23Å; E41-L44 PolarHBondContact O-N 2.94Å; L44-S46 VanDerWaalsContact C-N 3.32Å; L44-S46 PolarHBondContact O-N 3.49Å; L44-V47 PolarHBondContact O-N 3.42Å; L44-A48 WeakPolarHBondContact O-CB 3.3Å; L44-A48 PolarHBondContact O-N 3.46Å
45L93.3Very high91.2Very high4 Ų447.8 Ų47.82%0.02127%0.266CS..Hα-helixtrans-59.6-44.4176.6-175.275.1000111.3M27 L37 E41 N43 A48 Y49 I100 L108M27-L45 HydrophobicContact CB-CB 4.26Å; M27-L45 HydrophobicContact CB-CD1 3.56Å; M27-L45 HydrophobicContact CE-CB 4.33Å; L37-L45 HydrophobicContact CD1-CD2 4.12Å; E41-L45 WeakPolarHBondContact O-CB 3.42Å; E41-L45 PolarHBondContact O-N 3.4Å; N43-L45 PolarHBondContact O-N 2.91Å; L45-A48 PolarHBondContact O-N 2.66Å; L45-Y49 HydrophobicContact CD1-CD2 3.98Å; L45-Y49 HydrophobicContact CD1-CE2 3.72Å; L45-Y49 HydrophobicContact CG-CD2 4.25Å; L45-Y49 HydrophobicContact CG-CE2 4.4Å; L45-Y49 PolarHBondContact O-N 3.32Å; L45-Y49 VanDerWaalsContact O-N 3.17Å; L45-I100 HydrophobicContact CD2-CD1 4.41Å; L45-L108 HydrophobicContact CD2-CD1 3.48Å; L45-L108 VanDerWaalsContact CD2-CD1 3.48Å
46S90.3Very high91.7Very high44 Ų4447.1 Ų47.131%0.30826%0.255SS..Hα-helixtrans-65.5-44179.8-60.60000111.9R42 N43 L44 K50R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 3Å; R42-S46 PolarHBondContact O-OG 3.34Å; N43-S46 PolarHBondContact O-N 3.04Å; L44-S46 VanDerWaalsContact C-N 3.32Å; L44-S46 PolarHBondContact O-N 3.49Å; S46-K50 WeakPolarHBondContact O-CB 3.23Å; S46-K50 PolarHBondContact O-N 2.9Å
47V92.7Very high92.1Very high48 Ų4844.6 Ų44.629%0.29124%0.242SC..Hα-helixtrans-62.4-44.3176.7169.40000110.9M23 N43 L44 K50 N51M23-V47 HydrophobicContact CE-CB 4.34Å; M23-V47 HydrophobicContact CE-CG1 4.22Å; M23-V47 HydrophobicContact SD-CG1 4.47Å; N43-V47 WeakPolarHBondContact O-CB 3.49Å; N43-V47 VanDerWaalsContact O-CG2 3.31Å; N43-V47 WeakPolarHBondContact O-CG2 3.48Å; N43-V47 PolarHBondContact O-N 2.8Å; L44-V47 PolarHBondContact O-N 3.42Å; V47-K50 PolarHBondContact O-N 3.49Å; V47-N51 PolarHBondContact O-N 3.5Å; V47-N51 VanDerWaalsContact O-N 3.09Å; V47-N51 PolarHBondContact O-ND2 2.94Å
48A95.5Very high92.4Very high0 Ų046.2 Ų46.20%026%0.257CS..Hα-helixtrans-57.8-58.618000000111.2M23 V24 L44 L45 K50 N51 V52M23-A48 HydrophobicContact CB-CB 3.97Å; M23-A48 HydrophobicContact CE-CB 4.29Å; M23-A48 HydrophobicContact CG-CB 3.64Å; M23-A48 HydrophobicContact SD-CB 3.63Å; V24-A48 HydrophobicContact CB-CB 4.5Å; V24-A48 HydrophobicContact CG2-CB 3.65Å; L44-A48 WeakPolarHBondContact O-CB 3.3Å; L44-A48 PolarHBondContact O-N 3.46Å; L45-A48 PolarHBondContact O-N 2.66Å; A48-K50 PolarHBondContact O-N 3.45Å; A48-N51 PolarHBondContact O-N 2.9Å; A48-V52 WeakPolarHBondContact O-CG2 3.36Å; A48-V52 PolarHBondContact O-N 3.42Å; A48-V52 VanDerWaalsContact O-N 3.15Å
49Y94.6Very high92.7Very high3 Ų345.5 Ų45.51%0.01226%0.255CS..Hα-helixtrans-68.1-35.3-178.2-81.4-83.8000112.9V24 K28 L45 N51 V52 I53 I96 D99 I100 Y124V24-Y49 HydrophobicContact CG1-CD1 4.34Å; V24-Y49 HydrophobicContact CG1-CD2 4.4Å; V24-Y49 HydrophobicContact CG1-CE1 3.73Å; V24-Y49 HydrophobicContact CG1-CE2 3.8Å; V24-Y49 VanDerWaalsContact CG1-CZ 3.45Å; V24-Y49 HydrophobicContact CG2-CD1 4.13Å; V24-Y49 HydrophobicContact CG2-CD2 4.04Å; V24-Y49 HydrophobicContact CG2-CE1 4.34Å; V24-Y49 HydrophobicContact CG2-CE2 4.26Å; V24-Y49 HydrophobicContact CG2-CG 3.98Å; K28-Y49 WeakPolarHBondContact CD-OH 3.48Å; K28-Y49 HydrophobicContact CG-CE2 4.28Å; K28-Y49 WeakPolarHBondContact CG-OH 3.4Å; L45-Y49 HydrophobicContact CD1-CD2 3.98Å; L45-Y49 HydrophobicContact CD1-CE2 3.72Å; L45-Y49 HydrophobicContact CG-CD2 4.25Å; L45-Y49 HydrophobicContact CG-CE2 4.4Å; L45-Y49 PolarHBondContact O-N 3.32Å; L45-Y49 VanDerWaalsContact O-N 3.17Å; Y49-N51 VanDerWaalsContact C-N 3.31Å; Y49-N51 PolarHBondContact O-N 3.32Å; Y49-V52 PolarHBondContact O-N 3.01Å; Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 WeakPolarHBondContact O-CG2 3.48Å; Y49-I53 PolarHBondContact O-N 3.38Å; Y49-I96 HydrophobicContact CD1-CG2 4.17Å; Y49-D99 PolarHBondContact OH-OD2 3.03Å; Y49-I100 HydrophobicContact CD1-CB 3.84Å; Y49-I100 HydrophobicContact CD1-CG1 4.44Å; Y49-I100 HydrophobicContact CD1-CG2 4.32Å; Y49-I100 HydrophobicContact CD2-CB 4.43Å; Y49-I100 HydrophobicContact CD2-CD1 3.85Å; Y49-I100 HydrophobicContact CD2-CG1 4.3Å; Y49-I100 HydrophobicContact CE1-CB 3.63Å; Y49-I100 HydrophobicContact CE1-CG2 4.37Å; Y49-I100 HydrophobicContact CE2-CB 4.24Å; Y49-I100 HydrophobicContact CE2-CD1 3.69Å; Y49-I100 HydrophobicContact CE2-CG1 4.34Å; Y49-I100 HydrophobicContact CG-CB 4.22Å; Y49-I100 HydrophobicContact CG-CD1 4.37Å; Y49-I100 HydrophobicContact CG-CG1 4.33Å; Y49-Y124 WeakPolarHBondContact CB-OH 3.29Å
50K91.8Very high93.2Very high148 Ų14843 Ų4364%0.64324%0.235SC*.Hα-helixtrans-58.9-41.6176.7179.4-179.6174.6-177.90111.7S46 V47 A48 G54S46-K50 WeakPolarHBondContact O-CB 3.23Å; S46-K50 PolarHBondContact O-N 2.9Å; V47-K50 PolarHBondContact O-N 3.49Å; A48-K50 PolarHBondContact O-N 3.45Å; K50-G54 WeakPolarHBondContact O-CA 3.35Å; K50-G54 PolarHBondContact O-N 3.07Å
51N93.4Very high93.4Very high61 Ų6143.7 Ų43.733%0.32623%0.234SC..Hα-helixtrans-71.3-46.8178.2-79.8-71.6000111.9Y20 V47 A48 Y49 I53 G54 A55Y20-N51 HydrophobicContact CD1-CB 3.59Å; Y20-N51 HydrophobicContact CD2-CB 3.54Å; Y20-N51 HydrophobicContact CE1-CB 3.9Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.44Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.4Å; Y20-N51 VanDerWaalsContact CG-CB 3.4Å; V47-N51 PolarHBondContact O-N 3.5Å; V47-N51 VanDerWaalsContact O-N 3.09Å; V47-N51 PolarHBondContact O-ND2 2.94Å; A48-N51 PolarHBondContact O-N 2.9Å; Y49-N51 VanDerWaalsContact C-N 3.31Å; Y49-N51 PolarHBondContact O-N 3.32Å; N51-I53 PolarHBondContact O-N 3.03Å; N51-G54 PolarHBondContact O-N 3.15Å; N51-A55 PolarHBondContact O-N 3.49Å; N51-A55 VanDerWaalsContact O-N 3.12Å
52V95.2Very high93.6Very high8 Ų848.1 Ų48.15%0.04826%0.257CS..Hα-helixtrans-58.2-49178.71740000111.1D21 V24 A48 Y49 R56 I96D21-V52 WeakPolarHBondContact OD1-CG1 3.47Å; D21-V52 WeakPolarHBondContact OD1-CG2 3.15Å; V24-V52 HydrophobicContact CG2-CG2 3.85Å; A48-V52 WeakPolarHBondContact O-CG2 3.36Å; A48-V52 PolarHBondContact O-N 3.42Å; A48-V52 VanDerWaalsContact O-N 3.15Å; Y49-V52 PolarHBondContact O-N 3.01Å; V52-R56 VanDerWaalsContact O-CD 3.29Å; V52-R56 WeakPolarHBondContact O-CD 3.35Å; V52-I96 HydrophobicContact CG1-CD1 3.75Å; V52-I96 HydrophobicContact CG1-CG1 4.05Å; V52-I96 HydrophobicContact CG1-CG2 4.2Å
53I93.3Very high93.9Very high3 Ų346.8 Ų46.82%0.01525%0.253CS..Hα-helixtrans-73.2-35.1-179.6-159.7166000112.5Y49 N51 A55 R56 R57 L93 I96 C97 Y124 Y127Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 WeakPolarHBondContact O-CG2 3.48Å; Y49-I53 PolarHBondContact O-N 3.38Å; N51-I53 PolarHBondContact O-N 3.03Å; I53-A55 VanDerWaalsContact C-N 3.34Å; I53-A55 PolarHBondContact O-N 3.35Å; I53-R56 PolarHBondContact O-N 3.34Å; I53-R57 HydrophobicContact CG1-CG 4.2Å; I53-R57 WeakPolarHBondContact O-CB 3.13Å; I53-R57 WeakPolarHBondContact O-CG 3.12Å; I53-R57 PolarHBondContact O-N 3.29Å; I53-L93 HydrophobicContact CG1-CD2 3.91Å; I53-I96 HydrophobicContact CB-CG2 4.12Å; I53-I96 HydrophobicContact CD1-CG2 4.42Å; I53-I96 HydrophobicContact CG1-CG2 4.36Å; I53-C97 WeakPolarHBondContact CD1-SG 3.3Å; I53-Y124 HydrophobicContact CD1-CD1 3.71Å; I53-Y124 HydrophobicContact CD1-CE1 3.65Å; I53-Y124 HydrophobicContact CG2-CE1 4.28Å; I53-Y127 HydrophobicContact CD1-CD2 3.42Å; I53-Y127 VanDerWaalsContact CD1-CD2 3.42Å; I53-Y127 HydrophobicContact CD1-CE2 4.19Å; I53-Y127 HydrophobicContact CD1-CG 3.94Å; I53-Y127 HydrophobicContact CG1-CD2 4.48Å; I53-Y127 HydrophobicContact CG2-CE2 4.4Å
54G92.8Very high94.1Very high30 Ų3043.9 Ų43.931%0.30924%0.239SC..Hα-helixtrans-59.2-45.1179.100000111.9K50 N51 R57 A58K50-G54 WeakPolarHBondContact O-CA 3.35Å; K50-G54 PolarHBondContact O-N 3.07Å; N51-G54 PolarHBondContact O-N 3.15Å; G54-R57 PolarHBondContact O-N 3.37Å; G54-A58 WeakPolarHBondContact O-CB 3.26Å; G54-A58 PolarHBondContact O-N 3.15Å
55A93.9Very high94.1Very high51 Ų5145.7 Ų45.742%0.42125%0.253SS..Hα-helixtrans-59-49.8175.700000111.8N51 I53 R57 A58 S59N51-A55 PolarHBondContact O-N 3.49Å; N51-A55 VanDerWaalsContact O-N 3.12Å; I53-A55 VanDerWaalsContact C-N 3.34Å; I53-A55 PolarHBondContact O-N 3.35Å; A55-R57 PolarHBondContact O-N 3.37Å; A55-A58 PolarHBondContact O-N 2.93Å; A55-S59 PolarHBondContact O-N 3.3Å; A55-S59 PolarHBondContact O-OG 3.29Å
56R94.9Very high94.1Very high65 Ų6549.6 Ų49.625%0.24527%0.274CS..Hα-helixtrans-67.6-36.3-179.3-83.570.7179.3-172.3-3.2112.4D21 V52 I53 S59 W60 E92 L93 I96D21-R56 IonicContact OD1-NH1 2.94Å; D21-R56 IonicContact OD2-NH1 3.28Å; D21-R56 IonicContact OD2-NH2 3.09Å; V52-R56 VanDerWaalsContact O-CD 3.29Å; V52-R56 WeakPolarHBondContact O-CD 3.35Å; I53-R56 PolarHBondContact O-N 3.34Å; R56-S59 PolarHBondContact O-N 3.43Å; R56-W60 WeakPolarHBondContact O-CB 3.2Å; R56-W60 PolarHBondContact O-N 3.06Å; R56-E92 HydrophobicContact CG-CB 4.32Å; R56-E92 IonicContact NE-OE2 2.69Å; R56-E92 PolarHBondContact NE-OE2 3.29Å; R56-L93 HydrophobicContact CB-CD2 3.45Å; R56-L93 VanDerWaalsContact CB-CD2 3.45Å; R56-L93 HydrophobicContact CB-CG 3.84Å; R56-I96 HydrophobicContact CB-CD1 4.47Å; R56-I96 HydrophobicContact CG-CD1 4.04Å
57R94.1Very high94.3Very high34 Ų3448.4 Ų48.413%0.12826%0.263CS..Hα-helixtrans-64.4-41.4174.9-76.7179.168.5-137.97.4111.5I53 G54 A55 W60 R61 L93 Y127 E130I53-R57 HydrophobicContact CG1-CG 4.2Å; I53-R57 WeakPolarHBondContact O-CB 3.13Å; I53-R57 WeakPolarHBondContact O-CG 3.12Å; I53-R57 PolarHBondContact O-N 3.29Å; G54-R57 PolarHBondContact O-N 3.37Å; A55-R57 PolarHBondContact O-N 3.37Å; R57-W60 PolarHBondContact O-N 2.94Å; R57-R61 WeakPolarHBondContact O-CG 3.49Å; R57-R61 PolarHBondContact O-N 3.46Å; R57-L93 HydrophobicContact CG-CD2 3.75Å; R57-Y127 VanDerWaalsContact CZ-CE1 3.41Å; R57-Y127 VanDerWaalsContact NH1-CE1 3.31Å; R57-E130 IonicContact CZ-OE1 3.61Å; R57-E130 IonicContact CZ-OE2 3.67Å; R57-E130 VanDerWaalsContact CZ-OE2 3.25Å; R57-E130 IonicContact NE-OE1 3.9Å; R57-E130 IonicContact NE-OE2 2.69Å; R57-E130 PolarHBondContact NE-OE2 3.48Å; R57-E130 IonicContact NH2-OE1 3.71Å; R57-E130 PolarHBondContact NH2-OE1 2.94Å; R57-E130 IonicContact NH2-OE2 3.12Å; R57-E130 PolarHBondContact NH2-OE2 2.91Å
58A94.5Very high94.2Very high46 Ų4652.2 Ų52.238%0.3828%0.278SS..Hα-helixtrans-62.6-4717500000111.4G54 A55 W60 R61 I62G54-A58 WeakPolarHBondContact O-CB 3.26Å; G54-A58 PolarHBondContact O-N 3.15Å; A55-A58 PolarHBondContact O-N 2.93Å; A58-W60 VanDerWaalsContact C-N 3.34Å; A58-W60 PolarHBondContact O-N 3.36Å; A58-R61 PolarHBondContact O-N 3.41Å; A58-I62 WeakPolarHBondContact O-CG1 3.47Å; A58-I62 PolarHBondContact O-N 3.36Å; A58-I62 VanDerWaalsContact O-N 3.14Å
59S96.1Very high94Very high57 Ų5757.9 Ų57.940%0.39930%0.302SS..Hα-helixtrans-56.8-46.7174.1-60.20000111.9A55 R56 R61 I62 I63A55-S59 PolarHBondContact O-N 3.3Å; A55-S59 PolarHBondContact O-OG 3.29Å; R56-S59 PolarHBondContact O-N 3.43Å; S59-R61 PolarHBondContact O-N 3.26Å; S59-I62 PolarHBondContact O-N 3.44Å; S59-I63 WeakPolarHBondContact O-CD1 3.47Å; S59-I63 VanDerWaalsContact O-CG1 3.25Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.12Å
60W96.1Very high93.9Very high40 Ų4059 Ų5915%0.15231%0.308CS..Hα-helixtrans-59.8-46.8178.9-179.681.9000112.2R56 R57 A58 I62 I63 S64 V89 E90 L93 F131R56-W60 WeakPolarHBondContact O-CB 3.2Å; R56-W60 PolarHBondContact O-N 3.06Å; R57-W60 PolarHBondContact O-N 2.94Å; A58-W60 VanDerWaalsContact C-N 3.34Å; A58-W60 PolarHBondContact O-N 3.36Å; W60-I62 VanDerWaalsContact C-N 3.32Å; W60-I62 PolarHBondContact O-N 3.22Å; W60-I63 PolarHBondContact O-N 2.86Å; W60-S64 WeakPolarHBondContact O-CB 3.47Å; W60-S64 PolarHBondContact O-N 3Å; W60-S64 PolarHBondContact O-OG 2.78Å; W60-S64 VanDerWaalsContact O-OG 3.06Å; W60-V89 HydrophobicContact CB-CG1 3.87Å; W60-E90 PolarHBondContact NE1-OE1 3.46Å; W60-L93 HydrophobicContact CB-CD1 3.78Å; W60-L93 HydrophobicContact CG-CD1 4.01Å; W60-F131 HydrophobicContact CD2-CB 4.21Å; W60-F131 VanDerWaalsContact CE2-CB 3.49Å; W60-F131 HydrophobicContact CH2-CB 4.01Å; W60-F131 HydrophobicContact CZ2-CB 3.39Å
61R93.9Very high93.8Very high118 Ų11856.2 Ų56.245%0.44530%0.297SS..Hα-helixtrans-57.9-43176.8-73.9-176-179.3113-0.4112.7R57 A58 S59 S65R57-R61 WeakPolarHBondContact O-CG 3.49Å; R57-R61 PolarHBondContact O-N 3.46Å; A58-R61 PolarHBondContact O-N 3.41Å; S59-R61 PolarHBondContact O-N 3.26Å; R61-S65 WeakPolarHBondContact O-CB 3.41Å; R61-S65 PolarHBondContact O-N 2.57Å
62I95.8Very high93.4Very high106 Ų10659.9 Ų59.954%0.54432%0.317SS..Hα-helixtrans-62.4-48.6178.1-66.9165.5000110A58 S59 W60 S65 L66A58-I62 WeakPolarHBondContact O-CG1 3.47Å; A58-I62 PolarHBondContact O-N 3.36Å; A58-I62 VanDerWaalsContact O-N 3.14Å; S59-I62 PolarHBondContact O-N 3.44Å; W60-I62 VanDerWaalsContact C-N 3.32Å; W60-I62 PolarHBondContact O-N 3.22Å; I62-S65 PolarHBondContact O-N 2.67Å; I62-L66 HydrophobicContact CG2-CD1 4.19Å; I62-L66 WeakPolarHBondContact O-CG 3.33Å; I62-L66 PolarHBondContact O-N 2.89Å
63I95.8Very high93Very high14 Ų1466.8 Ų66.87%0.07235%0.346CS..Hα-helixtrans-64.7-43.5-178.3-62.6160.3000110.8S59 W60 S65 L66 E67 I82 Y85 R86 V89S59-I63 WeakPolarHBondContact O-CD1 3.47Å; S59-I63 VanDerWaalsContact O-CG1 3.25Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.12Å; W60-I63 PolarHBondContact O-N 2.86Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 2.91Å; I63-L66 WeakPolarHBondContact O-CB 3.42Å; I63-L66 PolarHBondContact O-N 3.01Å; I63-L66 VanDerWaalsContact O-N 3.12Å; I63-E67 PolarHBondContact O-N 3.43Å; I63-I82 HydrophobicContact CG2-CG2 3.96Å; I63-Y85 HydrophobicContact CD1-CD1 3.45Å; I63-Y85 VanDerWaalsContact CD1-CD1 3.45Å; I63-Y85 HydrophobicContact CD1-CE1 3.52Å; I63-Y85 HydrophobicContact CG1-CD1 3.97Å; I63-Y85 HydrophobicContact CG1-CE1 4.2Å; I63-R86 HydrophobicContact CG2-CB 3.69Å; I63-R86 HydrophobicContact CG2-CG 4.37Å; I63-V89 HydrophobicContact CD1-CB 4.38Å; I63-V89 HydrophobicContact CD1-CG2 3.57Å
64S94Very high92.2Very high30 Ų3069.7 Ų69.721%0.2138%0.377CS..Hα-helixtrans-60.9-39.3175.8-62.90000112W60 E67 Q68 R86W60-S64 WeakPolarHBondContact O-CB 3.47Å; W60-S64 PolarHBondContact O-N 3Å; W60-S64 PolarHBondContact O-OG 2.78Å; W60-S64 VanDerWaalsContact O-OG 3.06Å; S64-E67 WeakPolarHBondContact O-CB 3.23Å; S64-E67 PolarHBondContact O-N 3.37Å; S64-Q68 PolarHBondContact O-N 3.28Å; S64-Q68 VanDerWaalsContact O-N 3.1Å; S64-R86 WeakPolarHBondContact OG-CD 3.27Å
65S94.3Very high91.8Very high49 Ų4969.5 Ų69.534%0.34338%0.375SS..Hα-helixtrans-65.9-37.2173.8-176.10000112.5R61 I62 I63 K69R61-S65 WeakPolarHBondContact O-CB 3.41Å; R61-S65 PolarHBondContact O-N 2.57Å; I62-S65 PolarHBondContact O-N 2.67Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 2.91Å; S65-K69 WeakPolarHBondContact O-CG 3.4Å; S65-K69 PolarHBondContact O-N 3.12Å; S65-K69 VanDerWaalsContact O-N 3.12Å
66L93.6Very high91.4Very high87 Ų8773.8 Ų73.846%0.45539%0.386SS..Hα-helixtrans-67.2-39.3174.7-69.6173.3000111.9I62 I63 K69 E70I62-L66 HydrophobicContact CG2-CD1 4.19Å; I62-L66 WeakPolarHBondContact O-CG 3.33Å; I62-L66 PolarHBondContact O-N 2.89Å; I63-L66 WeakPolarHBondContact O-CB 3.42Å; I63-L66 PolarHBondContact O-N 3.01Å; I63-L66 VanDerWaalsContact O-N 3.12Å; L66-K69 PolarHBondContact O-N 2.97Å; L66-E70 PolarHBondContact O-N 3.44Å
67E93.3Very high91.2Very high18 Ų1876.4 Ų76.48%0.08441%0.405CS..Hα-helixtrans-57.3-53.4174.6-169.3174169.500110.4I63 S64 K69 E70 E71 L79 I82 R83 R86I63-E67 PolarHBondContact O-N 3.43Å; S64-E67 WeakPolarHBondContact O-CB 3.23Å; S64-E67 PolarHBondContact O-N 3.37Å; E67-K69 VanDerWaalsContact C-N 3.3Å; E67-K69 PolarHBondContact O-N 2.88Å; E67-E70 PolarHBondContact O-N 2.99Å; E67-E71 WeakPolarHBondContact O-CG 3.42Å; E67-E71 PolarHBondContact O-N 2.85Å; E67-L79 HydrophobicContact CG-CD1 3.74Å; E67-I82 HydrophobicContact CB-CG2 3.64Å; E67-I82 HydrophobicContact CG-CG2 4.2Å; E67-R83 HydrophobicContact CG-CG 4.24Å; E67-R83 WeakPolarHBondContact OE1-CG 3.39Å; E67-R83 IonicContact OE1-NE 3.92Å; E67-R83 PolarHBondContact OE1-NE 3.23Å; E67-R86 IonicContact OE1-NH2 3.38Å; E67-R86 PolarHBondContact OE1-NH2 3.22Å; E67-R86 WeakPolarHBondContact OE2-CD 3.36Å; E67-R86 IonicContact OE2-CZ 2.74Å; E67-R86 IonicContact OE2-NE 3.32Å; E67-R86 PolarHBondContact OE2-NE 3.31Å; E67-R86 IonicContact OE2-NH2 3.05Å; E67-R86 PolarHBondContact OE2-NH2 3.07Å
68Q91.3Very high91.1Very high128 Ų12881.2 Ų81.260%0.59843%0.427SS*.Hα-helixtrans-59.9-38.4-179.8-167.1-179.915.500112.6S64 N72S64-Q68 PolarHBondContact O-N 3.28Å; S64-Q68 VanDerWaalsContact O-N 3.1Å; Q68-N72 PolarHBondContact O-ND2 2.93Å
69K91.5Very high91.1Very high119 Ų11980 Ų8052%0.51741%0.414SS..Hα-helixtrans-67.3-34.1176.5-75.8175.8-174.3175.30113S65 L66 E67S65-K69 WeakPolarHBondContact O-CG 3.4Å; S65-K69 PolarHBondContact O-N 3.12Å; S65-K69 VanDerWaalsContact O-N 3.12Å; L66-K69 PolarHBondContact O-N 2.97Å; E67-K69 VanDerWaalsContact C-N 3.3Å; E67-K69 PolarHBondContact O-N 2.88Å
70E92.4Very high91Very high27 Ų2782.6 Ų82.613%0.12642%0.418CS..Hα-helixtrans-82.5-31.7-178.8-160.366.3-173.100111.9L66 E67 N72 K73 G74 K78 I82L66-E70 PolarHBondContact O-N 3.44Å; E67-E70 PolarHBondContact O-N 2.99Å; E70-N72 PolarHBondContact O-N 3.31Å; E70-K73 PolarHBondContact O-N 3.46Å; E70-K73 IonicContact OE2-NZ 3.46Å; E70-G74 PolarHBondContact O-N 3.31Å; E70-K78 HydrophobicContact CG-CB 4.1Å; E70-K78 VanDerWaalsContact OE1-CD 3.26Å; E70-K78 WeakPolarHBondContact OE1-CD 3.37Å; E70-I82 HydrophobicContact CB-CD1 3.89Å; E70-I82 HydrophobicContact CG-CD1 4.15Å
71E89.2Confident90.9Very high89 Ų8987.1 Ų87.142%0.41644%0.442SS..Hα-helixtrans-54.5-41170.5-74.9-176.8159.900111.6E67 K73 L79 R83E67-E71 WeakPolarHBondContact O-CG 3.42Å; E67-E71 PolarHBondContact O-N 2.85Å; E71-K73 PolarHBondContact O-N 2.93Å; E71-L79 HydrophobicContact CG-CD1 3.5Å; E71-L79 HydrophobicContact CG-CD2 3.86Å; E71-L79 HydrophobicContact CG-CG 4.33Å; E71-R83 IonicContact OE1-CZ 3.34Å; E71-R83 IonicContact OE1-NE 2.69Å; E71-R83 IonicContact OE1-NH2 3.69Å; E71-R83 PolarHBondContact OE1-NH2 3.45Å
72N85.7Confident91Very high139 Ų13983 Ų8374%0.74343%0.429SS*.THydrogen-bonded Turntrans-69.5-14.7178.1-67.1-25.9000114.4Q68 E70Q68-N72 PolarHBondContact O-ND2 2.93Å; E70-N72 PolarHBondContact O-N 3.31Å
73K86.6Confident91Very high152 Ų15282.6 Ų82.666%0.66142%0.421SS*.THydrogen-bonded Turntrans-102.2-11.7-177-65.6175.8-169.4168.20113.8E70 E71E70-K73 PolarHBondContact O-N 3.46Å; E70-K73 IonicContact OE2-NZ 3.46Å; E71-K73 PolarHBondContact O-N 2.93Å
74G77.1Confident91Very high65 Ų6588.3 Ų88.367%0.6745%0.447SS*.THydrogen-bonded Turntrans76.119.8177.800000115.8E70 E76E70-G74 PolarHBondContact O-N 3.31Å; G74-E76 PolarHBondContact O-N 3.4Å
75G83Confident91.1Very high25 Ų2593.9 Ų93.926%0.25846%0.464SS..  trans-85.688.4178.900000113.7D77 L79G75-D77 PolarHBondContact O-N 2.8Å; G75-L79 VanDerWaalsContact O-CB 3.27Å; G75-L79 WeakPolarHBondContact O-CB 3.4Å; G75-L79 PolarHBondContact O-N 3.29Å
76E86.8Confident91.2Very high141 Ų14193.8 Ų93.866%0.65946%0.457SS*.Hα-helixtrans-59.7-42.9-173.1-73.1-167.7172.800115.2G74 L79 K80G74-E76 PolarHBondContact O-N 3.4Å; E76-L79 PolarHBondContact O-N 3.21Å; E76-K80 WeakPolarHBondContact O-CG 3.25Å; E76-K80 PolarHBondContact O-N 3Å
77D90.9Very high91.3Very high121 Ų12195.3 Ų95.365%0.64746%0.459SS*.Hα-helixtrans-70.4-42.2-175.6-70.5-27.8000112.4G75 L79 K80 M81G75-D77 PolarHBondContact O-N 2.8Å; D77-L79 VanDerWaalsContact C-N 3.32Å; D77-L79 PolarHBondContact O-N 3.35Å; D77-K80 PolarHBondContact O-N 3.46Å; D77-M81 PolarHBondContact O-N 3.11Å
78K91.6Very high91.5Very high134 Ų13497.6 Ų97.658%0.58348%0.475SS*.Hα-helixtrans-65.1-39.9175.1-70.5177.6178.8176.40111E70 K80 M81 I82E70-K78 HydrophobicContact CG-CB 4.1Å; E70-K78 VanDerWaalsContact OE1-CD 3.26Å; E70-K78 WeakPolarHBondContact OE1-CD 3.37Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.38Å; K78-M81 PolarHBondContact O-N 3.39Å; K78-I82 VanDerWaalsContact O-CG1 3.31Å; K78-I82 WeakPolarHBondContact O-CG1 3.28Å; K78-I82 PolarHBondContact O-N 3.36Å
79L93.6Very high91.7Very high21 Ų2191.8 Ų91.811%0.1145%0.448CS..Hα-helixtrans-62.3-39.3177.8-175.661.7000112E67 E71 G75 E76 D77 I82 R83E67-L79 HydrophobicContact CG-CD1 3.74Å; E71-L79 HydrophobicContact CG-CD1 3.5Å; E71-L79 HydrophobicContact CG-CD2 3.86Å; E71-L79 HydrophobicContact CG-CG 4.33Å; G75-L79 VanDerWaalsContact O-CB 3.27Å; G75-L79 WeakPolarHBondContact O-CB 3.4Å; G75-L79 PolarHBondContact O-N 3.29Å; E76-L79 PolarHBondContact O-N 3.21Å; D77-L79 VanDerWaalsContact C-N 3.32Å; D77-L79 PolarHBondContact O-N 3.35Å; L79-I82 PolarHBondContact O-N 2.82Å; L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 WeakPolarHBondContact O-CG 3.34Å; L79-R83 PolarHBondContact O-N 3.17Å
80K94.9Very high91.9Very high111 Ų11187.5 Ų87.548%0.48343%0.43SS..Hα-helixtrans-59.9-47.7172.5-73.7173.2-172.21640111.8E76 D77 K78 I82 R83 E84E76-K80 WeakPolarHBondContact O-CG 3.25Å; E76-K80 PolarHBondContact O-N 3Å; D77-K80 PolarHBondContact O-N 3.46Å; K78-K80 VanDerWaalsContact C-N 3.32Å; K78-K80 PolarHBondContact O-N 3.38Å; K80-I82 PolarHBondContact O-N 3.46Å; K80-R83 PolarHBondContact O-N 3.47Å; K80-E84 WeakPolarHBondContact O-CG 3.42Å; K80-E84 PolarHBondContact O-N 2.93Å
81M94.6Very high92Very high135 Ų13593.7 Ų93.767%0.66546%0.456SS*.Hα-helixtrans-60.3-43.5178.3-65.9177.869.900112.3D77 K78 E84 Y85D77-M81 PolarHBondContact O-N 3.11Å; K78-M81 PolarHBondContact O-N 3.39Å; M81-E84 PolarHBondContact O-N 3.04Å; M81-Y85 WeakPolarHBondContact O-CB 3.37Å; M81-Y85 PolarHBondContact O-N 3.1Å
82I95.4Very high92.4Very high33 Ų3393.2 Ų93.217%0.16945%0.454CS..Hα-helixtrans-63.1-45.5178.6-65.9164.9000110.5I63 E67 E70 K78 L79 K80 E84 Y85 R86I63-I82 HydrophobicContact CG2-CG2 3.96Å; E67-I82 HydrophobicContact CB-CG2 3.64Å; E67-I82 HydrophobicContact CG-CG2 4.2Å; E70-I82 HydrophobicContact CB-CD1 3.89Å; E70-I82 HydrophobicContact CG-CD1 4.15Å; K78-I82 VanDerWaalsContact O-CG1 3.31Å; K78-I82 WeakPolarHBondContact O-CG1 3.28Å; K78-I82 PolarHBondContact O-N 3.36Å; L79-I82 PolarHBondContact O-N 2.82Å; K80-I82 PolarHBondContact O-N 3.46Å; I82-E84 PolarHBondContact O-N 3.12Å; I82-Y85 PolarHBondContact O-N 3.2Å; I82-R86 PolarHBondContact O-N 2.8Å
83R95.1Very high92.8Very high96 Ų9686.7 Ų86.736%0.36242%0.419SS..Hα-helixtrans-61-42.9178-81.4170.7177.2170.21.6112.9E67 E71 L79 K80 K87E67-R83 HydrophobicContact CG-CG 4.24Å; E67-R83 WeakPolarHBondContact OE1-CG 3.39Å; E67-R83 IonicContact OE1-NE 3.92Å; E67-R83 PolarHBondContact OE1-NE 3.23Å; E71-R83 IonicContact OE1-CZ 3.34Å; E71-R83 IonicContact OE1-NE 2.69Å; E71-R83 IonicContact OE1-NH2 3.69Å; E71-R83 PolarHBondContact OE1-NH2 3.45Å; L79-R83 WeakPolarHBondContact O-CB 3.46Å; L79-R83 WeakPolarHBondContact O-CG 3.34Å; L79-R83 PolarHBondContact O-N 3.17Å; K80-R83 PolarHBondContact O-N 3.47Å; R83-K87 WeakPolarHBondContact O-CG 3.43Å; R83-K87 PolarHBondContact O-N 3.13Å
84E96.2Very high93.2Very high134 Ų13483.6 Ų83.663%0.62641%0.406SS*.Hα-helixtrans-64-43.2176.5-75.2178.5-17900111.4K80 M81 I82 K87 T88K80-E84 WeakPolarHBondContact O-CG 3.42Å; K80-E84 PolarHBondContact O-N 2.93Å; M81-E84 PolarHBondContact O-N 3.04Å; I82-E84 PolarHBondContact O-N 3.12Å; E84-K87 PolarHBondContact O-N 3.43Å; E84-T88 PolarHBondContact O-N 3.47Å; E84-T88 VanDerWaalsContact O-N 3.12Å; E84-T88 PolarHBondContact O-OG1 3.4Å
85Y96.6Very high94.1Very high147 Ų14784.3 Ų84.358%0.57640%0.4SS*.Hα-helixtrans-66.5-41.3178.1-164-119.7000112.2I63 M81 I82 K87 T88 V89I63-Y85 HydrophobicContact CD1-CD1 3.45Å; I63-Y85 VanDerWaalsContact CD1-CD1 3.45Å; I63-Y85 HydrophobicContact CD1-CE1 3.52Å; I63-Y85 HydrophobicContact CG1-CD1 3.97Å; I63-Y85 HydrophobicContact CG1-CE1 4.2Å; M81-Y85 WeakPolarHBondContact O-CB 3.37Å; M81-Y85 PolarHBondContact O-N 3.1Å; I82-Y85 PolarHBondContact O-N 3.2Å; Y85-K87 VanDerWaalsContact C-N 3.33Å; Y85-K87 PolarHBondContact O-N 2.84Å; Y85-T88 WeakPolarHBondContact O-CB 3.36Å; Y85-T88 PolarHBondContact O-N 3.21Å; Y85-T88 VanDerWaalsContact O-N 3.14Å; Y85-V89 PolarHBondContact O-N 2.87Å; Y85-V89 VanDerWaalsContact O-N 3.14Å
86R96.1Very high94.6Very high47 Ų4784.1 Ų84.118%0.17739%0.393CS..Hα-helixtrans-56-48172.6-175.7178.35198.9-12.9111.3I63 S64 E67 I82 T88 V89 E90I63-R86 HydrophobicContact CG2-CB 3.69Å; I63-R86 HydrophobicContact CG2-CG 4.37Å; S64-R86 WeakPolarHBondContact OG-CD 3.27Å; E67-R86 IonicContact OE1-NH2 3.38Å; E67-R86 PolarHBondContact OE1-NH2 3.22Å; E67-R86 WeakPolarHBondContact OE2-CD 3.36Å; E67-R86 IonicContact OE2-CZ 2.74Å; E67-R86 IonicContact OE2-NE 3.32Å; E67-R86 PolarHBondContact OE2-NE 3.31Å; E67-R86 IonicContact OE2-NH2 3.05Å; E67-R86 PolarHBondContact OE2-NH2 3.07Å; I82-R86 PolarHBondContact O-N 2.8Å; R86-T88 PolarHBondContact O-N 3.24Å; R86-V89 PolarHBondContact O-N 2.8Å; R86-V89 VanDerWaalsContact O-N 3.11Å; R86-E90 WeakPolarHBondContact CD-OE1 3.28Å; R86-E90 HydrophobicContact CG-CG 4.3Å; R86-E90 WeakPolarHBondContact CG-OE1 3.2Å; R86-E90 IonicContact CZ-OE1 3.25Å; R86-E90 IonicContact NE-OE1 2.8Å; R86-E90 VanDerWaalsContact NH1-CD 3.34Å; R86-E90 IonicContact NH1-OE1 2.87Å; R86-E90 PolarHBondContact NH1-OE1 3.17Å; R86-E90 IonicContact NH1-OE2 3.44Å; R86-E90 PolarHBondContact NH1-OE2 3.46Å; R86-E90 WeakPolarHBondContact O-CG 3.42Å; R86-E90 PolarHBondContact O-N 2.69Å
87K95.5Very high95Very high119 Ų11977.4 Ų77.452%0.51736%0.362SS..Hα-helixtrans-60.5-33.1178.8-75.5177.2-178.11800112.8R83 E84 Y85 K91R83-K87 WeakPolarHBondContact O-CG 3.43Å; R83-K87 PolarHBondContact O-N 3.13Å; E84-K87 PolarHBondContact O-N 3.43Å; Y85-K87 VanDerWaalsContact C-N 3.33Å; Y85-K87 PolarHBondContact O-N 2.84Å; K87-K91 WeakPolarHBondContact O-CG 3.43Å; K87-K91 PolarHBondContact O-N 3.43Å; K87-K91 VanDerWaalsContact O-N 3.07Å
88T96.6Very high95.2Very high66 Ų6675 Ų7541%0.40535%0.349SS..Hα-helixtrans-64.6-48.3173.6-61.90000110.8E84 Y85 R86 E90 K91 E92E84-T88 PolarHBondContact O-N 3.47Å; E84-T88 VanDerWaalsContact O-N 3.12Å; E84-T88 PolarHBondContact O-OG1 3.4Å; Y85-T88 WeakPolarHBondContact O-CB 3.36Å; Y85-T88 PolarHBondContact O-N 3.21Å; Y85-T88 VanDerWaalsContact O-N 3.14Å; R86-T88 PolarHBondContact O-N 3.24Å; T88-E90 VanDerWaalsContact C-N 3.33Å; T88-E90 PolarHBondContact O-N 2.9Å; T88-K91 WeakPolarHBondContact O-CB 3.43Å; T88-K91 PolarHBondContact O-N 2.86Å; T88-E92 PolarHBondContact O-N 3.45Å; T88-E92 VanDerWaalsContact O-N 3.1Å
89V96.4Very high95.3Very high6 Ų670.9 Ų70.94%0.03633%0.334CS..Hα-helixtrans-63.3-38.4177.1-179.60000111.8W60 I63 Y85 R86 K91 E92 L93W60-V89 HydrophobicContact CB-CG1 3.87Å; I63-V89 HydrophobicContact CD1-CB 4.38Å; I63-V89 HydrophobicContact CD1-CG2 3.57Å; Y85-V89 PolarHBondContact O-N 2.87Å; Y85-V89 VanDerWaalsContact O-N 3.14Å; R86-V89 PolarHBondContact O-N 2.8Å; R86-V89 VanDerWaalsContact O-N 3.11Å; V89-K91 VanDerWaalsContact C-N 3.32Å; V89-K91 PolarHBondContact O-N 3.14Å; V89-E92 PolarHBondContact O-N 2.87Å; V89-L93 HydrophobicContact CG1-CD1 4.28Å; V89-L93 WeakPolarHBondContact O-CG 3.4Å; V89-L93 PolarHBondContact O-N 3.39Å
90E95.3Very high95.3Very high30 Ų3069.9 Ų69.914%0.1433%0.328CS..Hα-helixtrans-62.8-37.2175-73.6174176.300112.8W60 R86 T88 L93 K94 F131W60-E90 PolarHBondContact NE1-OE1 3.46Å; R86-E90 WeakPolarHBondContact CD-OE1 3.28Å; R86-E90 HydrophobicContact CG-CG 4.3Å; R86-E90 WeakPolarHBondContact CG-OE1 3.2Å; R86-E90 IonicContact CZ-OE1 3.25Å; R86-E90 IonicContact NE-OE1 2.8Å; R86-E90 VanDerWaalsContact NH1-CD 3.34Å; R86-E90 IonicContact NH1-OE1 2.87Å; R86-E90 PolarHBondContact NH1-OE1 3.17Å; R86-E90 IonicContact NH1-OE2 3.44Å; R86-E90 PolarHBondContact NH1-OE2 3.46Å; R86-E90 WeakPolarHBondContact O-CG 3.42Å; R86-E90 PolarHBondContact O-N 2.69Å; T88-E90 VanDerWaalsContact C-N 3.33Å; T88-E90 PolarHBondContact O-N 2.9Å; E90-L93 PolarHBondContact O-N 3.12Å; E90-K94 VanDerWaalsContact O-CB 3.29Å; E90-K94 WeakPolarHBondContact O-CB 3.34Å; E90-K94 PolarHBondContact O-N 2.69Å; E90-F131 HydrophobicContact CB-CD2 4.02Å; E90-F131 HydrophobicContact CB-CE2 4.31Å; E90-F131 HydrophobicContact CG-CB 4.29Å; E90-F131 HydrophobicContact CG-CD2 3.88Å; E90-F131 HydrophobicContact CG-CG 4.32Å
91K95.9Very high95.2Very high156 Ų15665 Ų6568%0.67831%0.308SS*.Hα-helixtrans-65.5-42.4174.1-74.9172.6-178.4179.10111.6K87 T88 V89 K94 S95K87-K91 WeakPolarHBondContact O-CG 3.43Å; K87-K91 PolarHBondContact O-N 3.43Å; K87-K91 VanDerWaalsContact O-N 3.07Å; T88-K91 WeakPolarHBondContact O-CB 3.43Å; T88-K91 PolarHBondContact O-N 2.86Å; V89-K91 VanDerWaalsContact C-N 3.32Å; V89-K91 PolarHBondContact O-N 3.14Å; K91-K94 PolarHBondContact O-N 3.33Å; K91-S95 WeakPolarHBondContact O-CB 3.5Å; K91-S95 PolarHBondContact O-N 3.25Å
92E95.8Very high95.2Very high80 Ų8062.3 Ų62.337%0.37430%0.296SS..Hα-helixtrans-61-48.4174.6-68.2178.4-157.400111R56 T88 V89 K94 S95 I96R56-E92 HydrophobicContact CG-CB 4.32Å; R56-E92 IonicContact NE-OE2 2.69Å; R56-E92 PolarHBondContact NE-OE2 3.29Å; T88-E92 PolarHBondContact O-N 3.45Å; T88-E92 VanDerWaalsContact O-N 3.1Å; V89-E92 PolarHBondContact O-N 2.87Å; E92-K94 PolarHBondContact O-N 3.48Å; E92-S95 WeakPolarHBondContact O-CB 3.34Å; E92-S95 PolarHBondContact O-N 3.36Å; E92-I96 WeakPolarHBondContact O-CD1 3.41Å; E92-I96 VanDerWaalsContact O-CG1 3.28Å; E92-I96 WeakPolarHBondContact O-CG1 3.39Å; E92-I96 PolarHBondContact O-N 3.38Å
93L94.7Very high95Very high1 Ų161.1 Ų61.11%0.00529%0.29CS..Hα-helixtrans-57.3-47.6176.1-79171.3000112.2I53 R56 R57 W60 V89 E90 S95 I96 C97 F131I53-L93 HydrophobicContact CG1-CD2 3.91Å; R56-L93 HydrophobicContact CB-CD2 3.45Å; R56-L93 VanDerWaalsContact CB-CD2 3.45Å; R56-L93 HydrophobicContact CB-CG 3.84Å; R57-L93 HydrophobicContact CG-CD2 3.75Å; W60-L93 HydrophobicContact CB-CD1 3.78Å; W60-L93 HydrophobicContact CG-CD1 4.01Å; V89-L93 HydrophobicContact CG1-CD1 4.28Å; V89-L93 WeakPolarHBondContact O-CG 3.4Å; V89-L93 PolarHBondContact O-N 3.39Å; E90-L93 PolarHBondContact O-N 3.12Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 3.16Å; L93-I96 PolarHBondContact O-N 3.01Å; L93-C97 WeakPolarHBondContact O-CB 3.47Å; L93-C97 PolarHBondContact O-N 2.87Å; L93-C97 PolarHBondContact O-SG 3.46Å; L93-F131 HydrophobicContact CB-CD1 4.39Å; L93-F131 HydrophobicContact CB-CE1 3.73Å; L93-F131 HydrophobicContact CB-CZ 3.8Å; L93-F131 HydrophobicContact CD1-CD1 4.13Å; L93-F131 HydrophobicContact CD1-CE1 4.28Å
94K94.8Very high94.7Very high88 Ų8856.6 Ų56.638%0.38327%0.273SS..Hα-helixtrans-61.7-41.2178.1-170.5166.9-174.9168.20111E90 K91 E92 C97 N98 L128 F131 D136E90-K94 VanDerWaalsContact O-CB 3.29Å; E90-K94 WeakPolarHBondContact O-CB 3.34Å; E90-K94 PolarHBondContact O-N 2.69Å; K91-K94 PolarHBondContact O-N 3.33Å; E92-K94 PolarHBondContact O-N 3.48Å; K94-C97 PolarHBondContact O-N 3.22Å; K94-N98 WeakPolarHBondContact O-CB 3.27Å; K94-N98 PolarHBondContact O-N 3.19Å; K94-N98 PolarHBondContact O-ND2 3.29Å; K94-L128 HydrophobicContact CB-CD2 4.35Å; K94-L128 HydrophobicContact CG-CD2 4.03Å; K94-F131 HydrophobicContact CB-CE2 4.14Å; K94-F131 HydrophobicContact CB-CZ 4.05Å; K94-D136 IonicContact NZ-OD2 2.57Å; K94-D136 PolarHBondContact NZ-OD2 3.12Å
95S95.7Very high94.4Very high79 Ų7953.4 Ų53.455%0.55226%0.26SS*.Hα-helixtrans-62.3-47.1175.9-168.40000111.8K91 E92 L93 N98 D99K91-S95 WeakPolarHBondContact O-CB 3.5Å; K91-S95 PolarHBondContact O-N 3.25Å; E92-S95 WeakPolarHBondContact O-CB 3.34Å; E92-S95 PolarHBondContact O-N 3.36Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 3.16Å; S95-N98 PolarHBondContact O-N 3.27Å; S95-D99 VanDerWaalsContact O-CB 3.26Å; S95-D99 WeakPolarHBondContact O-CB 3.4Å; S95-D99 PolarHBondContact O-N 3.43Å
96I94.9Very high94Very high22 Ų2252 Ų5211%0.11326%0.257CS..Hα-helixtrans-63.2-44.3179.7-65.1156.1000110.7Y49 V52 I53 R56 E92 L93 D99 I100Y49-I96 HydrophobicContact CD1-CG2 4.17Å; V52-I96 HydrophobicContact CG1-CD1 3.75Å; V52-I96 HydrophobicContact CG1-CG1 4.05Å; V52-I96 HydrophobicContact CG1-CG2 4.2Å; I53-I96 HydrophobicContact CB-CG2 4.12Å; I53-I96 HydrophobicContact CD1-CG2 4.42Å; I53-I96 HydrophobicContact CG1-CG2 4.36Å; R56-I96 HydrophobicContact CB-CD1 4.47Å; R56-I96 HydrophobicContact CG-CD1 4.04Å; E92-I96 WeakPolarHBondContact O-CD1 3.41Å; E92-I96 VanDerWaalsContact O-CG1 3.28Å; E92-I96 WeakPolarHBondContact O-CG1 3.39Å; E92-I96 PolarHBondContact O-N 3.38Å; L93-I96 PolarHBondContact O-N 3.01Å; I96-D99 WeakPolarHBondContact O-CB 3.41Å; I96-D99 PolarHBondContact O-N 2.9Å; I96-I100 WeakPolarHBondContact O-CG2 3.31Å; I96-I100 PolarHBondContact O-N 3.31Å
97C94.3Very high93.6Very high0 Ų051.4 Ų51.40%026%0.256CS..Hα-helixtrans-64-47.1178.6-650000111.7I53 L93 K94 D99 I100 L101 L128I53-C97 WeakPolarHBondContact CD1-SG 3.3Å; L93-C97 WeakPolarHBondContact O-CB 3.47Å; L93-C97 PolarHBondContact O-N 2.87Å; L93-C97 PolarHBondContact O-SG 3.46Å; K94-C97 PolarHBondContact O-N 3.22Å; C97-D99 PolarHBondContact O-N 3.39Å; C97-I100 WeakPolarHBondContact O-CG2 3.35Å; C97-I100 PolarHBondContact O-N 2.99Å; C97-L101 WeakPolarHBondContact O-CB 3.46Å; C97-L101 WeakPolarHBondContact O-CD1 3.16Å; C97-L101 WeakPolarHBondContact O-CG 3.34Å; C97-L101 PolarHBondContact O-N 3.42Å; C97-L128 HydrophobicContact CB-CD1 4.11Å; C97-L128 HydrophobicContact CB-CD2 3.51Å; C97-L128 HydrophobicContact CB-CG 3.57Å
98N94.5Very high93Very high70 Ų7046.5 Ų46.537%0.37424%0.235SC..Hα-helixtrans-63.6-35.2178.7-72.2-10.8000111.5K94 S95 L101 D102K94-N98 WeakPolarHBondContact O-CB 3.27Å; K94-N98 PolarHBondContact O-N 3.19Å; K94-N98 PolarHBondContact O-ND2 3.29Å; S95-N98 PolarHBondContact O-N 3.27Å; N98-L101 PolarHBondContact O-N 3.17Å; N98-D102 WeakPolarHBondContact O-CB 3.38Å; N98-D102 PolarHBondContact O-N 3.38Å
99D94.8Very high92.3Very high48 Ų4845.4 Ų45.426%0.25723%0.227SC..Hα-helixtrans-61.9-48.4179.7-170.558000112.8K28 Y49 S95 I96 C97 D102 V103K28-D99 WeakPolarHBondContact CD-OD2 3.16Å; K28-D99 WeakPolarHBondContact CE-OD1 3.37Å; K28-D99 VanDerWaalsContact CE-OD2 3.23Å; K28-D99 WeakPolarHBondContact CE-OD2 3.49Å; K28-D99 IonicContact NZ-OD1 2.66Å; K28-D99 PolarHBondContact NZ-OD1 3.07Å; K28-D99 IonicContact NZ-OD2 3.44Å; K28-D99 PolarHBondContact NZ-OD2 3.05Å; Y49-D99 PolarHBondContact OH-OD2 3.03Å; S95-D99 VanDerWaalsContact O-CB 3.26Å; S95-D99 WeakPolarHBondContact O-CB 3.4Å; S95-D99 PolarHBondContact O-N 3.43Å; I96-D99 WeakPolarHBondContact O-CB 3.41Å; I96-D99 PolarHBondContact O-N 2.9Å; C97-D99 PolarHBondContact O-N 3.39Å; D99-D102 PolarHBondContact O-N 3.06Å; D99-V103 WeakPolarHBondContact O-CG2 3.2Å; D99-V103 PolarHBondContact O-N 3.3Å; D99-V103 VanDerWaalsContact O-N 3.15Å
100I93.4Very high91.4Very high0 Ų051.9 Ų51.90%026%0.26CS..Hα-helixtrans-72.5-34.8176.3-178.356000112.5L45 Y49 I96 C97 D102 V103 L104 L120 Y124L45-I100 HydrophobicContact CD2-CD1 4.41Å; Y49-I100 HydrophobicContact CD1-CB 3.84Å; Y49-I100 HydrophobicContact CD1-CG1 4.44Å; Y49-I100 HydrophobicContact CD1-CG2 4.32Å; Y49-I100 HydrophobicContact CD2-CB 4.43Å; Y49-I100 HydrophobicContact CD2-CD1 3.85Å; Y49-I100 HydrophobicContact CD2-CG1 4.3Å; Y49-I100 HydrophobicContact CE1-CB 3.63Å; Y49-I100 HydrophobicContact CE1-CG2 4.37Å; Y49-I100 HydrophobicContact CE2-CB 4.24Å; Y49-I100 HydrophobicContact CE2-CD1 3.69Å; Y49-I100 HydrophobicContact CE2-CG1 4.34Å; Y49-I100 HydrophobicContact CG-CB 4.22Å; Y49-I100 HydrophobicContact CG-CD1 4.37Å; Y49-I100 HydrophobicContact CG-CG1 4.33Å; I96-I100 WeakPolarHBondContact O-CG2 3.31Å; I96-I100 PolarHBondContact O-N 3.31Å; C97-I100 WeakPolarHBondContact O-CG2 3.35Å; C97-I100 PolarHBondContact O-N 2.99Å; I100-D102 VanDerWaalsContact C-N 3.29Å; I100-D102 PolarHBondContact O-N 3.14Å; I100-V103 HydrophobicContact CD1-CB 4.4Å; I100-V103 PolarHBondContact O-N 3.48Å; I100-L104 HydrophobicContact CD1-CD1 4.32Å; I100-L104 HydrophobicContact CD1-CG 4.15Å; I100-L104 HydrophobicContact CG1-CD1 3.95Å; I100-L104 HydrophobicContact CG1-CG 4.3Å; I100-L104 WeakPolarHBondContact O-CB 3.42Å; I100-L104 VanDerWaalsContact O-CG 3.27Å; I100-L104 WeakPolarHBondContact O-CG 3.44Å; I100-L104 PolarHBondContact O-N 3.3Å; I100-L120 HydrophobicContact CD1-CD2 4.38Å; I100-Y124 HydrophobicContact CB-CD2 4.32Å; I100-Y124 HydrophobicContact CB-CE2 4.26Å; I100-Y124 HydrophobicContact CG1-CD2 3.8Å; I100-Y124 HydrophobicContact CG1-CE2 3.55Å; I100-Y124 HydrophobicContact CG1-CG 4.48Å; I100-Y124 HydrophobicContact CG2-CD1 3.32Å; I100-Y124 HydrophobicContact CG2-CD2 3.49Å; I100-Y124 VanDerWaalsContact CG2-CD2 3.49Å; I100-Y124 HydrophobicContact CG2-CE1 3.59Å; I100-Y124 HydrophobicContact CG2-CE2 3.74Å; I100-Y124 HydrophobicContact CG2-CG 3.3Å
101L92.8Very high90.2Very high9 Ų952 Ų525%0.04727%0.267CS..Hα-helixtrans-61.4-40.9174.8-72.9170.9000111C97 N98 L104 D105 K121 L128C97-L101 WeakPolarHBondContact O-CB 3.46Å; C97-L101 WeakPolarHBondContact O-CD1 3.16Å; C97-L101 WeakPolarHBondContact O-CG 3.34Å; C97-L101 PolarHBondContact O-N 3.42Å; N98-L101 PolarHBondContact O-N 3.17Å; L101-L104 PolarHBondContact O-N 3.14Å; L101-D105 WeakPolarHBondContact O-CB 3.45Å; L101-D105 PolarHBondContact O-N 3.36Å; L101-K121 HydrophobicContact CD2-CG 3.87Å; L101-L128 HydrophobicContact CD1-CD1 3.66Å
102D93.9Very high88.9Confident78 Ų7846.1 Ų46.142%0.41725%0.247SC..Hα-helixtrans-62.5-44.1174-96.625.2000112N98 D99 I100 L104 D105 K106N98-D102 WeakPolarHBondContact O-CB 3.38Å; N98-D102 PolarHBondContact O-N 3.38Å; D99-D102 PolarHBondContact O-N 3.06Å; I100-D102 VanDerWaalsContact C-N 3.29Å; I100-D102 PolarHBondContact O-N 3.14Å; D102-L104 VanDerWaalsContact C-N 3.32Å; D102-L104 PolarHBondContact O-N 3.38Å; D102-D105 PolarHBondContact O-N 2.59Å; D102-K106 VanDerWaalsContact O-CB 3.23Å; D102-K106 WeakPolarHBondContact O-CB 3.2Å; D102-K106 VanDerWaalsContact O-CG 3.3Å; D102-K106 WeakPolarHBondContact O-CG 3.19Å; D102-K106 PolarHBondContact O-N 3.09Å; D102-K106 IonicContact OD2-NZ 3.06Å; D102-K106 PolarHBondContact OD2-NZ 3.28Å
103V91.5Very high87.5Confident8 Ų847.2 Ų47.25%0.04826%0.259CS..Hα-helixtrans-63.1-40.8176.8171.70000111K28 A31 D99 I100 H107 L108K28-V103 HydrophobicContact CG-CG2 4.21Å; A31-V103 HydrophobicContact CB-CG1 3.62Å; D99-V103 WeakPolarHBondContact O-CG2 3.2Å; D99-V103 PolarHBondContact O-N 3.3Å; D99-V103 VanDerWaalsContact O-N 3.15Å; I100-V103 HydrophobicContact CD1-CB 4.4Å; I100-V103 PolarHBondContact O-N 3.48Å; V103-H107 WeakPolarHBondContact O-CB 3.43Å; V103-H107 PolarHBondContact O-N 3.07Å; V103-L108 HydrophobicContact CG1-CD1 3.92Å; V103-L108 HydrophobicContact CG1-CG 4.17Å; V103-L108 PolarHBondContact O-N 3.26Å
104L89.8Confident86.2Confident0 Ų049.3 Ų49.30%027%0.272CS..Iπ-helixtrans-63.7-49.5177.4-75.5164.9000111.4I100 L101 D102 L108 I109 L120 K121 Y124I100-L104 HydrophobicContact CD1-CD1 4.32Å; I100-L104 HydrophobicContact CD1-CG 4.15Å; I100-L104 HydrophobicContact CG1-CD1 3.95Å; I100-L104 HydrophobicContact CG1-CG 4.3Å; I100-L104 WeakPolarHBondContact O-CB 3.42Å; I100-L104 VanDerWaalsContact O-CG 3.27Å; I100-L104 WeakPolarHBondContact O-CG 3.44Å; I100-L104 PolarHBondContact O-N 3.3Å; L101-L104 PolarHBondContact O-N 3.14Å; D102-L104 VanDerWaalsContact C-N 3.32Å; D102-L104 PolarHBondContact O-N 3.38Å; L104-L108 HydrophobicContact CD2-CB 4.11Å; L104-L108 HydrophobicContact CD2-CD1 3.81Å; L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 PolarHBondContact O-N 2.92Å; L104-I109 HydrophobicContact CB-CD1 4.09Å; L104-I109 HydrophobicContact CB-CG1 4.39Å; L104-I109 VanDerWaalsContact O-CB 3.31Å; L104-I109 WeakPolarHBondContact O-CB 3.41Å; L104-I109 WeakPolarHBondContact O-CG1 3.46Å; L104-I109 PolarHBondContact O-N 3.02Å; L104-L120 HydrophobicContact CD1-CB 4.26Å; L104-L120 HydrophobicContact CD1-CD2 4.28Å; L104-L120 HydrophobicContact CD1-CG 4.15Å; L104-L120 HydrophobicContact CD2-CB 4.37Å; L104-L120 HydrophobicContact CD2-CD2 4.08Å; L104-K121 HydrophobicContact CD1-CB 4.16Å; L104-Y124 HydrophobicContact CD1-CD2 4.49Å
105D89.4Confident85.1Confident68 Ų6845.7 Ų45.736%0.36426%0.26SS..Iπ-helixtrans-72.5-36-175.4-77.9-12.9000113L101 D102 I109 K121L101-D105 WeakPolarHBondContact O-CB 3.45Å; L101-D105 PolarHBondContact O-N 3.36Å; D102-D105 PolarHBondContact O-N 2.59Å; D105-I109 WeakPolarHBondContact OD1-CD1 3.48Å; D105-K121 WeakPolarHBondContact OD1-CE 3.37Å; D105-K121 IonicContact OD1-NZ 2.66Å; D105-K121 PolarHBondContact OD1-NZ 2.86Å; D105-K121 IonicContact OD2-NZ 3.63Å; D105-K121 PolarHBondContact OD2-NZ 3.2Å
106K88.6Confident84.2Confident116 Ų11644.2 Ų44.250%0.50424%0.244SC..Iπ-helixtrans-84.6-32.3-176.5-68.3170179.4162.10113.9D102 L110D102-K106 VanDerWaalsContact O-CB 3.23Å; D102-K106 WeakPolarHBondContact O-CB 3.2Å; D102-K106 VanDerWaalsContact O-CG 3.3Å; D102-K106 WeakPolarHBondContact O-CG 3.19Å; D102-K106 PolarHBondContact O-N 3.09Å; D102-K106 IonicContact OD2-NZ 3.06Å; D102-K106 PolarHBondContact OD2-NZ 3.28Å; K106-L110 WeakPolarHBondContact O-CD1 3.41Å
107H86.2Confident83.4Confident36 Ų3643.8 Ų43.817%0.16724%0.243CC..Iπ-helixtrans-124.7-52-168.2-54.7-61.8000112.5A31 S32 D34 V103 A111A31-H107 WeakPolarHBondContact O-CB 3.22Å; S32-H107 PolarHBondContact OG-CD2 3Å; S32-H107 PolarHBondContact OG-NE2 3.26Å; S32-H107 VanDerWaalsContact OG-NE2 3.07Å; D34-H107 IonicContact OD1-CE1 3.86Å; D34-H107 IonicContact OD1-CG 2.59Å; D34-H107 IonicContact OD1-ND1 3.17Å; D34-H107 PolarHBondContact OD1-ND1 3.14Å; V103-H107 WeakPolarHBondContact O-CB 3.43Å; V103-H107 PolarHBondContact O-N 3.07Å; H107-A111 VanDerWaalsContact O-CB 3.3Å; H107-A111 WeakPolarHBondContact O-CB 3.42Å; H107-A111 PolarHBondContact O-N 3.49Å
108L82.8Confident82.8Confident15 Ų1547.3 Ų47.38%0.07926%0.259CS..Iπ-helixtrans-83.4-43.5-165.7-57.3177000113.3A31 L37 L45 V103 L104 L110 A111 A112A31-L108 HydrophobicContact CB-CD2 3.93Å; A31-L108 HydrophobicContact CB-CG 4.41Å; L37-L108 HydrophobicContact CD1-CD1 4.5Å; L37-L108 HydrophobicContact CD1-CD2 3.53Å; L37-L108 HydrophobicContact CG-CD2 3.78Å; L45-L108 HydrophobicContact CD2-CD1 3.48Å; L45-L108 VanDerWaalsContact CD2-CD1 3.48Å; V103-L108 HydrophobicContact CG1-CD1 3.92Å; V103-L108 HydrophobicContact CG1-CG 4.17Å; V103-L108 PolarHBondContact O-N 3.26Å; L104-L108 HydrophobicContact CD2-CB 4.11Å; L104-L108 HydrophobicContact CD2-CD1 3.81Å; L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 PolarHBondContact O-N 2.92Å; L108-L110 VanDerWaalsContact C-N 3.31Å; L108-L110 PolarHBondContact O-N 2.85Å; L108-A111 PolarHBondContact O-N 3.39Å; L108-A112 WeakPolarHBondContact O-CA 3.36Å; L108-A112 WeakPolarHBondContact O-CB 3.39Å; L108-A112 PolarHBondContact O-N 3.02Å
109I82.4Confident82.2Confident43 Ų4344.8 Ų44.822%0.22125%0.245CC..Hα-helixtrans-69.3-32.6-178.9-68.7171.9000111.1L104 D105 A111 K121L104-I109 HydrophobicContact CB-CD1 4.09Å; L104-I109 HydrophobicContact CB-CG1 4.39Å; L104-I109 VanDerWaalsContact O-CB 3.31Å; L104-I109 WeakPolarHBondContact O-CB 3.41Å; L104-I109 WeakPolarHBondContact O-CG1 3.46Å; L104-I109 PolarHBondContact O-N 3.02Å; D105-I109 WeakPolarHBondContact OD1-CD1 3.48Å; I109-A111 VanDerWaalsContact C-N 3.34Å; I109-K121 HydrophobicContact CD1-CB 4.36Å; I109-K121 HydrophobicContact CD1-CD 3.72Å
110L78Confident81.7Confident142 Ų14243.9 Ų43.974%0.74324%0.24SC*.Hα-helixtrans-70.8-32.3175.9-62.4179.8000112.2K106 L108K106-L110 WeakPolarHBondContact O-CD1 3.41Å; L108-L110 VanDerWaalsContact C-N 3.31Å; L108-L110 PolarHBondContact O-N 2.85Å
111A69.6Low81.6Confident34 Ų3446 Ų4628%0.28125%0.25SC..Hα-helixtrans-92.4-16.7179.500000113.8H107 L108 I109H107-A111 VanDerWaalsContact O-CB 3.3Å; H107-A111 WeakPolarHBondContact O-CB 3.42Å; H107-A111 PolarHBondContact O-N 3.49Å; L108-A111 PolarHBondContact O-N 3.39Å; I109-A111 VanDerWaalsContact C-N 3.34Å
112A69.3Low81.5Confident32 Ų3245.6 Ų45.626%0.26425%0.248SC..  trans-77129.2-171.800000112.2L108L108-A112 WeakPolarHBondContact O-CA 3.36Å; L108-A112 WeakPolarHBondContact O-CB 3.39Å; L108-A112 PolarHBondContact O-N 3.02Å
113T65.4Low81.3Confident102 Ų10242.5 Ų42.563%0.62623%0.231SC*.SBendtrans-87.1-14.5168.756.20000112.8E36E36-T113 PolarHBondContact OE1-N 3.31Å; E36-T113 PolarHBondContact OE1-OG1 3.49Å
114T67.2Low81.3Confident46 Ų4642.4 Ų42.428%0.28223%0.23SC..SBendtrans-118.6160.1-173.980.50000113.6R42 E116R42-T114 PolarHBondContact NH1-OG1 3.17Å; R42-T114 VanDerWaalsContact NH1-OG1 3.14Å; T114-E116 PolarHBondContact O-N 3.07Å
115G71.7Confident81.5Confident11 Ų1143.3 Ų43.311%0.11323%0.234CC..THydrogen-bonded Turntrans-67.6-10.4-178.700000116.4S117 K118 V119G115-S117 PolarHBondContact O-N 3.46Å; G115-K118 WeakPolarHBondContact O-CB 3.38Å; G115-K118 PolarHBondContact O-N 3.2Å; G115-K118 VanDerWaalsContact O-N 3.07Å; G115-V119 PolarHBondContact O-N 3Å
116E76.6Confident81.7Confident49 Ų4940.6 Ų40.623%0.22922%0.218CC..Hα-helixtrans-57.7-44.3-173-73.5172.9-132.600113.7R42 T114 K118 V119 L120 I165R42-E116 VanDerWaalsContact CZ-CD 3.41Å; R42-E116 IonicContact CZ-OE1 3.31Å; R42-E116 VanDerWaalsContact CZ-OE1 3.31Å; R42-E116 IonicContact CZ-OE2 3.6Å; R42-E116 IonicContact NE-OE2 2.68Å; R42-E116 PolarHBondContact NE-OE2 3.44Å; R42-E116 VanDerWaalsContact NH1-CD 3.34Å; R42-E116 IonicContact NH1-OE1 3.25Å; R42-E116 PolarHBondContact NH1-OE1 3.48Å; R42-E116 IonicContact NH1-OE2 3.22Å; R42-E116 PolarHBondContact NH1-OE2 2.87Å; R42-E116 IonicContact NH2-OE1 2.78Å; R42-E116 PolarHBondContact NH2-OE1 3.26Å; R42-E116 IonicContact NH2-OE2 3.76Å; R42-E116 PolarHBondContact NH2-OE2 3.16Å; T114-E116 PolarHBondContact O-N 3.07Å; E116-K118 PolarHBondContact O-N 3.23Å; E116-V119 WeakPolarHBondContact O-CB 3.45Å; E116-V119 PolarHBondContact O-N 3.39Å; E116-V119 VanDerWaalsContact O-N 3.13Å; E116-L120 PolarHBondContact O-N 3.35Å; E116-L120 VanDerWaalsContact O-N 3.07Å; E116-I165 HydrophobicContact CG-CD1 3.6Å; E116-I165 HydrophobicContact CG-CG1 4.31Å; E116-I165 HydrophobicContact CG-CG2 3.96Å; E116-I165 WeakPolarHBondContact OE1-CD1 3.29Å
117S78.6Confident81.8Confident13 Ų1336.6 Ų36.69%0.09120%0.2CC..Hα-helixtrans-63.3-29.5179.8-56.30000112.2G115 K121G115-S117 PolarHBondContact O-N 3.46Å; S117-K121 PolarHBondContact O-N 2.87Å; S117-K121 VanDerWaalsContact O-N 3.11Å
118K82.6Confident82.2Confident74 Ų7435.6 Ų35.632%0.32220%0.196SC..Hα-helixtrans-74.6-36.3175.8-64.8179.7179.9176.30112G115 E116 L120 K121 G122 A150 A151 I154G115-K118 WeakPolarHBondContact O-CB 3.38Å; G115-K118 PolarHBondContact O-N 3.2Å; G115-K118 VanDerWaalsContact O-N 3.07Å; E116-K118 PolarHBondContact O-N 3.23Å; K118-L120 VanDerWaalsContact C-N 3.32Å; K118-K121 PolarHBondContact O-N 3.04Å; K118-G122 PolarHBondContact O-N 3.02Å; K118-G122 VanDerWaalsContact O-N 3.12Å; K118-A150 HydrophobicContact CD-CB 4.33Å; K118-A151 HydrophobicContact CB-CB 3.89Å; K118-I154 HydrophobicContact CD-CD1 3.79Å; K118-I154 VanDerWaalsContact NZ-CD1 3.25Å
119V82.2Confident82.7Confident16 Ų1634.9 Ų34.910%0.09719%0.193CC..Hα-helixtrans-58.5-48.9171.7-176.90000109.7G115 E116 K121 G122 D123 A151 L169G115-V119 PolarHBondContact O-N 3Å; E116-V119 WeakPolarHBondContact O-CB 3.45Å; E116-V119 PolarHBondContact O-N 3.39Å; E116-V119 VanDerWaalsContact O-N 3.13Å; V119-K121 VanDerWaalsContact C-N 3.31Å; V119-K121 PolarHBondContact O-N 3.36Å; V119-G122 WeakPolarHBondContact O-CA 3.23Å; V119-G122 PolarHBondContact O-N 3.48Å; V119-D123 PolarHBondContact O-N 2.95Å; V119-D123 VanDerWaalsContact O-N 3.13Å; V119-A151 HydrophobicContact CG2-CB 3.75Å; V119-L169 HydrophobicContact CG1-CB 4.29Å; V119-L169 HydrophobicContact CG1-CD1 4.09Å; V119-L169 HydrophobicContact CG2-CB 4.15Å; V119-L169 HydrophobicContact CG2-CD1 4.06Å; V119-L169 HydrophobicContact CG2-CD2 4.16Å; V119-L169 HydrophobicContact CG2-CG 4.34Å
120L84.6Confident83.1Confident29 Ų2934.1 Ų34.115%0.15219%0.188CC..Hα-helixtrans-61.6-39.9-178.6-164.564.2000111.8I100 L104 E116 K118 G122 D123 Y124I100-L120 HydrophobicContact CD1-CD2 4.38Å; L104-L120 HydrophobicContact CD1-CB 4.26Å; L104-L120 HydrophobicContact CD1-CD2 4.28Å; L104-L120 HydrophobicContact CD1-CG 4.15Å; L104-L120 HydrophobicContact CD2-CB 4.37Å; L104-L120 HydrophobicContact CD2-CD2 4.08Å; E116-L120 PolarHBondContact O-N 3.35Å; E116-L120 VanDerWaalsContact O-N 3.07Å; K118-L120 VanDerWaalsContact C-N 3.32Å; L120-G122 VanDerWaalsContact C-N 3.32Å; L120-G122 PolarHBondContact O-N 3.16Å; L120-D123 PolarHBondContact O-N 3.1Å; L120-Y124 HydrophobicContact CD1-CD2 4.25Å; L120-Y124 HydrophobicContact CD1-CE2 3.54Å; L120-Y124 HydrophobicContact CD2-CE2 4.25Å; L120-Y124 HydrophobicContact CG-CD2 4.03Å; L120-Y124 HydrophobicContact CG-CE2 3.62Å; L120-Y124 WeakPolarHBondContact O-CD2 3.24Å; L120-Y124 PolarHBondContact O-N 3.27Å
121K89.6Confident83.7Confident46 Ų4628.2 Ų28.220%0.216%0.157CC..Hα-helixtrans-58.7-42.3173-178.9167.2-175.7166.70112.3L101 L104 D105 I109 S117 K118 V119 D123 Y124 H125 A147L101-K121 HydrophobicContact CD2-CG 3.87Å; L104-K121 HydrophobicContact CD1-CB 4.16Å; D105-K121 WeakPolarHBondContact OD1-CE 3.37Å; D105-K121 IonicContact OD1-NZ 2.66Å; D105-K121 PolarHBondContact OD1-NZ 2.86Å; D105-K121 IonicContact OD2-NZ 3.63Å; D105-K121 PolarHBondContact OD2-NZ 3.2Å; I109-K121 HydrophobicContact CD1-CB 4.36Å; I109-K121 HydrophobicContact CD1-CD 3.72Å; S117-K121 PolarHBondContact O-N 2.87Å; S117-K121 VanDerWaalsContact O-N 3.11Å; K118-K121 PolarHBondContact O-N 3.04Å; V119-K121 VanDerWaalsContact C-N 3.31Å; V119-K121 PolarHBondContact O-N 3.36Å; K121-D123 VanDerWaalsContact C-N 3.34Å; K121-D123 PolarHBondContact O-N 3.44Å; K121-Y124 PolarHBondContact O-N 3.36Å; K121-H125 WeakPolarHBondContact CE-NE2 3.18Å; K121-H125 PolarHBondContact O-CD2 3.01Å; K121-H125 VanDerWaalsContact O-CD2 3.32Å; K121-H125 PolarHBondContact O-N 3.07Å; K121-H125 VanDerWaalsContact O-N 3.17Å; K121-A147 HydrophobicContact CB-CB 4.28Å; K121-A147 HydrophobicContact CG-CB 4.07Å
122G90.9Very high84.8Confident0 Ų027.4 Ų27.40%015%0.15CC..Hα-helixtrans-58.7-44175.600000112.7K118 V119 L120 R126 S144K118-G122 PolarHBondContact O-N 3.02Å; K118-G122 VanDerWaalsContact O-N 3.12Å; V119-G122 WeakPolarHBondContact O-CA 3.23Å; V119-G122 PolarHBondContact O-N 3.48Å; L120-G122 VanDerWaalsContact C-N 3.32Å; L120-G122 PolarHBondContact O-N 3.16Å; G122-R126 WeakPolarHBondContact O-CB 3.34Å; G122-R126 PolarHBondContact O-N 3.4Å; G122-S144 PolarHBondContact O-OG 2.89Å
123D90Very high85.7Confident12 Ų1231.2 Ų31.26%0.06417%0.17CC..Hα-helixtrans-62.7-45179.2-76.3-39.5000113.1V119 L120 K121 R126 Y127 Y148 N172V119-D123 PolarHBondContact O-N 2.95Å; V119-D123 VanDerWaalsContact O-N 3.13Å; L120-D123 PolarHBondContact O-N 3.1Å; K121-D123 VanDerWaalsContact C-N 3.34Å; K121-D123 PolarHBondContact O-N 3.44Å; D123-R126 WeakPolarHBondContact O-CB 3.47Å; D123-R126 PolarHBondContact O-N 2.94Å; D123-R126 IonicContact OD1-CZ 2.99Å; D123-R126 IonicContact OD1-NE 3.37Å; D123-R126 IonicContact OD1-NH2 3.45Å; D123-R126 PolarHBondContact OD1-NH2 3.07Å; D123-Y127 HydrophobicContact CB-CE2 4.1Å; D123-Y127 WeakPolarHBondContact O-CD2 3.37Å; D123-Y127 VanDerWaalsContact O-CG 3.22Å; D123-Y127 PolarHBondContact O-N 2.79Å; D123-Y148 WeakPolarHBondContact CA-OH 3.33Å; D123-Y148 PolarHBondContact N-OH 2.92Å; D123-Y148 PolarHBondContact OD1-OH 3.25Å; D123-N172 WeakPolarHBondContact OD1-CB 3.5Å; D123-N172 PolarHBondContact OD1-ND2 3.35Å; D123-N172 PolarHBondContact OD2-ND2 3.27Å
124Y90.9Very high87.1Confident6 Ų629.2 Ų29.22%0.02417%0.17CC..Hα-helixtrans-72.5-33.7-179.1-72.2-75.1000113.4Y49 I53 I100 L104 L120 K121 R126 Y127 L128Y49-Y124 WeakPolarHBondContact CB-OH 3.29Å; I53-Y124 HydrophobicContact CD1-CD1 3.71Å; I53-Y124 HydrophobicContact CD1-CE1 3.65Å; I53-Y124 HydrophobicContact CG2-CE1 4.28Å; I100-Y124 HydrophobicContact CB-CD2 4.32Å; I100-Y124 HydrophobicContact CB-CE2 4.26Å; I100-Y124 HydrophobicContact CG1-CD2 3.8Å; I100-Y124 HydrophobicContact CG1-CE2 3.55Å; I100-Y124 HydrophobicContact CG1-CG 4.48Å; I100-Y124 HydrophobicContact CG2-CD1 3.32Å; I100-Y124 HydrophobicContact CG2-CD2 3.49Å; I100-Y124 VanDerWaalsContact CG2-CD2 3.49Å; I100-Y124 HydrophobicContact CG2-CE1 3.59Å; I100-Y124 HydrophobicContact CG2-CE2 3.74Å; I100-Y124 HydrophobicContact CG2-CG 3.3Å; L104-Y124 HydrophobicContact CD1-CD2 4.49Å; L120-Y124 HydrophobicContact CD1-CD2 4.25Å; L120-Y124 HydrophobicContact CD1-CE2 3.54Å; L120-Y124 HydrophobicContact CD2-CE2 4.25Å; L120-Y124 HydrophobicContact CG-CD2 4.03Å; L120-Y124 HydrophobicContact CG-CE2 3.62Å; L120-Y124 WeakPolarHBondContact O-CD2 3.24Å; L120-Y124 PolarHBondContact O-N 3.27Å; K121-Y124 PolarHBondContact O-N 3.36Å; Y124-R126 VanDerWaalsContact C-N 3.32Å; Y124-Y127 AromaticContact CD1-CD2 3.66Å; Y124-Y127 HydrophobicContact CD1-CD2 3.66Å; Y124-Y127 HydrophobicContact CD1-CE2 4.11Å; Y124-Y127 HydrophobicContact CE1-CD2 4.01Å; Y124-Y127 HydrophobicContact CE1-CE2 4.08Å; Y124-Y127 HydrophobicContact CG-CD2 4.25Å; Y124-Y127 PolarHBondContact O-N 3.22Å; Y124-L128 WeakPolarHBondContact O-CG 3.44Å; Y124-L128 PolarHBondContact O-N 3.21Å
125H94.1Very high88.3Confident19 Ų1933.5 Ų33.59%0.08819%0.191CC..Hα-helixtrans-66.6-35.1168.3-78.4-63.1000112.3K121 L128 A129 N143K121-H125 WeakPolarHBondContact CE-NE2 3.18Å; K121-H125 PolarHBondContact O-CD2 3.01Å; K121-H125 VanDerWaalsContact O-CD2 3.32Å; K121-H125 PolarHBondContact O-N 3.07Å; K121-H125 VanDerWaalsContact O-N 3.17Å; H125-L128 WeakPolarHBondContact O-CB 3.22Å; H125-L128 PolarHBondContact O-N 3.13Å; H125-A129 PolarHBondContact O-N 2.97Å; H125-N143 HydrophobicContact CB-CB 4.33Å
126R93.9Very high89.3Confident11 Ų1137 Ų374%0.04221%0.207CC..Hα-helixtrans-61.6-46.3172.2175173.361.269.75.6110.9G122 D123 Y124 L128 A129 E130 S144 Y148 F176 I180G122-R126 WeakPolarHBondContact O-CB 3.34Å; G122-R126 PolarHBondContact O-N 3.4Å; D123-R126 WeakPolarHBondContact O-CB 3.47Å; D123-R126 PolarHBondContact O-N 2.94Å; D123-R126 IonicContact OD1-CZ 2.99Å; D123-R126 IonicContact OD1-NE 3.37Å; D123-R126 IonicContact OD1-NH2 3.45Å; D123-R126 PolarHBondContact OD1-NH2 3.07Å; Y124-R126 VanDerWaalsContact C-N 3.32Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.56Å; R126-A129 WeakPolarHBondContact O-CB 3.21Å; R126-A129 PolarHBondContact O-N 3.42Å; R126-E130 IonicContact NH1-OE1 3.77Å; R126-E130 PolarHBondContact NH1-OE1 3.44Å; R126-E130 VanDerWaalsContact NH1-OE1 3.12Å; R126-E130 PolarHBondContact O-N 3.01Å; R126-E130 VanDerWaalsContact O-N 3.1Å; R126-S144 PolarHBondContact N-OG 2.91Å; R126-Y148 HydrophobicContact CB-CE2 4.42Å; R126-Y148 PolarHBondContact NE-OH 3.26Å; R126-F176 HydrophobicContact CB-CD2 4.2Å; R126-F176 HydrophobicContact CG-CD2 4.1Å; R126-I180 HydrophobicContact CG-CD1 4.29Å; R126-I180 HydrophobicContact CG-CG1 3.87Å
127Y91.8Very high90.1Very high32 Ų3238.5 Ų38.513%0.12521%0.211CC..Hα-helixtrans-60.5-39.1176.5-58.5-39000112.4I53 R57 D123 Y124 A129 E130 F131I53-Y127 HydrophobicContact CD1-CD2 3.42Å; I53-Y127 VanDerWaalsContact CD1-CD2 3.42Å; I53-Y127 HydrophobicContact CD1-CE2 4.19Å; I53-Y127 HydrophobicContact CD1-CG 3.94Å; I53-Y127 HydrophobicContact CG1-CD2 4.48Å; I53-Y127 HydrophobicContact CG2-CE2 4.4Å; R57-Y127 VanDerWaalsContact CZ-CE1 3.41Å; R57-Y127 VanDerWaalsContact NH1-CE1 3.31Å; D123-Y127 HydrophobicContact CB-CE2 4.1Å; D123-Y127 WeakPolarHBondContact O-CD2 3.37Å; D123-Y127 VanDerWaalsContact O-CG 3.22Å; D123-Y127 PolarHBondContact O-N 2.79Å; Y124-Y127 AromaticContact CD1-CD2 3.66Å; Y124-Y127 HydrophobicContact CD1-CD2 3.66Å; Y124-Y127 HydrophobicContact CD1-CE2 4.11Å; Y124-Y127 HydrophobicContact CE1-CD2 4.01Å; Y124-Y127 HydrophobicContact CE1-CE2 4.08Å; Y124-Y127 HydrophobicContact CG-CD2 4.25Å; Y124-Y127 PolarHBondContact O-N 3.22Å; Y127-A129 VanDerWaalsContact C-N 3.33Å; Y127-A129 PolarHBondContact O-N 3.45Å; Y127-E130 WeakPolarHBondContact CD1-OE1 3.26Å; Y127-E130 WeakPolarHBondContact O-CB 3.39Å; Y127-E130 PolarHBondContact O-N 3.32Å; Y127-F131 WeakPolarHBondContact O-CD1 3.48Å; Y127-F131 WeakPolarHBondContact O-CE1 3.48Å
128L93Very high90.8Very high16 Ų1644 Ų448%0.08423%0.233CC..Hα-helixtrans-59.7-43.1171.2-74.4174.4000111.9K94 C97 L101 Y124 H125 R126 E130 F131 A132 A140K94-L128 HydrophobicContact CB-CD2 4.35Å; K94-L128 HydrophobicContact CG-CD2 4.03Å; C97-L128 HydrophobicContact CB-CD1 4.11Å; C97-L128 HydrophobicContact CB-CD2 3.51Å; C97-L128 HydrophobicContact CB-CG 3.57Å; L101-L128 HydrophobicContact CD1-CD1 3.66Å; Y124-L128 WeakPolarHBondContact O-CG 3.44Å; Y124-L128 PolarHBondContact O-N 3.21Å; H125-L128 WeakPolarHBondContact O-CB 3.22Å; H125-L128 PolarHBondContact O-N 3.13Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.56Å; L128-E130 VanDerWaalsContact C-N 3.27Å; L128-E130 PolarHBondContact O-N 3.19Å; L128-F131 HydrophobicContact CD2-CE1 4.34Å; L128-F131 HydrophobicContact CD2-CZ 3.78Å; L128-A132 WeakPolarHBondContact O-CB 3.05Å; L128-A132 PolarHBondContact O-N 3.27Å; L128-A132 VanDerWaalsContact O-N 3.07Å; L128-A140 HydrophobicContact CB-CB 3.86Å
129A94.4Very high91.4Very high0 Ų046.2 Ų46.20%024%0.244CC..Hα-helixtrans-66.3-26.6-179.300000113.3H125 R126 Y127 F131 R137 A140 A141 I180H125-A129 PolarHBondContact O-N 2.97Å; R126-A129 WeakPolarHBondContact O-CB 3.21Å; R126-A129 PolarHBondContact O-N 3.42Å; Y127-A129 VanDerWaalsContact C-N 3.33Å; Y127-A129 PolarHBondContact O-N 3.45Å; A129-F131 PolarHBondContact O-N 3.17Å; A129-R137 PolarHBondContact O-NH1 3.33Å; A129-A140 HydrophobicContact CB-CB 3.86Å; A129-A141 HydrophobicContact CB-CB 4.42Å; A129-I180 HydrophobicContact CB-CD1 4.15Å; A129-I180 HydrophobicContact CB-CG1 4.47Å; A129-I180 HydrophobicContact CB-CG2 3.73Å
130E91.6Very high92Very high26 Ų2645.8 Ų45.812%0.12124%0.242CC..Hα-helixtrans-59.2-42.6-179.4-73174.8-164.900112.8R57 R126 Y127 L128 I180R57-E130 IonicContact CZ-OE1 3.61Å; R57-E130 IonicContact CZ-OE2 3.67Å; R57-E130 VanDerWaalsContact CZ-OE2 3.25Å; R57-E130 IonicContact NE-OE1 3.9Å; R57-E130 IonicContact NE-OE2 2.69Å; R57-E130 PolarHBondContact NE-OE2 3.48Å; R57-E130 IonicContact NH2-OE1 3.71Å; R57-E130 PolarHBondContact NH2-OE1 2.94Å; R57-E130 IonicContact NH2-OE2 3.12Å; R57-E130 PolarHBondContact NH2-OE2 2.91Å; R126-E130 IonicContact NH1-OE1 3.77Å; R126-E130 PolarHBondContact NH1-OE1 3.44Å; R126-E130 VanDerWaalsContact NH1-OE1 3.12Å; R126-E130 PolarHBondContact O-N 3.01Å; R126-E130 VanDerWaalsContact O-N 3.1Å; Y127-E130 WeakPolarHBondContact CD1-OE1 3.26Å; Y127-E130 WeakPolarHBondContact O-CB 3.39Å; Y127-E130 PolarHBondContact O-N 3.32Å; L128-E130 VanDerWaalsContact C-N 3.27Å; L128-E130 PolarHBondContact O-N 3.19Å; E130-I180 HydrophobicContact CG-CD1 3.87Å
131F89.6Confident92.6Very high19 Ų1944.9 Ų44.98%0.08324%0.239CC..Hα-helixtrans-111.1-12.6-175.465-92.6000113.9W60 E90 L93 K94 Y127 L128 A129W60-F131 HydrophobicContact CD2-CB 4.21Å; W60-F131 VanDerWaalsContact CE2-CB 3.49Å; W60-F131 HydrophobicContact CH2-CB 4.01Å; W60-F131 HydrophobicContact CZ2-CB 3.39Å; E90-F131 HydrophobicContact CB-CD2 4.02Å; E90-F131 HydrophobicContact CB-CE2 4.31Å; E90-F131 HydrophobicContact CG-CB 4.29Å; E90-F131 HydrophobicContact CG-CD2 3.88Å; E90-F131 HydrophobicContact CG-CG 4.32Å; L93-F131 HydrophobicContact CB-CD1 4.39Å; L93-F131 HydrophobicContact CB-CE1 3.73Å; L93-F131 HydrophobicContact CB-CZ 3.8Å; L93-F131 HydrophobicContact CD1-CD1 4.13Å; L93-F131 HydrophobicContact CD1-CE1 4.28Å; K94-F131 HydrophobicContact CB-CE2 4.14Å; K94-F131 HydrophobicContact CB-CZ 4.05Å; Y127-F131 WeakPolarHBondContact O-CD1 3.48Å; Y127-F131 WeakPolarHBondContact O-CE1 3.48Å; L128-F131 HydrophobicContact CD2-CE1 4.34Å; L128-F131 HydrophobicContact CD2-CZ 3.78Å; A129-F131 PolarHBondContact O-N 3.17Å
132A92.1Very high92.9Very high16 Ų1647.4 Ų47.413%0.13225%0.251CS..  trans-66.3156174.500000111.7L128 D136 R137L128-A132 WeakPolarHBondContact O-CB 3.05Å; L128-A132 PolarHBondContact O-N 3.27Å; L128-A132 VanDerWaalsContact O-N 3.07Å; A132-D136 HydrophobicContact CB-CB 4.03Å; A132-R137 HydrophobicContact CB-CB 4Å; A132-R137 WeakPolarHBondContact O-CB 3.47Å
133T89.6Confident93.1Very high112 Ų11250.4 Ų50.469%0.68727%0.268SS*.  trans-131.7159.1178.157.10000110.6N135 D136 R137T133-N135 PolarHBondContact O-N 3.15Å; T133-D136 PolarHBondContact O-N 2.85Å; T133-R137 PolarHBondContact O-N 3.31Å
134G93.3Very high93.4Very high61 Ų6149.9 Ų49.963%0.62926%0.264SS*.Hα-helixtrans57.7-132.4177.500000113.4R137 K138G134-R137 PolarHBondContact O-N 2.92Å; G134-K138 PolarHBondContact O-N 3.37Å
135N93.6Very high93.6Very high136 Ų13651.4 Ų51.473%0.72727%0.273SS*.Hα-helixtrans-65.9-38.6-177.6-76.5-5.1000113T133 R137 K138 E139T133-N135 PolarHBondContact O-N 3.15Å; N135-R137 PolarHBondContact O-N 3.39Å; N135-K138 WeakPolarHBondContact O-CB 3.44Å; N135-K138 PolarHBondContact O-N 3.35Å; N135-K138 VanDerWaalsContact O-N 3.08Å; N135-E139 PolarHBondContact O-N 3.09Å
136D91.6Very high93.6Very high83 Ų8355.1 Ų55.144%0.44430%0.297SS..Hα-helixtrans-58-38.7177.7-75.726000111K94 A132 T133 A140K94-D136 IonicContact NZ-OD2 2.57Å; K94-D136 PolarHBondContact NZ-OD2 3.12Å; A132-D136 HydrophobicContact CB-CB 4.03Å; T133-D136 PolarHBondContact O-N 2.85Å; D136-A140 VanDerWaalsContact O-CB 3.28Å; D136-A140 WeakPolarHBondContact O-CB 3.4Å; D136-A140 PolarHBondContact O-N 3Å
137R93.9Very high93.6Very high82 Ų8255 Ų5531%0.30930%0.298SS..Hα-helixtrans-65.3-44.6176.3-175.2176.7171.3101.6-3.1111.5A129 A132 T133 G134 N135 A140 A141 I180A129-R137 PolarHBondContact O-NH1 3.33Å; A132-R137 HydrophobicContact CB-CB 4Å; A132-R137 WeakPolarHBondContact O-CB 3.47Å; T133-R137 PolarHBondContact O-N 3.31Å; G134-R137 PolarHBondContact O-N 2.92Å; N135-R137 PolarHBondContact O-N 3.39Å; R137-A140 PolarHBondContact O-N 2.97Å; R137-A141 VanDerWaalsContact O-CB 3.3Å; R137-A141 WeakPolarHBondContact O-CB 3.04Å; R137-A141 PolarHBondContact O-N 2.92Å; R137-I180 PolarHBondContact NH2-O 3.43Å
138K93.9Very high93.7Very high129 Ų12953.5 Ų53.556%0.56129%0.293SS*.Hα-helixtrans-62.2-47.3-179.7-177.5177.8172.5-177.40110.7G134 N135 A141 E142G134-K138 PolarHBondContact O-N 3.37Å; N135-K138 WeakPolarHBondContact O-CB 3.44Å; N135-K138 PolarHBondContact O-N 3.35Å; N135-K138 VanDerWaalsContact O-N 3.08Å; K138-A141 PolarHBondContact O-N 2.92Å; K138-E142 WeakPolarHBondContact CE-OE1 3.36Å; K138-E142 IonicContact NZ-OE1 3.97Å; K138-E142 WeakPolarHBondContact O-CB 3.42Å; K138-E142 WeakPolarHBondContact O-CG 3.43Å; K138-E142 PolarHBondContact O-N 3.08Å
139E95.6Very high93.8Very high120 Ų12057.7 Ų57.756%0.56131%0.31SS*.Hα-helixtrans-62.8-45.4177.9-176179.2178.300111.8N135 A141 E142 N143N135-E139 PolarHBondContact O-N 3.09Å; E139-A141 VanDerWaalsContact C-N 3.35Å; E139-A141 PolarHBondContact O-N 3.47Å; E139-E142 PolarHBondContact O-N 3.07Å; E139-N143 WeakPolarHBondContact O-CB 3.49Å; E139-N143 PolarHBondContact O-N 3.2Å; E139-N143 PolarHBondContact O-ND2 3.22Å; E139-N143 VanDerWaalsContact O-ND2 3.15Å
140A94.9Very high93.6Very high6 Ų659.2 Ų59.25%0.0532%0.322CS..Hα-helixtrans-61.5-42.3176.400000112.1L128 A129 D136 R137 S144L128-A140 HydrophobicContact CB-CB 3.86Å; A129-A140 HydrophobicContact CB-CB 3.86Å; D136-A140 VanDerWaalsContact O-CB 3.28Å; D136-A140 WeakPolarHBondContact O-CB 3.4Å; D136-A140 PolarHBondContact O-N 3Å; R137-A140 PolarHBondContact O-N 2.97Å; A140-S144 WeakPolarHBondContact O-CB 3.4Å; A140-S144 PolarHBondContact O-N 3.14Å
141A95.7Very high93.6Very high10 Ų1058 Ų588%0.08332%0.317CS..Hα-helixtrans-65.9-42.7176.900000112.2A129 R137 K138 E139 S144 L145 F176 I180 L181A129-A141 HydrophobicContact CB-CB 4.42Å; R137-A141 VanDerWaalsContact O-CB 3.3Å; R137-A141 WeakPolarHBondContact O-CB 3.04Å; R137-A141 PolarHBondContact O-N 2.92Å; K138-A141 PolarHBondContact O-N 2.92Å; E139-A141 VanDerWaalsContact C-N 3.35Å; E139-A141 PolarHBondContact O-N 3.47Å; A141-S144 PolarHBondContact O-N 2.85Å; A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 PolarHBondContact O-N 3.32Å; A141-F176 HydrophobicContact CB-CE2 4.46Å; A141-F176 HydrophobicContact CB-CZ 4.41Å; A141-F176 VanDerWaalsContact O-CZ 3.28Å; A141-F176 WeakPolarHBondContact O-CZ 3.07Å; A141-I180 HydrophobicContact CB-CG2 3.73Å; A141-L181 HydrophobicContact CB-CD2 4.27Å
142E96.5Very high93.7Very high100 Ų10058 Ų5847%0.46732%0.319SS..Hα-helixtrans-62.3-46.2176.4-75.7173.6-178.500111.5K138 E139 S144 L145 V146K138-E142 WeakPolarHBondContact CE-OE1 3.36Å; K138-E142 IonicContact NZ-OE1 3.97Å; K138-E142 WeakPolarHBondContact O-CB 3.42Å; K138-E142 WeakPolarHBondContact O-CG 3.43Å; K138-E142 PolarHBondContact O-N 3.08Å; E139-E142 PolarHBondContact O-N 3.07Å; E142-S144 PolarHBondContact O-N 3.42Å; E142-L145 PolarHBondContact O-N 2.94Å; E142-V146 WeakPolarHBondContact O-CG2 3.42Å; E142-V146 PolarHBondContact O-N 3.35Å
143N95.2Very high93.7Very high63 Ų6362.1 Ų62.134%0.33734%0.339SS..Hα-helixtrans-63.5-40.8177.2-75.3-37.3000112.3H125 E139 V146 A147H125-N143 HydrophobicContact CB-CB 4.33Å; E139-N143 WeakPolarHBondContact O-CB 3.49Å; E139-N143 PolarHBondContact O-N 3.2Å; E139-N143 PolarHBondContact O-ND2 3.22Å; E139-N143 VanDerWaalsContact O-ND2 3.15Å; N143-V146 PolarHBondContact O-N 3.06Å; N143-A147 WeakPolarHBondContact O-CB 3.49Å; N143-A147 PolarHBondContact O-N 3.29Å
144S95.7Very high93.7Very high0 Ų058.6 Ų58.60%032%0.316CS..Hα-helixtrans-62-45.7174.6-174.30000111.5G122 R126 A140 A141 E142 V146 A147 Y148 F176G122-S144 PolarHBondContact O-OG 2.89Å; R126-S144 PolarHBondContact N-OG 2.91Å; A140-S144 WeakPolarHBondContact O-CB 3.4Å; A140-S144 PolarHBondContact O-N 3.14Å; A141-S144 PolarHBondContact O-N 2.85Å; E142-S144 PolarHBondContact O-N 3.42Å; S144-V146 PolarHBondContact O-N 3.28Å; S144-A147 PolarHBondContact O-N 3.48Å; S144-Y148 VanDerWaalsContact O-CD2 3.28Å; S144-Y148 WeakPolarHBondContact O-CD2 3.3Å; S144-Y148 PolarHBondContact O-N 2.86Å; S144-Y148 WeakPolarHBondContact OG-CE2 3.42Å; S144-F176 WeakPolarHBondContact OG-CD2 3.31Å; S144-F176 WeakPolarHBondContact OG-CE2 3.47Å
145L95.2Very high93.5Very high38 Ų3856 Ų5620%0.19929%0.288CS..Hα-helixtrans-61-44.4178.2178.762.9000112A141 E142 K149 F173 F176 Y177 L181A141-L145 WeakPolarHBondContact O-CB 3.32Å; A141-L145 PolarHBondContact O-N 3.32Å; E142-L145 PolarHBondContact O-N 2.94Å; L145-K149 HydrophobicContact CD1-CD 4.27Å; L145-K149 HydrophobicContact CD1-CG 4.3Å; L145-K149 HydrophobicContact CG-CD 4.33Å; L145-K149 WeakPolarHBondContact O-CB 3.41Å; L145-K149 WeakPolarHBondContact O-CG 3.48Å; L145-K149 PolarHBondContact O-N 3.04Å; L145-F173 HydrophobicContact CD1-CE2 3.71Å; L145-F173 HydrophobicContact CD1-CZ 3.76Å; L145-F176 HydrophobicContact CB-CE1 3.89Å; L145-F176 HydrophobicContact CB-CZ 3.97Å; L145-F176 HydrophobicContact CD1-CE1 3.99Å; L145-Y177 HydrophobicContact CD1-CE1 4.31Å; L145-L181 HydrophobicContact CD1-CD1 4.42Å
146V95.1Very high93.4Very high98 Ų9854 Ų5459%0.59428%0.275SS*.Hα-helixtrans-62.3-45.7178170.20000110.6E142 N143 S144 K149 A150E142-V146 WeakPolarHBondContact O-CG2 3.42Å; E142-V146 PolarHBondContact O-N 3.35Å; N143-V146 PolarHBondContact O-N 3.06Å; S144-V146 PolarHBondContact O-N 3.28Å; V146-K149 PolarHBondContact O-N 2.93Å; V146-A150 WeakPolarHBondContact O-CB 3.39Å; V146-A150 PolarHBondContact O-N 2.95Å
147A93.2Very high93.3Very high9 Ų957 Ų577%0.07429%0.29CS..Hα-helixtrans-64-46.3179.400000112.3K121 N143 S144 A150 A151K121-A147 HydrophobicContact CB-CB 4.28Å; K121-A147 HydrophobicContact CG-CB 4.07Å; N143-A147 WeakPolarHBondContact O-CB 3.49Å; N143-A147 PolarHBondContact O-N 3.29Å; S144-A147 PolarHBondContact O-N 3.48Å; A147-A150 PolarHBondContact O-N 3.33Å; A147-A151 WeakPolarHBondContact O-CB 3.48Å; A147-A151 PolarHBondContact O-N 3.34Å
148Y94.6Very high93Very high0 Ų058.4 Ų58.40%030%0.3CS..Hα-helixtrans-64.9-40.7178.2-76.3-49000112.8D123 R126 S144 A151 S152 L169 N172 F173 F176D123-Y148 WeakPolarHBondContact CA-OH 3.33Å; D123-Y148 PolarHBondContact N-OH 2.92Å; D123-Y148 PolarHBondContact OD1-OH 3.25Å; R126-Y148 HydrophobicContact CB-CE2 4.42Å; R126-Y148 PolarHBondContact NE-OH 3.26Å; S144-Y148 VanDerWaalsContact O-CD2 3.28Å; S144-Y148 WeakPolarHBondContact O-CD2 3.3Å; S144-Y148 PolarHBondContact O-N 2.86Å; S144-Y148 WeakPolarHBondContact OG-CE2 3.42Å; Y148-A151 PolarHBondContact O-N 2.92Å; Y148-S152 VanDerWaalsContact O-CB 3.29Å; Y148-S152 WeakPolarHBondContact O-CB 3.36Å; Y148-S152 PolarHBondContact O-N 3.26Å; Y148-L169 HydrophobicContact CD1-CD1 3.54Å; Y148-L169 HydrophobicContact CE1-CD1 4.22Å; Y148-L169 HydrophobicContact CG-CD1 4.46Å; Y148-N172 HydrophobicContact CE1-CB 4.12Å; Y148-F173 HydrophobicContact CD1-CB 4.3Å; Y148-F173 HydrophobicContact CD2-CB 4.49Å; Y148-F173 AromaticContact CD2-CD2 3.66Å; Y148-F173 HydrophobicContact CD2-CD2 3.66Å; Y148-F173 HydrophobicContact CD2-CE2 4.13Å; Y148-F173 HydrophobicContact CD2-CG 4.24Å; Y148-F173 HydrophobicContact CG-CB 4.15Å; Y148-F173 AromaticContact CG-CD2 3.78Å; Y148-F173 HydrophobicContact CG-CD2 3.78Å; Y148-F173 HydrophobicContact CG-CE2 4.25Å; Y148-F173 AromaticContact CG-CG 3.94Å; Y148-F173 HydrophobicContact CG-CG 3.94Å; Y148-F176 HydrophobicContact CD2-CB 4.2Å; Y148-F176 HydrophobicContact CD2-CD1 4.3Å; Y148-F176 HydrophobicContact CD2-CG 4.08Å; Y148-F176 HydrophobicContact CE2-CB 3.76Å; Y148-F176 HydrophobicContact CE2-CD2 4.15Å; Y148-F176 AromaticContact CE2-CG 3.91Å; Y148-F176 HydrophobicContact CE2-CG 3.91Å
149K93.9Very high92.8Very high103 Ų10354.2 Ų54.245%0.44828%0.284SS..Hα-helixtrans-60.3-50.3174.5-77.9-178.5173.1-179.90111.5L145 V146 A151 S152 D153 F173L145-K149 HydrophobicContact CD1-CD 4.27Å; L145-K149 HydrophobicContact CD1-CG 4.3Å; L145-K149 HydrophobicContact CG-CD 4.33Å; L145-K149 WeakPolarHBondContact O-CB 3.41Å; L145-K149 WeakPolarHBondContact O-CG 3.48Å; L145-K149 PolarHBondContact O-N 3.04Å; V146-K149 PolarHBondContact O-N 2.93Å; K149-A151 VanDerWaalsContact C-N 3.27Å; K149-A151 PolarHBondContact O-N 3.04Å; K149-S152 WeakPolarHBondContact O-CB 3.31Å; K149-S152 PolarHBondContact O-N 3.03Å; K149-D153 VanDerWaalsContact O-CG 3.31Å; K149-D153 PolarHBondContact O-N 3.29Å; K149-F173 HydrophobicContact CG-CE1 4.29Å; K149-F173 HydrophobicContact CG-CZ 3.93Å
150A91.4Very high92.6Very high32 Ų3251.5 Ų51.526%0.26428%0.277SS..Hα-helixtrans-60.5-37178.900000112.5K118 V146 A147 I154K118-A150 HydrophobicContact CD-CB 4.33Å; V146-A150 WeakPolarHBondContact O-CB 3.39Å; V146-A150 PolarHBondContact O-N 2.95Å; A147-A150 PolarHBondContact O-N 3.33Å; A150-I154 WeakPolarHBondContact O-CD1 3.42Å; A150-I154 WeakPolarHBondContact O-CG1 3.29Å; A150-I154 PolarHBondContact O-N 3.47Å
151A90.9Very high92.6Very high1 Ų152.1 Ų52.11%0.00828%0.28CS..Hα-helixtrans-69.2-37.2173.800000112.2K118 V119 A147 Y148 K149 I154 A155 L169K118-A151 HydrophobicContact CB-CB 3.89Å; V119-A151 HydrophobicContact CG2-CB 3.75Å; A147-A151 WeakPolarHBondContact O-CB 3.48Å; A147-A151 PolarHBondContact O-N 3.34Å; Y148-A151 PolarHBondContact O-N 2.92Å; K149-A151 VanDerWaalsContact C-N 3.27Å; K149-A151 PolarHBondContact O-N 3.04Å; A151-I154 PolarHBondContact O-N 3.01Å; A151-A155 VanDerWaalsContact O-CB 3.29Å; A151-A155 WeakPolarHBondContact O-CB 3.25Å; A151-A155 PolarHBondContact O-N 2.88Å; A151-L169 HydrophobicContact CB-CD1 4.11Å; A151-L169 HydrophobicContact CB-CD2 3.83Å
152S91.9Very high92.5Very high19 Ų1951.8 Ų51.813%0.13328%0.277CS..Hα-helixtrans-69.2-43.6-178.4-155.30000111.3Y148 K149 I154 A155 M156Y148-S152 VanDerWaalsContact O-CB 3.29Å; Y148-S152 WeakPolarHBondContact O-CB 3.36Å; Y148-S152 PolarHBondContact O-N 3.26Å; K149-S152 WeakPolarHBondContact O-CB 3.31Å; K149-S152 PolarHBondContact O-N 3.03Å; S152-I154 VanDerWaalsContact C-N 3.29Å; S152-I154 PolarHBondContact O-N 3.2Å; S152-A155 PolarHBondContact O-N 3.41Å; S152-M156 WeakPolarHBondContact O-CB 3.41Å; S152-M156 VanDerWaalsContact O-CG 3.25Å; S152-M156 WeakPolarHBondContact O-CG 3.16Å; S152-M156 PolarHBondContact O-N 3.19Å
153D91.7Very high92.2Very high102 Ų10249.9 Ų49.955%0.54527%0.268SS..Hα-helixtrans-57.9-42.3176.7-65-21.4000111.4K149 I157K149-D153 VanDerWaalsContact O-CG 3.31Å; K149-D153 PolarHBondContact O-N 3.29Å; D153-I157 WeakPolarHBondContact O-CD1 3.43Å; D153-I157 WeakPolarHBondContact O-CG1 3.45Å
154I89.4Confident92Very high38 Ų3848.4 Ų48.420%0.19526%0.262CS..Hα-helixtrans-69.8-49177.6-64.5167.8000110.7K118 A150 A151 S152 M156 I157 E158K118-I154 HydrophobicContact CD-CD1 3.79Å; K118-I154 VanDerWaalsContact NZ-CD1 3.25Å; A150-I154 WeakPolarHBondContact O-CD1 3.42Å; A150-I154 WeakPolarHBondContact O-CG1 3.29Å; A150-I154 PolarHBondContact O-N 3.47Å; A151-I154 PolarHBondContact O-N 3.01Å; S152-I154 VanDerWaalsContact C-N 3.29Å; S152-I154 PolarHBondContact O-N 3.2Å; I154-M156 PolarHBondContact O-N 3.34Å; I154-I157 PolarHBondContact O-N 3.42Å; I154-E158 VanDerWaalsContact CG2-CD 3.47Å; I154-E158 HydrophobicContact CG2-CG 4.17Å; I154-E158 WeakPolarHBondContact CG2-OE2 3.5Å; I154-E158 PolarHBondContact O-N 2.74Å
155A90.1Very high91.6Very high6 Ų650.9 Ų50.95%0.0528%0.275CS..Hα-helixtrans-62.1-32.9-178.700000112.4A151 S152 I157 L159 R166 L169A151-A155 VanDerWaalsContact O-CB 3.29Å; A151-A155 WeakPolarHBondContact O-CB 3.25Å; A151-A155 PolarHBondContact O-N 2.88Å; S152-A155 PolarHBondContact O-N 3.41Å; A155-I157 VanDerWaalsContact C-N 3.27Å; A155-I157 PolarHBondContact O-N 3.37Å; A155-L159 HydrophobicContact CB-CD1 4.19Å; A155-L159 WeakPolarHBondContact O-CB 3.4Å; A155-L159 PolarHBondContact O-N 3.27Å; A155-L159 VanDerWaalsContact O-O 3.07Å; A155-R166 HydrophobicContact CB-CB 4.31Å; A155-R166 HydrophobicContact CB-CG 4.12Å; A155-L169 HydrophobicContact CB-CD2 4.02Å
156M89.9Confident91.5Very high94 Ų9451.4 Ų51.446%0.46327%0.274SS..Hα-helixtrans-66.4-28.4175.5-75.5-176.1178.100113.3S152 I154S152-M156 WeakPolarHBondContact O-CB 3.41Å; S152-M156 VanDerWaalsContact O-CG 3.25Å; S152-M156 WeakPolarHBondContact O-CG 3.16Å; S152-M156 PolarHBondContact O-N 3.19Å; I154-M156 PolarHBondContact O-N 3.34Å
157I90.1Very high91.5Very high147 Ų14746.8 Ų46.875%0.75425%0.246SC*.Hα-helixtrans-89.4-43.2-179.5-64168000111.1D153 I154 A155D153-I157 WeakPolarHBondContact O-CD1 3.43Å; D153-I157 WeakPolarHBondContact O-CG1 3.45Å; I154-I157 PolarHBondContact O-N 3.42Å; A155-I157 VanDerWaalsContact C-N 3.27Å; A155-I157 PolarHBondContact O-N 3.37Å
158E88.1Confident91.5Very high112 Ų11247.1 Ų47.152%0.52325%0.251SS..Hα-helixtrans-95.1-24.7-168.1-65.9-178179.600114.1I154I154-E158 VanDerWaalsContact CG2-CD 3.47Å; I154-E158 HydrophobicContact CG2-CG 4.17Å; I154-E158 WeakPolarHBondContact CG2-OE2 3.5Å; I154-E158 PolarHBondContact O-N 2.74Å
159L89.4Confident91.4Very high40 Ų4047.3 Ų47.321%0.20925%0.251CS..SBendtrans-121.2137.3-169.8-55.5178.3000111.6A155 H163 I165 R166A155-L159 HydrophobicContact CB-CD1 4.19Å; A155-L159 WeakPolarHBondContact O-CB 3.4Å; A155-L159 PolarHBondContact O-N 3.27Å; A155-L159 VanDerWaalsContact O-O 3.07Å; L159-H163 HydrophobicContact CB-CB 3.86Å; L159-I165 HydrophobicContact CD1-CB 4.03Å; L159-I165 HydrophobicContact CD1-CG2 4.08Å; L159-R166 HydrophobicContact CB-CB 4.25Å; L159-R166 HydrophobicContact CD1-CB 4.35Å; L159-R166 PolarHBondContact O-NH1 2.7Å
160P91.8Very high91.5Very high64 Ų6442.9 Ų42.942%0.41623%0.234SC..  trans-63.4155.6173.726.5-32.9000111T162 H163 R166P160-T162 PolarHBondContact O-N 2.9Å; P160-T162 VanDerWaalsContact O-N 3.1Å; P160-H163 HydrophobicContact CG-CB 4.04Å; P160-H163 VanDerWaalsContact O-CB 3.22Å; P160-H163 WeakPolarHBondContact O-CB 3.37Å; P160-H163 PolarHBondContact O-N 3.16Å; P160-R166 WeakPolarHBondContact O-CD 3.34Å
161P94.3Very high91.7Very high19 Ų1942.3 Ų42.312%0.12323%0.226CC..THydrogen-bonded Turntrans-54.4-29.8179.5-27.136.2000114.5H163 N197 E201P161-H163 VanDerWaalsContact C-N 3.34Å; P161-N197 HydrophobicContact CB-CB 3.98Å; P161-E201 WeakPolarHBondContact CD-OE2 3.23Å
162T93.9Very high91.9Very high3 Ų344.2 Ų44.22%0.01824%0.237CC..THydrogen-bonded Turntrans-81.1-8.6178.2490000113.9P160 L167 A198 E201 L202 L205 S213P160-T162 PolarHBondContact O-N 2.9Å; P160-T162 VanDerWaalsContact O-N 3.1Å; T162-L167 WeakPolarHBondContact O-CD1 3.3Å; T162-A198 HydrophobicContact CG2-CB 4.25Å; T162-A198 WeakPolarHBondContact CG2-O 3.45Å; T162-E201 HydrophobicContact CG2-CB 4.03Å; T162-L202 HydrophobicContact CG2-CD1 4.43Å; T162-L205 HydrophobicContact CG2-CD1 4.15Å; T162-L205 HydrophobicContact CG2-CD2 4.48Å; T162-L205 HydrophobicContact CG2-CG 4.3Å; T162-L205 WeakPolarHBondContact OG1-CD2 3.33Å; T162-S213 WeakPolarHBondContact O-CB 3.37Å; T162-S213 PolarHBondContact O-OG 2.73Å
163H91Very high92.1Very high59 Ų5943.7 Ų43.727%0.27323%0.232SC..  trans-63.4129.1-175.5-163.2-76.4000111.5L159 P160 P161 I165 R166 L167L159-H163 HydrophobicContact CB-CB 3.86Å; P160-H163 HydrophobicContact CG-CB 4.04Å; P160-H163 VanDerWaalsContact O-CB 3.22Å; P160-H163 WeakPolarHBondContact O-CB 3.37Å; P160-H163 PolarHBondContact O-N 3.16Å; P161-H163 VanDerWaalsContact C-N 3.34Å; H163-I165 VanDerWaalsContact C-N 3.28Å; H163-I165 VanDerWaalsContact CE1-CD1 3.47Å; H163-I165 WeakPolarHBondContact CE1-CD1 3.29Å; H163-I165 PolarHBondContact ND1-N 3.15Å; H163-I165 PolarHBondContact O-N 3.34Å; H163-I165 VanDerWaalsContact O-N 3.14Å; H163-R166 HydrophobicContact CB-CB 4.24Å; H163-R166 PolarHBondContact O-N 2.98Å; H163-L167 PolarHBondContact O-N 3.41Å
164P90.6Very high92.3Very high33 Ų3338.9 Ų38.921%0.21421%0.206CC..Hα-helixtrans-54.1-39.4-176.3-30.635.7000114.5L167 G168 D212 I216P164-L167 PolarHBondContact O-N 3.14Å; P164-G168 PolarHBondContact O-N 2.92Å; P164-D212 HydrophobicContact CB-CB 4.4Å; P164-D212 HydrophobicContact CG-CB 3.88Å; P164-I216 HydrophobicContact CB-CD1 3.89Å; P164-I216 VanDerWaalsContact O-CD1 3.32Å; P164-I216 WeakPolarHBondContact O-CD1 3.41Å
165I87.9Confident92.6Very high51 Ų5138 Ų3826%0.26220%0.203SC..Hα-helixtrans-62-43.7175.5-59.4169.6000111.9E116 L159 H163 G168 L169E116-I165 HydrophobicContact CG-CD1 3.6Å; E116-I165 HydrophobicContact CG-CG1 4.31Å; E116-I165 HydrophobicContact CG-CG2 3.96Å; E116-I165 WeakPolarHBondContact OE1-CD1 3.29Å; L159-I165 HydrophobicContact CD1-CB 4.03Å; L159-I165 HydrophobicContact CD1-CG2 4.08Å; H163-I165 VanDerWaalsContact C-N 3.28Å; H163-I165 VanDerWaalsContact CE1-CD1 3.47Å; H163-I165 WeakPolarHBondContact CE1-CD1 3.29Å; H163-I165 PolarHBondContact ND1-N 3.15Å; H163-I165 PolarHBondContact O-N 3.34Å; H163-I165 VanDerWaalsContact O-N 3.14Å; I165-G168 PolarHBondContact O-N 3.46Å; I165-L169 WeakPolarHBondContact O-CB 3.49Å; I165-L169 PolarHBondContact O-N 3.48Å
166R92.6Very high92.9Very high49 Ų4937.8 Ų37.819%0.18520%0.201CC..Hα-helixtrans-68.9-42-179.4-177175.3173.7174.5-4111A155 L159 P160 H163 L169 A170A155-R166 HydrophobicContact CB-CB 4.31Å; A155-R166 HydrophobicContact CB-CG 4.12Å; L159-R166 HydrophobicContact CB-CB 4.25Å; L159-R166 HydrophobicContact CD1-CB 4.35Å; L159-R166 PolarHBondContact O-NH1 2.7Å; P160-R166 WeakPolarHBondContact O-CD 3.34Å; H163-R166 HydrophobicContact CB-CB 4.24Å; H163-R166 PolarHBondContact O-N 2.98Å; R166-L169 PolarHBondContact O-N 3.1Å; R166-A170 PolarHBondContact O-N 2.99Å
167L94.6Very high93.3Very high1 Ų134.6 Ų34.61%0.00518%0.184CC..Hα-helixtrans-62.6-46.5173.8-75.2173000112T162 H163 P164 L169 A170 L171 A198 I216 M217 L220T162-L167 WeakPolarHBondContact O-CD1 3.3Å; H163-L167 PolarHBondContact O-N 3.41Å; P164-L167 PolarHBondContact O-N 3.14Å; L167-L169 VanDerWaalsContact C-N 3.32Å; L167-L169 PolarHBondContact O-N 2.96Å; L167-A170 PolarHBondContact O-N 2.96Å; L167-L171 WeakPolarHBondContact O-CB 3.42Å; L167-L171 PolarHBondContact O-N 2.68Å; L167-A198 HydrophobicContact CD2-CB 3.81Å; L167-I216 HydrophobicContact CB-CB 4.19Å; L167-I216 HydrophobicContact CB-CD1 4.42Å; L167-I216 HydrophobicContact CB-CG2 3.69Å; L167-M217 HydrophobicContact CD1-CG 3.95Å; L167-M217 HydrophobicContact CD1-SD 4.46Å; L167-M217 HydrophobicContact CD2-CG 4.17Å; L167-L220 HydrophobicContact CD2-CD1 4.06Å
168G93.1Very high93.6Very high17 Ų1730 Ų3018%0.17516%0.157CC..Hα-helixtrans-63-38.4178.100000112.4P164 I165 L171 N172P164-G168 PolarHBondContact O-N 2.92Å; I165-G168 PolarHBondContact O-N 3.46Å; G168-L171 WeakPolarHBondContact O-CB 3.44Å; G168-L171 PolarHBondContact O-N 2.81Å; G168-N172 PolarHBondContact O-N 2.95Å
169L93.6Very high93.8Very high3 Ų329.3 Ų29.32%0.01615%0.154CC..Hα-helixtrans-61.7-48171.5168.959.6000111.7V119 Y148 A151 A155 I165 R166 L167 L171 N172 F173V119-L169 HydrophobicContact CG1-CB 4.29Å; V119-L169 HydrophobicContact CG1-CD1 4.09Å; V119-L169 HydrophobicContact CG2-CB 4.15Å; V119-L169 HydrophobicContact CG2-CD1 4.06Å; V119-L169 HydrophobicContact CG2-CD2 4.16Å; V119-L169 HydrophobicContact CG2-CG 4.34Å; Y148-L169 HydrophobicContact CD1-CD1 3.54Å; Y148-L169 HydrophobicContact CE1-CD1 4.22Å; Y148-L169 HydrophobicContact CG-CD1 4.46Å; A151-L169 HydrophobicContact CB-CD1 4.11Å; A151-L169 HydrophobicContact CB-CD2 3.83Å; A155-L169 HydrophobicContact CB-CD2 4.02Å; I165-L169 WeakPolarHBondContact O-CB 3.49Å; I165-L169 PolarHBondContact O-N 3.48Å; R166-L169 PolarHBondContact O-N 3.1Å; L167-L169 VanDerWaalsContact C-N 3.32Å; L167-L169 PolarHBondContact O-N 2.96Å; L169-L171 VanDerWaalsContact C-N 3.29Å; L169-L171 PolarHBondContact O-N 3.2Å; L169-N172 PolarHBondContact O-N 3.45Å; L169-F173 WeakPolarHBondContact O-CB 3.43Å; L169-F173 PolarHBondContact O-N 2.93Å
170A96.1Very high94.1Very high10 Ų1028 Ų288%0.08315%0.147CC..Hα-helixtrans-61.6-39.6177.800000112R166 L167 S174 A194R166-A170 PolarHBondContact O-N 2.99Å; L167-A170 PolarHBondContact O-N 2.96Å; A170-S174 VanDerWaalsContact O-CB 3.3Å; A170-S174 WeakPolarHBondContact O-CB 3.36Å; A170-S174 PolarHBondContact O-N 3.26Å; A170-S174 PolarHBondContact O-OG 3.22Å; A170-A194 HydrophobicContact CB-CB 3.47Å; A170-A194 VanDerWaalsContact CB-CB 3.47Å
171L95.6Very high94.2Very high20 Ų2027.6 Ų27.611%0.10514%0.141CC..Hα-helixtrans-58.1-56.8173.5178.466000110.8L167 G168 L169 F173 S174 V175 I216 L219 L220 N223L167-L171 WeakPolarHBondContact O-CB 3.42Å; L167-L171 PolarHBondContact O-N 2.68Å; G168-L171 WeakPolarHBondContact O-CB 3.44Å; G168-L171 PolarHBondContact O-N 2.81Å; L169-L171 VanDerWaalsContact C-N 3.29Å; L169-L171 PolarHBondContact O-N 3.2Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.14Å; L171-S174 PolarHBondContact O-N 3.44Å; L171-S174 PolarHBondContact O-OG 2.77Å; L171-V175 WeakPolarHBondContact O-CG2 3.43Å; L171-V175 PolarHBondContact O-N 3.49Å; L171-V175 VanDerWaalsContact O-N 3.1Å; L171-I216 HydrophobicContact CB-CG2 4.41Å; L171-I216 HydrophobicContact CD2-CG2 4.17Å; L171-L219 HydrophobicContact CD1-CB 4.14Å; L171-L219 HydrophobicContact CD2-CB 3.85Å; L171-L219 HydrophobicContact CD2-CD1 3.91Å; L171-L220 HydrophobicContact CB-CD2 3.91Å; L171-L220 HydrophobicContact CB-CG 4.26Å; L171-L220 HydrophobicContact CD1-CD2 3.81Å; L171-L220 HydrophobicContact CD1-CG 4.08Å; L171-N223 WeakPolarHBondContact CD1-ND2 3.48Å
172N93.9Very high94.2Very high42 Ų4233.3 Ų33.323%0.22517%0.17CC..Hα-helixtrans-64.7-36.9-177.3-70.1-3.8000112.2D123 Y148 G168 L169 V175 F176D123-N172 WeakPolarHBondContact OD1-CB 3.5Å; D123-N172 PolarHBondContact OD1-ND2 3.35Å; D123-N172 PolarHBondContact OD2-ND2 3.27Å; Y148-N172 HydrophobicContact CE1-CB 4.12Å; G168-N172 PolarHBondContact O-N 2.95Å; L169-N172 PolarHBondContact O-N 3.45Å; N172-V175 PolarHBondContact O-N 2.94Å; N172-F176 PolarHBondContact O-N 3.4Å
173F96.6Very high94.2Very high8 Ų834.7 Ų34.74%0.03518%0.18CC..Hα-helixtrans-73.4-32.6179.6-165.8-169.4000112.2L145 Y148 K149 L169 L171 F176 Y177 L190L145-F173 HydrophobicContact CD1-CE2 3.71Å; L145-F173 HydrophobicContact CD1-CZ 3.76Å; Y148-F173 HydrophobicContact CD1-CB 4.3Å; Y148-F173 HydrophobicContact CD2-CB 4.49Å; Y148-F173 AromaticContact CD2-CD2 3.66Å; Y148-F173 HydrophobicContact CD2-CD2 3.66Å; Y148-F173 HydrophobicContact CD2-CE2 4.13Å; Y148-F173 HydrophobicContact CD2-CG 4.24Å; Y148-F173 HydrophobicContact CG-CB 4.15Å; Y148-F173 AromaticContact CG-CD2 3.78Å; Y148-F173 HydrophobicContact CG-CD2 3.78Å; Y148-F173 HydrophobicContact CG-CE2 4.25Å; Y148-F173 AromaticContact CG-CG 3.94Å; Y148-F173 HydrophobicContact CG-CG 3.94Å; K149-F173 HydrophobicContact CG-CE1 4.29Å; K149-F173 HydrophobicContact CG-CZ 3.93Å; L169-F173 WeakPolarHBondContact O-CB 3.43Å; L169-F173 PolarHBondContact O-N 2.93Å; L171-F173 VanDerWaalsContact C-N 3.32Å; L171-F173 PolarHBondContact O-N 3.14Å; F173-F176 HydrophobicContact CD2-CB 4.27Å; F173-F176 AromaticContact CD2-CD1 3.82Å; F173-F176 HydrophobicContact CD2-CD1 3.82Å; F173-F176 HydrophobicContact CD2-CG 4.42Å; F173-F176 AromaticContact CE2-CD1 3.79Å; F173-F176 HydrophobicContact CE2-CD1 3.79Å; F173-F176 HydrophobicContact CE2-CE1 4.26Å; F173-F176 WeakPolarHBondContact O-CB 3.35Å; F173-F176 PolarHBondContact O-N 3.48Å; F173-Y177 HydrophobicContact CD1-CE2 4.27Å; F173-Y177 AromaticContact CD2-CD2 3.93Å; F173-Y177 HydrophobicContact CD2-CD2 3.93Å; F173-Y177 AromaticContact CD2-CE2 3.63Å; F173-Y177 HydrophobicContact CD2-CE2 3.63Å; F173-Y177 HydrophobicContact CE1-CE2 4.01Å; F173-Y177 AromaticContact CE2-CD2 4Å; F173-Y177 HydrophobicContact CE2-CD2 4Å; F173-Y177 HydrophobicContact CE2-CE1 4.42Å; F173-Y177 AromaticContact CE2-CE2 3.31Å; F173-Y177 HydrophobicContact CE2-CE2 3.31Å; F173-Y177 AromaticContact CE2-CZ 3.56Å; F173-Y177 HydrophobicContact CG-CD2 4.45Å; F173-Y177 HydrophobicContact CG-CE2 4.1Å; F173-Y177 AromaticContact CZ-CE2 3.53Å; F173-Y177 HydrophobicContact CZ-CE2 3.53Å; F173-Y177 AromaticContact CZ-CZ 3.64Å; F173-Y177 VanDerWaalsContact CZ-OH 3.27Å; F173-Y177 WeakPolarHBondContact CZ-OH 3.39Å; F173-Y177 VanDerWaalsContact O-CD2 3.22Å; F173-Y177 WeakPolarHBondContact O-CD2 3.37Å; F173-Y177 PolarHBondContact O-N 3.02Å; F173-L190 HydrophobicContact CB-CD2 3.85Å; F173-L190 HydrophobicContact CD1-CD2 3.79Å; F173-L190 HydrophobicContact CG-CD2 3.81Å
174S96.9Very high94.4Very high0 Ų033.6 Ų33.60%018%0.179CC..Hα-helixtrans-65.9-43.3171.568.60000111.5A170 L171 F176 Y177 Y178 A187A170-S174 VanDerWaalsContact O-CB 3.3Å; A170-S174 WeakPolarHBondContact O-CB 3.36Å; A170-S174 PolarHBondContact O-N 3.26Å; A170-S174 PolarHBondContact O-OG 3.22Å; L171-S174 PolarHBondContact O-N 3.44Å; L171-S174 PolarHBondContact O-OG 2.77Å; S174-F176 VanDerWaalsContact C-N 3.3Å; S174-F176 PolarHBondContact O-N 3.29Å; S174-Y177 PolarHBondContact O-N 3.38Å; S174-Y177 VanDerWaalsContact O-N 3.16Å; S174-Y178 PolarHBondContact O-N 3.44Å; S174-A187 WeakPolarHBondContact CB-O 3.43Å; S174-A187 WeakPolarHBondContact O-CB 3.34Å
175V95.6Very high94.6Very high21 Ų2137.6 Ų37.613%0.12720%0.198CC..Hα-helixtrans-59.4-41.6173.1174.10000110.9L171 N172 Y177 Y178 E179 N223 W227L171-V175 WeakPolarHBondContact O-CG2 3.43Å; L171-V175 PolarHBondContact O-N 3.49Å; L171-V175 VanDerWaalsContact O-N 3.1Å; N172-V175 PolarHBondContact O-N 2.94Å; V175-Y177 PolarHBondContact O-N 2.8Å; V175-Y178 PolarHBondContact O-N 2.72Å; V175-E179 HydrophobicContact CG1-CG 4.01Å; V175-E179 WeakPolarHBondContact O-CB 3.42Å; V175-E179 PolarHBondContact O-N 2.91Å; V175-N223 WeakPolarHBondContact CG2-ND2 3.19Å; V175-W227 HydrophobicContact CG2-CH2 4.12Å; V175-W227 HydrophobicContact CG2-CZ2 4.06Å
176F96.6Very high94.9Very high0 Ų041.7 Ų41.70%021%0.21CC..Hα-helixtrans-58.1-46.8174173.7-100.4000112.8R126 A141 S144 L145 Y148 N172 F173 S174 Y178 I180 L181R126-F176 HydrophobicContact CB-CD2 4.2Å; R126-F176 HydrophobicContact CG-CD2 4.1Å; A141-F176 HydrophobicContact CB-CE2 4.46Å; A141-F176 HydrophobicContact CB-CZ 4.41Å; A141-F176 VanDerWaalsContact O-CZ 3.28Å; A141-F176 WeakPolarHBondContact O-CZ 3.07Å; S144-F176 WeakPolarHBondContact OG-CD2 3.31Å; S144-F176 WeakPolarHBondContact OG-CE2 3.47Å; L145-F176 HydrophobicContact CB-CE1 3.89Å; L145-F176 HydrophobicContact CB-CZ 3.97Å; L145-F176 HydrophobicContact CD1-CE1 3.99Å; Y148-F176 HydrophobicContact CD2-CB 4.2Å; Y148-F176 HydrophobicContact CD2-CD1 4.3Å; Y148-F176 HydrophobicContact CD2-CG 4.08Å; Y148-F176 HydrophobicContact CE2-CB 3.76Å; Y148-F176 HydrophobicContact CE2-CD2 4.15Å; Y148-F176 AromaticContact CE2-CG 3.91Å; Y148-F176 HydrophobicContact CE2-CG 3.91Å; N172-F176 PolarHBondContact O-N 3.4Å; F173-F176 HydrophobicContact CD2-CB 4.27Å; F173-F176 AromaticContact CD2-CD1 3.82Å; F173-F176 HydrophobicContact CD2-CD1 3.82Å; F173-F176 HydrophobicContact CD2-CG 4.42Å; F173-F176 AromaticContact CE2-CD1 3.79Å; F173-F176 HydrophobicContact CE2-CD1 3.79Å; F173-F176 HydrophobicContact CE2-CE1 4.26Å; F173-F176 WeakPolarHBondContact O-CB 3.35Å; F173-F176 PolarHBondContact O-N 3.48Å; S174-F176 VanDerWaalsContact C-N 3.3Å; S174-F176 PolarHBondContact O-N 3.29Å; F176-Y178 VanDerWaalsContact C-N 3.26Å; F176-Y178 PolarHBondContact O-N 2.84Å; F176-I180 HydrophobicContact CD2-CB 3.71Å; F176-I180 HydrophobicContact CD2-CG1 3.67Å; F176-I180 HydrophobicContact CD2-CG2 4.14Å; F176-I180 HydrophobicContact CE2-CB 3.69Å; F176-I180 HydrophobicContact CE2-CG1 4.03Å; F176-I180 HydrophobicContact CE2-CG2 3.6Å; F176-I180 HydrophobicContact CG-CB 4.48Å; F176-I180 HydrophobicContact CZ-CB 4.46Å; F176-I180 HydrophobicContact CZ-CG2 4.29Å; F176-I180 WeakPolarHBondContact O-CA 3.3Å; F176-I180 WeakPolarHBondContact O-CB 3.47Å; F176-I180 PolarHBondContact O-N 3.02Å; F176-L181 HydrophobicContact CD1-CD1 4.19Å; F176-L181 HydrophobicContact CD1-CG 4.28Å; F176-L181 HydrophobicContact CE1-CD1 3.39Å; F176-L181 HydrophobicContact CE1-CD2 4.26Å; F176-L181 HydrophobicContact CE1-CG 3.55Å; F176-L181 HydrophobicContact CZ-CD1 3.95Å; F176-L181 HydrophobicContact CZ-CD2 3.96Å; F176-L181 HydrophobicContact CZ-CG 3.71Å; F176-L181 PolarHBondContact O-N 3.04Å
177Y97.1Very high95.1Very high27 Ų2739.3 Ų39.311%0.10620%0.201CC..Hα-helixtrans-61.2-37.6176.7-82.2-62.4000112.1L145 F173 S174 V175 L181 N182 S183 R186 L190L145-Y177 HydrophobicContact CD1-CE1 4.31Å; F173-Y177 HydrophobicContact CD1-CE2 4.27Å; F173-Y177 AromaticContact CD2-CD2 3.93Å; F173-Y177 HydrophobicContact CD2-CD2 3.93Å; F173-Y177 AromaticContact CD2-CE2 3.63Å; F173-Y177 HydrophobicContact CD2-CE2 3.63Å; F173-Y177 HydrophobicContact CE1-CE2 4.01Å; F173-Y177 AromaticContact CE2-CD2 4Å; F173-Y177 HydrophobicContact CE2-CD2 4Å; F173-Y177 HydrophobicContact CE2-CE1 4.42Å; F173-Y177 AromaticContact CE2-CE2 3.31Å; F173-Y177 HydrophobicContact CE2-CE2 3.31Å; F173-Y177 AromaticContact CE2-CZ 3.56Å; F173-Y177 HydrophobicContact CG-CD2 4.45Å; F173-Y177 HydrophobicContact CG-CE2 4.1Å; F173-Y177 AromaticContact CZ-CE2 3.53Å; F173-Y177 HydrophobicContact CZ-CE2 3.53Å; F173-Y177 AromaticContact CZ-CZ 3.64Å; F173-Y177 VanDerWaalsContact CZ-OH 3.27Å; F173-Y177 WeakPolarHBondContact CZ-OH 3.39Å; F173-Y177 VanDerWaalsContact O-CD2 3.22Å; F173-Y177 WeakPolarHBondContact O-CD2 3.37Å; F173-Y177 PolarHBondContact O-N 3.02Å; S174-Y177 PolarHBondContact O-N 3.38Å; S174-Y177 VanDerWaalsContact O-N 3.16Å; V175-Y177 PolarHBondContact O-N 2.8Å; Y177-L181 HydrophobicContact CD1-CB 4.48Å; Y177-L181 HydrophobicContact CD1-CD1 3.74Å; Y177-L181 HydrophobicContact CE1-CD1 3.79Å; Y177-N182 PolarHBondContact O-N 3.4Å; Y177-S183 PolarHBondContact O-N 3.02Å; Y177-R186 HydrophobicContact CD1-CB 3.93Å; Y177-R186 HydrophobicContact CD2-CB 4.5Å; Y177-R186 HydrophobicContact CE1-CB 4.39Å; Y177-R186 HydrophobicContact CG-CB 4.01Å; Y177-L190 HydrophobicContact CD2-CD2 3.97Å; Y177-L190 HydrophobicContact CE2-CD2 3.97Å
178Y95.6Very high95.1Very high52 Ų5240.5 Ų40.520%0.20421%0.209CC..Hα-helixtrans-72-62.3179.3-163.4-93.6000111.5S174 V175 F176 N182 P184 A187 W227 D230S174-Y178 PolarHBondContact O-N 3.44Å; V175-Y178 PolarHBondContact O-N 2.72Å; F176-Y178 VanDerWaalsContact C-N 3.26Å; F176-Y178 PolarHBondContact O-N 2.84Å; Y178-N182 WeakPolarHBondContact O-CA 3.37Å; Y178-N182 PolarHBondContact O-N 2.97Å; Y178-P184 HydrophobicContact CD2-CB 3.92Å; Y178-P184 HydrophobicContact CE2-CB 3.78Å; Y178-A187 HydrophobicContact CD2-CB 4.16Å; Y178-W227 AromaticContact CD1-CD1 3.92Å; Y178-W227 AromaticContact CD1-NE1 3.53Å; Y178-W227 HydrophobicContact CD2-CB 4.21Å; Y178-W227 AromaticContact CD2-CD1 3.71Å; Y178-W227 AromaticContact CD2-CD2 3.67Å; Y178-W227 HydrophobicContact CD2-CD2 3.67Å; Y178-W227 AromaticContact CD2-CE2 3.81Å; Y178-W227 HydrophobicContact CD2-CE3 4.3Å; Y178-W227 AromaticContact CD2-CG 3.61Å; Y178-W227 HydrophobicContact CD2-CG 3.61Å; Y178-W227 AromaticContact CD2-NE1 3.81Å; Y178-W227 AromaticContact CE1-CD1 3.52Å; Y178-W227 HydrophobicContact CE1-CG 4.35Å; Y178-W227 AromaticContact CE1-NE1 3.55Å; Y178-W227 HydrophobicContact CE2-CB 3.63Å; Y178-W227 AromaticContact CE2-CD1 3.32Å; Y178-W227 AromaticContact CE2-CD2 3.95Å; Y178-W227 HydrophobicContact CE2-CD2 3.95Å; Y178-W227 AromaticContact CE2-CG 3.34Å; Y178-W227 HydrophobicContact CE2-CG 3.34Å; Y178-W227 AromaticContact CE2-NE1 3.87Å; Y178-W227 AromaticContact CG-CD1 4Å; Y178-W227 HydrophobicContact CG-CD2 4.07Å; Y178-W227 AromaticContact CG-CE2 3.69Å; Y178-W227 HydrophobicContact CG-CG 4.25Å; Y178-W227 HydrophobicContact CG-CZ2 4.11Å; Y178-W227 AromaticContact CG-NE1 3.65Å; Y178-W227 AromaticContact CZ-CD1 3.2Å; Y178-W227 AromaticContact CZ-CG 3.74Å; Y178-W227 AromaticContact CZ-NE1 3.73Å; Y178-D230 PolarHBondContact OH-OD2 3.42Å
179E93.6Very high95.3Very high96 Ų9647.4 Ų47.445%0.44923%0.23SC..Hα-helixtrans-80.6-30.9-168-63.2-173.5173.100113.9V175V175-E179 HydrophobicContact CG1-CG 4.01Å; V175-E179 WeakPolarHBondContact O-CB 3.42Å; V175-E179 PolarHBondContact O-N 2.91Å
180I95.4Very high95.4Very high12 Ų1248.6 Ų48.66%0.06224%0.236CC..THydrogen-bonded Turntrans-100.8-49.2-174-53.4-55000112.1R126 A129 E130 R137 A141 F176R126-I180 HydrophobicContact CG-CD1 4.29Å; R126-I180 HydrophobicContact CG-CG1 3.87Å; A129-I180 HydrophobicContact CB-CD1 4.15Å; A129-I180 HydrophobicContact CB-CG1 4.47Å; A129-I180 HydrophobicContact CB-CG2 3.73Å; E130-I180 HydrophobicContact CG-CD1 3.87Å; R137-I180 PolarHBondContact NH2-O 3.43Å; A141-I180 HydrophobicContact CB-CG2 3.73Å; F176-I180 HydrophobicContact CD2-CB 3.71Å; F176-I180 HydrophobicContact CD2-CG1 3.67Å; F176-I180 HydrophobicContact CD2-CG2 4.14Å; F176-I180 HydrophobicContact CE2-CB 3.69Å; F176-I180 HydrophobicContact CE2-CG1 4.03Å; F176-I180 HydrophobicContact CE2-CG2 3.6Å; F176-I180 HydrophobicContact CG-CB 4.48Å; F176-I180 HydrophobicContact CZ-CB 4.46Å; F176-I180 HydrophobicContact CZ-CG2 4.29Å; F176-I180 WeakPolarHBondContact O-CA 3.3Å; F176-I180 WeakPolarHBondContact O-CB 3.47Å; F176-I180 PolarHBondContact O-N 3.02Å
181L94.3Very high95.5Very high56 Ų5648.1 Ų48.129%0.29323%0.232SC..THydrogen-bonded Turntrans-90.6-0.7-177.4-64.2-170.8000114.1A141 L145 F176 Y177 S183A141-L181 HydrophobicContact CB-CD2 4.27Å; L145-L181 HydrophobicContact CD1-CD1 4.42Å; F176-L181 HydrophobicContact CD1-CD1 4.19Å; F176-L181 HydrophobicContact CD1-CG 4.28Å; F176-L181 HydrophobicContact CE1-CD1 3.39Å; F176-L181 HydrophobicContact CE1-CD2 4.26Å; F176-L181 HydrophobicContact CE1-CG 3.55Å; F176-L181 HydrophobicContact CZ-CD1 3.95Å; F176-L181 HydrophobicContact CZ-CD2 3.96Å; F176-L181 HydrophobicContact CZ-CG 3.71Å; F176-L181 PolarHBondContact O-N 3.04Å; Y177-L181 HydrophobicContact CD1-CB 4.48Å; Y177-L181 HydrophobicContact CD1-CD1 3.74Å; Y177-L181 HydrophobicContact CE1-CD1 3.79Å; L181-S183 PolarHBondContact O-N 2.88Å; L181-S183 VanDerWaalsContact O-N 3.14Å; L181-S183 PolarHBondContact O-OG 3.34Å
182N93.4Very high95.5Very high139 Ų13952.9 Ų52.974%0.74325%0.252SS*.  trans48.443.8-180-163.846.5000112.2Y177 Y178 P184Y177-N182 PolarHBondContact O-N 3.4Å; Y178-N182 WeakPolarHBondContact O-CA 3.37Å; Y178-N182 PolarHBondContact O-N 2.97Å; N182-P184 VanDerWaalsContact C-CD 3.42Å; N182-P184 WeakPolarHBondContact O-CD 3.47Å
183S95.3Very high95.6Very high32 Ų3256 Ų5622%0.22427%0.265CS..  trans-121.967-174-66.80000110.3Y177 L181 D185 R186 A187Y177-S183 PolarHBondContact O-N 3.02Å; L181-S183 PolarHBondContact O-N 2.88Å; L181-S183 VanDerWaalsContact O-N 3.14Å; L181-S183 PolarHBondContact O-OG 3.34Å; S183-D185 VanDerWaalsContact C-N 3.29Å; S183-D185 PolarHBondContact O-N 3.46Å; S183-R186 PolarHBondContact O-N 2.88Å; S183-A187 PolarHBondContact O-N 3.27Å; S183-A187 VanDerWaalsContact O-N 3.07Å
184P94.5Very high95.6Very high37 Ų3756.4 Ų56.424%0.2427%0.27CS..Hα-helixtrans-58.3-38.1-173.323.7-34.3000112.7Y178 N182 R186 A187 C188 V231Y178-P184 HydrophobicContact CD2-CB 3.92Å; Y178-P184 HydrophobicContact CE2-CB 3.78Å; N182-P184 VanDerWaalsContact C-CD 3.42Å; N182-P184 WeakPolarHBondContact O-CD 3.47Å; P184-R186 VanDerWaalsContact C-N 3.26Å; P184-R186 PolarHBondContact O-N 3.36Å; P184-A187 WeakPolarHBondContact O-CB 3.44Å; P184-A187 PolarHBondContact O-N 3.21Å; P184-C188 WeakPolarHBondContact O-CB 3.43Å; P184-C188 PolarHBondContact O-N 3.27Å; P184-C188 PolarHBondContact O-SG 3.29Å; P184-V231 HydrophobicContact CB-CG2 4.49Å
185D93.8Very high95.6Very high116 Ų11658.4 Ų58.462%0.6228%0.279SS*.Hα-helixtrans-60.9-33.6176.5-61.8-47.2000113.4S183 R189S183-D185 VanDerWaalsContact C-N 3.29Å; S183-D185 PolarHBondContact O-N 3.46Å; D185-R189 WeakPolarHBondContact O-CB 3.41Å; D185-R189 VanDerWaalsContact O-CG 3.23Å; D185-R189 WeakPolarHBondContact O-CG 3.43Å; D185-R189 PolarHBondContact O-N 3.5Å; D185-R189 PolarHBondContact O-NE 3.39Å; D185-R189 VanDerWaalsContact O-NE 3.07Å
186R95.2Very high95.6Very high137 Ų13761.3 Ų61.352%0.51729%0.294SS..Hα-helixtrans-77.4-41176.6-70.1-175.3-178.3-177.51.6110.6Y177 S183 P184 R189 L190Y177-R186 HydrophobicContact CD1-CB 3.93Å; Y177-R186 HydrophobicContact CD2-CB 4.5Å; Y177-R186 HydrophobicContact CE1-CB 4.39Å; Y177-R186 HydrophobicContact CG-CB 4.01Å; S183-R186 PolarHBondContact O-N 2.88Å; P184-R186 VanDerWaalsContact C-N 3.26Å; P184-R186 PolarHBondContact O-N 3.36Å; R186-R189 PolarHBondContact O-N 3.28Å; R186-L190 WeakPolarHBondContact O-CB 3.44Å; R186-L190 PolarHBondContact O-N 3.03Å
187A96.2Very high95.5Very high0 Ų064.4 Ų64.40%031%0.31CS..Hα-helixtrans-58.4-52.9176.200000111.5S174 Y178 S183 P184 R189 L190 A191 W227S174-A187 WeakPolarHBondContact CB-O 3.43Å; S174-A187 WeakPolarHBondContact O-CB 3.34Å; Y178-A187 HydrophobicContact CD2-CB 4.16Å; S183-A187 PolarHBondContact O-N 3.27Å; S183-A187 VanDerWaalsContact O-N 3.07Å; P184-A187 WeakPolarHBondContact O-CB 3.44Å; P184-A187 PolarHBondContact O-N 3.21Å; A187-R189 PolarHBondContact O-N 3.24Å; A187-L190 PolarHBondContact O-N 3.08Å; A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.2Å; A187-W227 HydrophobicContact CB-CE3 4.23Å; A187-W227 HydrophobicContact CB-CH2 4.44Å; A187-W227 HydrophobicContact CB-CZ3 3.96Å
188C95.2Very high95.4Very high25 Ų2563.1 Ų63.117%0.16931%0.305CS..Hα-helixtrans-63.3-41.7-179.8-68.60000112.2P184 K192 L224P184-C188 WeakPolarHBondContact O-CB 3.43Å; P184-C188 PolarHBondContact O-N 3.27Å; P184-C188 PolarHBondContact O-SG 3.29Å; C188-K192 WeakPolarHBondContact O-CB 3.4Å; C188-K192 PolarHBondContact O-N 2.87Å; C188-L224 HydrophobicContact CB-CD2 4.11Å; C188-L224 WeakPolarHBondContact O-CD2 3.35Å
189R96.4Very high95.3Very high162 Ų16264.7 Ų64.761%0.61132%0.316SS*.Hα-helixtrans-61.3-47.9176-80.3-173.5-66.3165-6.2112.1D185 R186 A187 K192 E193D185-R189 WeakPolarHBondContact O-CB 3.41Å; D185-R189 VanDerWaalsContact O-CG 3.23Å; D185-R189 WeakPolarHBondContact O-CG 3.43Å; D185-R189 PolarHBondContact O-N 3.5Å; D185-R189 PolarHBondContact O-NE 3.39Å; D185-R189 VanDerWaalsContact O-NE 3.07Å; R186-R189 PolarHBondContact O-N 3.28Å; A187-R189 PolarHBondContact O-N 3.24Å; R189-K192 PolarHBondContact O-N 2.96Å; R189-E193 VanDerWaalsContact O-CB 3.29Å; R189-E193 WeakPolarHBondContact O-CB 3.27Å; R189-E193 PolarHBondContact O-N 2.87Å
190L96.8Very high95.4Very high29 Ų2964.1 Ų64.115%0.15233%0.328CS..Hα-helixtrans-63-46.4-179.8-179.663000111.8F173 Y177 R186 A187 A194F173-L190 HydrophobicContact CB-CD2 3.85Å; F173-L190 HydrophobicContact CD1-CD2 3.79Å; F173-L190 HydrophobicContact CG-CD2 3.81Å; Y177-L190 HydrophobicContact CD2-CD2 3.97Å; Y177-L190 HydrophobicContact CE2-CD2 3.97Å; R186-L190 WeakPolarHBondContact O-CB 3.44Å; R186-L190 PolarHBondContact O-N 3.03Å; A187-L190 PolarHBondContact O-N 3.08Å; L190-A194 WeakPolarHBondContact O-CB 3.36Å; L190-A194 PolarHBondContact O-N 3.07Å
191A96.9Very high95.2Very high0 Ų067.4 Ų67.40%034%0.343CS..Hα-helixtrans-63.8-41.9179.200000111.8A187 F195 L220 L224 W227A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.2Å; A191-F195 WeakPolarHBondContact O-CB 3.47Å; A191-F195 PolarHBondContact O-N 3.44Å; A191-L220 HydrophobicContact CB-CD2 3.85Å; A191-L224 HydrophobicContact CB-CD1 4.29Å; A191-L224 HydrophobicContact CB-CD2 3.86Å; A191-L224 HydrophobicContact CB-CG 3.94Å; A191-W227 HydrophobicContact CB-CZ3 4.26Å
192K95.8Very high95Very high120 Ų12065.7 Ų65.752%0.52233%0.334SS..Hα-helixtrans-66.4-46.3177.9-176.3173.8-178.1178.80112.1C188 R189 A194 F195 D196 L224C188-K192 WeakPolarHBondContact O-CB 3.4Å; C188-K192 PolarHBondContact O-N 2.87Å; R189-K192 PolarHBondContact O-N 2.96Å; K192-A194 VanDerWaalsContact C-N 3.34Å; K192-A194 PolarHBondContact O-N 3.14Å; K192-F195 PolarHBondContact O-N 2.78Å; K192-D196 WeakPolarHBondContact CE-OD2 3.47Å; K192-D196 WeakPolarHBondContact CG-OD2 3.34Å; K192-D196 WeakPolarHBondContact O-CB 3.48Å; K192-D196 VanDerWaalsContact O-CG 3.3Å; K192-D196 PolarHBondContact O-N 3.47Å; K192-L224 HydrophobicContact CB-CD1 4.26Å; K192-L224 HydrophobicContact CB-CD2 4.32Å
193E96.8Very high94.8Very high107 Ų10766.9 Ų66.950%0.534%0.34SS..Hα-helixtrans-59.8-44.7177.6-178.2-179.316900111.5R189 F195 N197R189-E193 VanDerWaalsContact O-CB 3.29Å; R189-E193 WeakPolarHBondContact O-CB 3.27Å; R189-E193 PolarHBondContact O-N 2.87Å; E193-F195 VanDerWaalsContact C-N 3.35Å; E193-F195 PolarHBondContact O-N 3.48Å; E193-N197 VanDerWaalsContact O-CB 3.27Å; E193-N197 WeakPolarHBondContact O-CB 3.19Å; E193-N197 PolarHBondContact O-N 3.08Å; E193-N197 PolarHBondContact O-ND2 3.44Å; E193-N197 VanDerWaalsContact O-ND2 3.14Å
194A96.5Very high94.3Very high16 Ų1670.6 Ų70.613%0.13236%0.362CS..Hα-helixtrans-62.6-41.6176.200000112.3A170 L190 K192 A198 L220A170-A194 HydrophobicContact CB-CB 3.47Å; A170-A194 VanDerWaalsContact CB-CB 3.47Å; L190-A194 WeakPolarHBondContact O-CB 3.36Å; L190-A194 PolarHBondContact O-N 3.07Å; K192-A194 VanDerWaalsContact C-N 3.34Å; K192-A194 PolarHBondContact O-N 3.14Å; A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.07Å; A194-A198 VanDerWaalsContact O-N 3.12Å; A194-L220 HydrophobicContact CB-CD1 4.26Å
195F96.2Very high94Very high43 Ų4370.8 Ų70.819%0.18936%0.361CS..Hα-helixtrans-64.9-50.3177.4-173.8-86.9000112A191 K192 E193 N197 A198 I199 M217 L220 R221A191-F195 WeakPolarHBondContact O-CB 3.47Å; A191-F195 PolarHBondContact O-N 3.44Å; K192-F195 PolarHBondContact O-N 2.78Å; E193-F195 VanDerWaalsContact C-N 3.35Å; E193-F195 PolarHBondContact O-N 3.48Å; F195-N197 PolarHBondContact O-N 3.02Å; F195-A198 PolarHBondContact O-N 2.99Å; F195-I199 HydrophobicContact CD1-CG1 3.97Å; F195-I199 HydrophobicContact CE1-CD1 4.1Å; F195-I199 HydrophobicContact CE1-CG1 3.62Å; F195-I199 HydrophobicContact CZ-CD1 4.15Å; F195-I199 HydrophobicContact CZ-CG1 4.11Å; F195-I199 WeakPolarHBondContact O-CG1 3.32Å; F195-I199 PolarHBondContact O-N 2.69Å; F195-M217 HydrophobicContact CD2-CB 4.08Å; F195-M217 HydrophobicContact CD2-CE 4.44Å; F195-M217 WeakPolarHBondContact CD2-O 3.26Å; F195-M217 HydrophobicContact CE2-CB 3.98Å; F195-M217 HydrophobicContact CE2-CE 4.29Å; F195-M217 WeakPolarHBondContact CE2-O 3.4Å; F195-L220 HydrophobicContact CD2-CB 4.41Å; F195-R221 HydrophobicContact CD2-CB 4.46Å; F195-R221 HydrophobicContact CE2-CB 3.99Å
196D96.1Very high93.5Very high81 Ų8168.5 Ų68.543%0.43335%0.353SS..Hα-helixtrans-63.7-42.2-177.7-70.1-16.3000111.2K192 A198 I199 A200K192-D196 WeakPolarHBondContact CE-OD2 3.47Å; K192-D196 WeakPolarHBondContact CG-OD2 3.34Å; K192-D196 WeakPolarHBondContact O-CB 3.48Å; K192-D196 VanDerWaalsContact O-CG 3.3Å; K192-D196 PolarHBondContact O-N 3.47Å; D196-A198 PolarHBondContact O-N 2.84Å; D196-I199 PolarHBondContact O-N 2.93Å; D196-A200 PolarHBondContact O-N 3.22Å; D196-A200 VanDerWaalsContact O-N 3.14Å
197N94.8Very high92.9Very high66 Ų6669.1 Ų69.135%0.35336%0.362SS..Hα-helixtrans-64.5-39176.1-71.4-24.5000112.2P161 E193 F195 A200P161-N197 HydrophobicContact CB-CB 3.98Å; E193-N197 VanDerWaalsContact O-CB 3.27Å; E193-N197 WeakPolarHBondContact O-CB 3.19Å; E193-N197 PolarHBondContact O-N 3.08Å; E193-N197 PolarHBondContact O-ND2 3.44Å; E193-N197 VanDerWaalsContact O-ND2 3.14Å; F195-N197 PolarHBondContact O-N 3.02Å; N197-A200 PolarHBondContact O-N 3.12Å
198A94.8Very high92Very high0 Ų076.6 Ų76.60%040%0.397CS..Hα-helixtrans-71.5-35.6177.600000112.6T162 L167 A194 F195 D196 A200 E201 L202 M217T162-A198 HydrophobicContact CG2-CB 4.25Å; T162-A198 WeakPolarHBondContact CG2-O 3.45Å; L167-A198 HydrophobicContact CD2-CB 3.81Å; A194-A198 WeakPolarHBondContact O-CB 3.47Å; A194-A198 PolarHBondContact O-N 3.07Å; A194-A198 VanDerWaalsContact O-N 3.12Å; F195-A198 PolarHBondContact O-N 2.99Å; D196-A198 PolarHBondContact O-N 2.84Å; A198-A200 VanDerWaalsContact C-N 3.3Å; A198-A200 PolarHBondContact O-N 3.16Å; A198-E201 PolarHBondContact O-N 2.99Å; A198-L202 WeakPolarHBondContact O-CB 3.24Å; A198-L202 PolarHBondContact O-N 3.45Å; A198-M217 HydrophobicContact CB-CE 3.9Å; A198-M217 HydrophobicContact CB-CG 4.32Å; A198-M217 HydrophobicContact CB-SD 3.87Å
199I94.2Very high91.4Very high85 Ų8577.7 Ų77.744%0.43641%0.405SS..Hα-helixtrans-59.9-41.9172.8-74.2-70.8000111.2F195 D196 E201 L202 M217F195-I199 HydrophobicContact CD1-CG1 3.97Å; F195-I199 HydrophobicContact CE1-CD1 4.1Å; F195-I199 HydrophobicContact CE1-CG1 3.62Å; F195-I199 HydrophobicContact CZ-CD1 4.15Å; F195-I199 HydrophobicContact CZ-CG1 4.11Å; F195-I199 WeakPolarHBondContact O-CG1 3.32Å; F195-I199 PolarHBondContact O-N 2.69Å; D196-I199 PolarHBondContact O-N 2.93Å; I199-E201 PolarHBondContact O-N 3.5Å; I199-L202 HydrophobicContact CD1-CD2 4.46Å; I199-L202 PolarHBondContact O-N 2.99Å; I199-M217 HydrophobicContact CB-CE 4.48Å; I199-M217 HydrophobicContact CD1-CE 3.46Å; I199-M217 VanDerWaalsContact CD1-CE 3.46Å; I199-M217 HydrophobicContact CG1-CE 3.56Å
200A94.1Very high91Very high83 Ų8375 Ų7569%0.68640%0.396SS*.Hα-helixtrans-62.5-24.1-17800000113.8D196 N197 A198D196-A200 PolarHBondContact O-N 3.22Å; D196-A200 VanDerWaalsContact O-N 3.14Å; N197-A200 PolarHBondContact O-N 3.12Å; A198-A200 VanDerWaalsContact C-N 3.3Å; A198-A200 PolarHBondContact O-N 3.16Å
201E92.6Very high90.7Very high81 Ų8179.8 Ų79.838%0.37942%0.415SS..THydrogen-bonded Turntrans-11812.3-178-64.4-175.6-149.200112.7P161 T162 A198 I199 D203 T204P161-E201 WeakPolarHBondContact CD-OE2 3.23Å; T162-E201 HydrophobicContact CG2-CB 4.03Å; A198-E201 PolarHBondContact O-N 2.99Å; I199-E201 PolarHBondContact O-N 3.5Å; E201-D203 VanDerWaalsContact C-N 3.28Å; E201-D203 PolarHBondContact O-N 3.46Å; E201-T204 PolarHBondContact O-N 3.14Å; E201-T204 PolarHBondContact O-OG1 3.48Å
202L89.6Confident90.3Very high20 Ų2084 Ų8411%0.10544%0.438CS..G310 helixtrans-66.2-33-173.4-15971.1000112.6T162 A198 I199 T204 L205 Y210 T214 M217T162-L202 HydrophobicContact CG2-CD1 4.43Å; A198-L202 WeakPolarHBondContact O-CB 3.24Å; A198-L202 PolarHBondContact O-N 3.45Å; I199-L202 HydrophobicContact CD1-CD2 4.46Å; I199-L202 PolarHBondContact O-N 2.99Å; L202-T204 PolarHBondContact O-N 3.15Å; L202-T204 VanDerWaalsContact O-N 3.16Å; L202-L205 HydrophobicContact CD1-CD1 3.83Å; L202-L205 PolarHBondContact O-N 2.98Å; L202-Y210 HydrophobicContact CD1-CE2 4.47Å; L202-Y210 HydrophobicContact CD2-CE2 3.76Å; L202-Y210 HydrophobicContact CG-CD2 4.22Å; L202-Y210 HydrophobicContact CG-CE2 3.8Å; L202-T214 HydrophobicContact CD1-CG2 4.31Å; L202-T214 HydrophobicContact CD2-CG2 4.31Å; L202-M217 HydrophobicContact CD1-CE 4.15Å; L202-M217 HydrophobicContact CD1-SD 3.63Å
203D88.5Confident90.1Very high165 Ų16578.3 Ų78.388%0.88241%0.413SS*.G310 helixtrans-67.7-11.4-178.5-66.4-24.3000113.4E201E201-D203 VanDerWaalsContact C-N 3.28Å; E201-D203 PolarHBondContact O-N 3.46Å
204T85.6Confident89.9Confident109 Ų10975.2 Ų75.267%0.66940%0.402SS*.G310 helixtrans-91.1-3.3179.871.30000113.5E201 L202E201-T204 PolarHBondContact O-N 3.14Å; E201-T204 PolarHBondContact O-OG1 3.48Å; L202-T204 PolarHBondContact O-N 3.15Å; L202-T204 VanDerWaalsContact O-N 3.16Å
205L87.3Confident89.8Confident42 Ų4280 Ų8022%0.2242%0.424CS..  trans-80.5148.3-175.3-69.4179.3000113.1T162 L202 Y210T162-L205 HydrophobicContact CG2-CD1 4.15Å; T162-L205 HydrophobicContact CG2-CD2 4.48Å; T162-L205 HydrophobicContact CG2-CG 4.3Å; T162-L205 WeakPolarHBondContact OG1-CD2 3.33Å; L202-L205 HydrophobicContact CD1-CD1 3.83Å; L202-L205 PolarHBondContact O-N 2.98Å; L205-Y210 HydrophobicContact CD1-CD2 4.5Å
206S85.1Confident89.7Confident67 Ų6779.2 Ų79.247%0.46942%0.422SS..  trans-72.2160.3164690000110.8E208 S209 Y210S206-E208 PolarHBondContact O-N 2.94Å; S206-S209 PolarHBondContact O-N 3.25Å; S206-S209 PolarHBondContact OG-N 3.37Å; S206-S209 PolarHBondContact OG-OG 2.82Å; S206-Y210 VanDerWaalsContact O-CB 3.25Å; S206-Y210 WeakPolarHBondContact O-CB 3.46Å; S206-Y210 PolarHBondContact O-N 3.01Å
207E82.1Confident89.7Confident151 Ų15175.7 Ų75.771%0.70640%0.403SS*.Hα-helixtrans-59-34.6-179-163.9-171.8159.300113.1K211E207-K211 IonicContact OE1-NZ 3.85Å
208E77.3Confident89.8Confident157 Ų15776.5 Ų76.573%0.73440%0.404SS*.Hα-helixtrans-68.1-52177.6-172.3175.2-174.900111.1S206 Y210 K211S206-E208 PolarHBondContact O-N 2.94Å; E208-Y210 VanDerWaalsContact C-N 3.27Å; E208-Y210 PolarHBondContact O-N 2.78Å; E208-K211 PolarHBondContact O-N 3.28Å
209S82.7Confident89.8Confident47 Ų4780.2 Ų80.233%0.32942%0.424SS..Hα-helixtrans-68.7-26.2179-560000113.1S206 S213S206-S209 PolarHBondContact O-N 3.25Å; S206-S209 PolarHBondContact OG-N 3.37Å; S206-S209 PolarHBondContact OG-OG 2.82Å; S209-S213 WeakPolarHBondContact O-CB 3.38Å; S209-S213 PolarHBondContact O-N 3.39Å; S209-S213 VanDerWaalsContact O-N 3.09Å; S209-S213 PolarHBondContact O-OG 3Å
210Y88.5Confident89.9Confident107 Ų10776.2 Ų76.242%0.4240%0.403SS..Hα-helixtrans-62.6-43.8177.8-175.9-88.7000111.8L202 L205 S206 E208 T214L202-Y210 HydrophobicContact CD1-CE2 4.47Å; L202-Y210 HydrophobicContact CD2-CE2 3.76Å; L202-Y210 HydrophobicContact CG-CD2 4.22Å; L202-Y210 HydrophobicContact CG-CE2 3.8Å; L205-Y210 HydrophobicContact CD1-CD2 4.5Å; S206-Y210 VanDerWaalsContact O-CB 3.25Å; S206-Y210 WeakPolarHBondContact O-CB 3.46Å; S206-Y210 PolarHBondContact O-N 3.01Å; E208-Y210 VanDerWaalsContact C-N 3.27Å; E208-Y210 PolarHBondContact O-N 2.78Å; Y210-T214 HydrophobicContact CD1-CG2 3.98Å; Y210-T214 HydrophobicContact CD2-CG2 4.31Å; Y210-T214 HydrophobicContact CE1-CG2 3.64Å; Y210-T214 HydrophobicContact CE2-CG2 4.01Å; Y210-T214 HydrophobicContact CG-CG2 4.29Å; Y210-T214 WeakPolarHBondContact O-CB 3.02Å; Y210-T214 VanDerWaalsContact O-CG2 3.27Å; Y210-T214 WeakPolarHBondContact O-CG2 3.41Å; Y210-T214 PolarHBondContact O-N 3.13Å; Y210-T214 PolarHBondContact O-OG1 3.25Å
211K89.1Confident90Very high128 Ų12878.8 Ų78.856%0.55740%0.395SS*.Hα-helixtrans-63.4-45.8-178.7-71.4178.3-175.2168.10111.9E207 E208 T214 L215E207-K211 IonicContact OE1-NZ 3.85Å; E208-K211 PolarHBondContact O-N 3.28Å; K211-T214 PolarHBondContact O-OG1 3.04Å; K211-L215 WeakPolarHBondContact O-CB 3.22Å; K211-L215 PolarHBondContact O-N 3.41Å; K211-L215 VanDerWaalsContact O-N 3.15Å
212D88.9Confident90.1Very high90 Ų9078.6 Ų78.648%0.48140%0.397SS..Hα-helixtrans-67.6-43.2-179.1-69-15.4000111.8P164 I216P164-D212 HydrophobicContact CB-CB 4.4Å; P164-D212 HydrophobicContact CG-CB 3.88Å; D212-I216 WeakPolarHBondContact O-CG1 3.45Å; D212-I216 PolarHBondContact O-N 2.82Å
213S92.1Very high90.3Very high0 Ų079.4 Ų79.40%040%0.401CS..Hα-helixtrans-66.8-44.9-178.9-50.50000111.3T162 S209 L215 I216 M217T162-S213 WeakPolarHBondContact O-CB 3.37Å; T162-S213 PolarHBondContact O-OG 2.73Å; S209-S213 WeakPolarHBondContact O-CB 3.38Å; S209-S213 PolarHBondContact O-N 3.39Å; S209-S213 VanDerWaalsContact O-N 3.09Å; S209-S213 PolarHBondContact O-OG 3Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 3.26Å; S213-I216 PolarHBondContact O-N 3.43Å; S213-M217 VanDerWaalsContact O-CG 3.26Å; S213-M217 WeakPolarHBondContact O-CG 3.46Å; S213-M217 PolarHBondContact O-N 2.94Å
214T92.9Very high90.6Very high42 Ų4272.9 Ų72.926%0.25837%0.366SS..Hα-helixtrans-66.8-33.6-179.8520000113.1L202 Y210 K211 I216 M217 Q218L202-T214 HydrophobicContact CD1-CG2 4.31Å; L202-T214 HydrophobicContact CD2-CG2 4.31Å; Y210-T214 HydrophobicContact CD1-CG2 3.98Å; Y210-T214 HydrophobicContact CD2-CG2 4.31Å; Y210-T214 HydrophobicContact CE1-CG2 3.64Å; Y210-T214 HydrophobicContact CE2-CG2 4.01Å; Y210-T214 HydrophobicContact CG-CG2 4.29Å; Y210-T214 WeakPolarHBondContact O-CB 3.02Å; Y210-T214 VanDerWaalsContact O-CG2 3.27Å; Y210-T214 WeakPolarHBondContact O-CG2 3.41Å; Y210-T214 PolarHBondContact O-N 3.13Å; Y210-T214 PolarHBondContact O-OG1 3.25Å; K211-T214 PolarHBondContact O-OG1 3.04Å; T214-I216 PolarHBondContact O-N 3.08Å; T214-M217 PolarHBondContact O-N 3.49Å; T214-Q218 WeakPolarHBondContact O-CB 3.38Å; T214-Q218 PolarHBondContact O-N 3.42Å
215L93.6Very high91Very high115 Ų11571.8 Ų71.860%0.60236%0.359SS*.Hα-helixtrans-59.9-45.6173-179.563.8000111.4K211 S213 Q218 L219K211-L215 WeakPolarHBondContact O-CB 3.22Å; K211-L215 PolarHBondContact O-N 3.41Å; K211-L215 VanDerWaalsContact O-N 3.15Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 3.26Å; L215-Q218 PolarHBondContact O-N 2.85Å; L215-L219 PolarHBondContact O-N 3.48Å
216I94.8Very high91.2Very high28 Ų2874.2 Ų74.214%0.14437%0.372CS..Hα-helixtrans-71.3-38.7179.8-58.1169.1000111.1P164 L167 L171 D212 S213 T214 Q218 L219 L220P164-I216 HydrophobicContact CB-CD1 3.89Å; P164-I216 VanDerWaalsContact O-CD1 3.32Å; P164-I216 WeakPolarHBondContact O-CD1 3.41Å; L167-I216 HydrophobicContact CB-CB 4.19Å; L167-I216 HydrophobicContact CB-CD1 4.42Å; L167-I216 HydrophobicContact CB-CG2 3.69Å; L171-I216 HydrophobicContact CB-CG2 4.41Å; L171-I216 HydrophobicContact CD2-CG2 4.17Å; D212-I216 WeakPolarHBondContact O-CG1 3.45Å; D212-I216 PolarHBondContact O-N 2.82Å; S213-I216 PolarHBondContact O-N 3.43Å; T214-I216 PolarHBondContact O-N 3.08Å; I216-Q218 VanDerWaalsContact C-N 3.26Å; I216-Q218 PolarHBondContact O-N 2.63Å; I216-L219 WeakPolarHBondContact O-CB 3.49Å; I216-L219 PolarHBondContact O-N 3.45Å; I216-L219 VanDerWaalsContact O-N 3.13Å; I216-L220 PolarHBondContact O-N 3.39Å
217M95.9Very high91.6Very high7 Ų771.4 Ų71.43%0.03435%0.351CS..Hα-helixtrans-60.6-37174.3-70170.171.600112.1L167 F195 A198 I199 L202 S213 T214 L220 R221L167-M217 HydrophobicContact CD1-CG 3.95Å; L167-M217 HydrophobicContact CD1-SD 4.46Å; L167-M217 HydrophobicContact CD2-CG 4.17Å; F195-M217 HydrophobicContact CD2-CB 4.08Å; F195-M217 HydrophobicContact CD2-CE 4.44Å; F195-M217 WeakPolarHBondContact CD2-O 3.26Å; F195-M217 HydrophobicContact CE2-CB 3.98Å; F195-M217 HydrophobicContact CE2-CE 4.29Å; F195-M217 WeakPolarHBondContact CE2-O 3.4Å; A198-M217 HydrophobicContact CB-CE 3.9Å; A198-M217 HydrophobicContact CB-CG 4.32Å; A198-M217 HydrophobicContact CB-SD 3.87Å; I199-M217 HydrophobicContact CB-CE 4.48Å; I199-M217 HydrophobicContact CD1-CE 3.46Å; I199-M217 VanDerWaalsContact CD1-CE 3.46Å; I199-M217 HydrophobicContact CG1-CE 3.56Å; L202-M217 HydrophobicContact CD1-CE 4.15Å; L202-M217 HydrophobicContact CD1-SD 3.63Å; S213-M217 VanDerWaalsContact O-CG 3.26Å; S213-M217 WeakPolarHBondContact O-CG 3.46Å; S213-M217 PolarHBondContact O-N 2.94Å; T214-M217 PolarHBondContact O-N 3.49Å; M217-L220 WeakPolarHBondContact O-CB 3.44Å; M217-L220 PolarHBondContact O-N 3.25Å; M217-R221 PolarHBondContact O-N 2.66Å
218Q95.7Very high91.8Very high82 Ų8267.4 Ų67.438%0.38334%0.337SS..Hα-helixtrans-62.6-43.2173.8-173.76051.200111.2T214 L215 I216 L220 R221 D222T214-Q218 WeakPolarHBondContact O-CB 3.38Å; T214-Q218 PolarHBondContact O-N 3.42Å; L215-Q218 PolarHBondContact O-N 2.85Å; I216-Q218 VanDerWaalsContact C-N 3.26Å; I216-Q218 PolarHBondContact O-N 2.63Å; Q218-L220 VanDerWaalsContact C-N 3.34Å; Q218-L220 PolarHBondContact O-N 3.1Å; Q218-R221 WeakPolarHBondContact O-CB 3.49Å; Q218-R221 PolarHBondContact O-N 3.09Å; Q218-R221 VanDerWaalsContact O-N 3.15Å; Q218-D222 PolarHBondContact NE2-OD1 2.94Å; Q218-D222 PolarHBondContact O-N 3.42Å
219L95.6Very high92Very high79 Ų7962.8 Ų62.841%0.41432%0.322SS..Hα-helixtrans-62-39.4175.4-64174000112.6L171 L215 I216 R221 D222 N223L171-L219 HydrophobicContact CD1-CB 4.14Å; L171-L219 HydrophobicContact CD2-CB 3.85Å; L171-L219 HydrophobicContact CD2-CD1 3.91Å; L215-L219 PolarHBondContact O-N 3.48Å; I216-L219 WeakPolarHBondContact O-CB 3.49Å; I216-L219 PolarHBondContact O-N 3.45Å; I216-L219 VanDerWaalsContact O-N 3.13Å; L219-R221 VanDerWaalsContact C-N 3.34Å; L219-D222 PolarHBondContact O-N 3.14Å; L219-N223 PolarHBondContact O-N 2.92Å
220L95.8Very high91.6Very high0 Ų064 Ų640%033%0.325CS..Hα-helixtrans-60.1-44.4173-77.3169.1000111.4L167 L171 A191 A194 F195 I216 M217 Q218 N223 L224L167-L220 HydrophobicContact CD2-CD1 4.06Å; L171-L220 HydrophobicContact CB-CD2 3.91Å; L171-L220 HydrophobicContact CB-CG 4.26Å; L171-L220 HydrophobicContact CD1-CD2 3.81Å; L171-L220 HydrophobicContact CD1-CG 4.08Å; A191-L220 HydrophobicContact CB-CD2 3.85Å; A194-L220 HydrophobicContact CB-CD1 4.26Å; F195-L220 HydrophobicContact CD2-CB 4.41Å; I216-L220 PolarHBondContact O-N 3.39Å; M217-L220 WeakPolarHBondContact O-CB 3.44Å; M217-L220 PolarHBondContact O-N 3.25Å; Q218-L220 VanDerWaalsContact C-N 3.34Å; Q218-L220 PolarHBondContact O-N 3.1Å; L220-N223 PolarHBondContact O-N 2.85Å; L220-L224 WeakPolarHBondContact O-CG 3.32Å; L220-L224 PolarHBondContact O-N 3.32Å
221R95.6Very high90.4Very high137 Ų13762.5 Ų62.552%0.51733%0.327SS..Hα-helixtrans-65.3-41.1177.8-178.8-177.6174.9-175.31.1112.4F195 M217 Q218 L219 L224 T225F195-R221 HydrophobicContact CD2-CB 4.46Å; F195-R221 HydrophobicContact CE2-CB 3.99Å; M217-R221 PolarHBondContact O-N 2.66Å; Q218-R221 WeakPolarHBondContact O-CB 3.49Å; Q218-R221 PolarHBondContact O-N 3.09Å; Q218-R221 VanDerWaalsContact O-N 3.15Å; L219-R221 VanDerWaalsContact C-N 3.34Å; R221-L224 PolarHBondContact O-N 3.44Å; R221-T225 PolarHBondContact O-N 3.15Å; R221-T225 PolarHBondContact O-OG1 3.36Å
222D95.9Very high88.9Confident78 Ų7863.4 Ų63.442%0.41733%0.333SS..Hα-helixtrans-62.2-46.4177.9-66.8-15.8000110.1Q218 L219 T225 L226Q218-D222 PolarHBondContact NE2-OD1 2.94Å; Q218-D222 PolarHBondContact O-N 3.42Å; L219-D222 PolarHBondContact O-N 3.14Å; D222-T225 PolarHBondContact O-N 2.93Å; D222-L226 PolarHBondContact O-N 2.95Å
223N94Very high87.1Confident37 Ų3761.3 Ų61.320%0.19833%0.333CS..Hα-helixtrans-60-46.7174.5-79.9-3.1000112.4L171 V175 L219 L220 T225 L226 W227L171-N223 WeakPolarHBondContact CD1-ND2 3.48Å; V175-N223 WeakPolarHBondContact CG2-ND2 3.19Å; L219-N223 PolarHBondContact O-N 2.92Å; L220-N223 PolarHBondContact O-N 2.85Å; N223-T225 VanDerWaalsContact C-N 3.29Å; N223-T225 PolarHBondContact O-N 3.5Å; N223-L226 PolarHBondContact O-N 3.23Å; N223-W227 HydrophobicContact CB-CD2 4.23Å; N223-W227 HydrophobicContact CB-CE3 4.18Å; N223-W227 HydrophobicContact CB-CH2 3.73Å; N223-W227 HydrophobicContact CB-CZ2 3.76Å; N223-W227 HydrophobicContact CB-CZ3 3.94Å; N223-W227 WeakPolarHBondContact O-CB 3.34Å; N223-W227 VanDerWaalsContact O-CD2 3.25Å; N223-W227 PolarHBondContact O-N 3.38Å
224L93.8Very high85.1Confident28 Ų2867.2 Ų67.215%0.14737%0.365CS..Hα-helixtrans-59-41176.5-77169.6000112.1C188 A191 K192 L220 R221 T228C188-L224 HydrophobicContact CB-CD2 4.11Å; C188-L224 WeakPolarHBondContact O-CD2 3.35Å; A191-L224 HydrophobicContact CB-CD1 4.29Å; A191-L224 HydrophobicContact CB-CD2 3.86Å; A191-L224 HydrophobicContact CB-CG 3.94Å; K192-L224 HydrophobicContact CB-CD1 4.26Å; K192-L224 HydrophobicContact CB-CD2 4.32Å; L220-L224 WeakPolarHBondContact O-CG 3.32Å; L220-L224 PolarHBondContact O-N 3.32Å; R221-L224 PolarHBondContact O-N 3.44Å; L224-T228 WeakPolarHBondContact O-CB 3.49Å; L224-T228 VanDerWaalsContact O-CG2 3.23Å; L224-T228 WeakPolarHBondContact O-CG2 3.34Å; L224-T228 PolarHBondContact O-N 2.91Å; L224-T228 PolarHBondContact O-OG1 3.27Å
225T93.7Very high82.6Confident85 Ų8567.7 Ų67.752%0.52138%0.378SS..Hα-helixtrans-63.1-47.4178.1-55.40000110.4R221 D222 N223 T228 S229R221-T225 PolarHBondContact O-N 3.15Å; R221-T225 PolarHBondContact O-OG1 3.36Å; D222-T225 PolarHBondContact O-N 2.93Å; N223-T225 VanDerWaalsContact C-N 3.29Å; N223-T225 PolarHBondContact O-N 3.5Å; T225-T228 PolarHBondContact O-OG1 3.32Å; T225-S229 PolarHBondContact O-N 3.33Å; T225-S229 VanDerWaalsContact O-N 3.15Å; T225-S229 PolarHBondContact O-OG 3.46Å
226L92.3Very high80Confident93 Ų9370 Ų7049%0.48739%0.385SS..Hα-helixtrans-61.1-49.1178.1-176.868.3000112.1D222 N223 T228 S229 D230D222-L226 PolarHBondContact O-N 2.95Å; N223-L226 PolarHBondContact O-N 3.23Å; L226-T228 PolarHBondContact O-N 3.06Å; L226-S229 PolarHBondContact O-N 3.19Å; L226-S229 PolarHBondContact O-OG 3.28Å; L226-D230 PolarHBondContact O-N 2.77Å; L226-D230 VanDerWaalsContact O-N 3.1Å
227W93Very high77.2Confident8 Ų876.9 Ų76.93%0.0342%0.417CS..Hα-helixtrans-71.5-31.2-175.7-59.3-23.5000113V175 Y178 A187 A191 N223 V231V175-W227 HydrophobicContact CG2-CH2 4.12Å; V175-W227 HydrophobicContact CG2-CZ2 4.06Å; Y178-W227 AromaticContact CD1-CD1 3.92Å; Y178-W227 AromaticContact CD1-NE1 3.53Å; Y178-W227 HydrophobicContact CD2-CB 4.21Å; Y178-W227 AromaticContact CD2-CD1 3.71Å; Y178-W227 AromaticContact CD2-CD2 3.67Å; Y178-W227 HydrophobicContact CD2-CD2 3.67Å; Y178-W227 AromaticContact CD2-CE2 3.81Å; Y178-W227 HydrophobicContact CD2-CE3 4.3Å; Y178-W227 AromaticContact CD2-CG 3.61Å; Y178-W227 HydrophobicContact CD2-CG 3.61Å; Y178-W227 AromaticContact CD2-NE1 3.81Å; Y178-W227 AromaticContact CE1-CD1 3.52Å; Y178-W227 HydrophobicContact CE1-CG 4.35Å; Y178-W227 AromaticContact CE1-NE1 3.55Å; Y178-W227 HydrophobicContact CE2-CB 3.63Å; Y178-W227 AromaticContact CE2-CD1 3.32Å; Y178-W227 AromaticContact CE2-CD2 3.95Å; Y178-W227 HydrophobicContact CE2-CD2 3.95Å; Y178-W227 AromaticContact CE2-CG 3.34Å; Y178-W227 HydrophobicContact CE2-CG 3.34Å; Y178-W227 AromaticContact CE2-NE1 3.87Å; Y178-W227 AromaticContact CG-CD1 4Å; Y178-W227 HydrophobicContact CG-CD2 4.07Å; Y178-W227 AromaticContact CG-CE2 3.69Å; Y178-W227 HydrophobicContact CG-CG 4.25Å; Y178-W227 HydrophobicContact CG-CZ2 4.11Å; Y178-W227 AromaticContact CG-NE1 3.65Å; Y178-W227 AromaticContact CZ-CD1 3.2Å; Y178-W227 AromaticContact CZ-CG 3.74Å; Y178-W227 AromaticContact CZ-NE1 3.73Å; A187-W227 HydrophobicContact CB-CE3 4.23Å; A187-W227 HydrophobicContact CB-CH2 4.44Å; A187-W227 HydrophobicContact CB-CZ3 3.96Å; A191-W227 HydrophobicContact CB-CZ3 4.26Å; N223-W227 HydrophobicContact CB-CD2 4.23Å; N223-W227 HydrophobicContact CB-CE3 4.18Å; N223-W227 HydrophobicContact CB-CH2 3.73Å; N223-W227 HydrophobicContact CB-CZ2 3.76Å; N223-W227 HydrophobicContact CB-CZ3 3.94Å; N223-W227 WeakPolarHBondContact O-CB 3.34Å; N223-W227 VanDerWaalsContact O-CD2 3.25Å; N223-W227 PolarHBondContact O-N 3.38Å; W227-V231 VanDerWaalsContact O-CG2 3.26Å; W227-V231 WeakPolarHBondContact O-CG2 3.25Å; W227-V231 PolarHBondContact O-N 2.7Å; W227-V231 VanDerWaalsContact O-N 3.16Å
228T85.9Confident74.3Confident67 Ų6785 Ų8541%0.41146%0.455SS..Hα-helixtrans-74.9-29.9175.752.60000112.5L224 T225 L226 Q232L224-T228 WeakPolarHBondContact O-CB 3.49Å; L224-T228 VanDerWaalsContact O-CG2 3.23Å; L224-T228 WeakPolarHBondContact O-CG2 3.34Å; L224-T228 PolarHBondContact O-N 2.91Å; L224-T228 PolarHBondContact O-OG1 3.27Å; T225-T228 PolarHBondContact O-OG1 3.32Å; L226-T228 PolarHBondContact O-N 3.06Å; T228-Q232 WeakPolarHBondContact O-CG 3.27Å; T228-Q232 PolarHBondContact O-N 3.3Å
229S83.1Confident71.3Confident60 Ų6088.2 Ų88.242%0.4248%0.475SS..Hα-helixtrans-68.8-39.5169.7510000112.6T225 L226 Q232 G233T225-S229 PolarHBondContact O-N 3.33Å; T225-S229 VanDerWaalsContact O-N 3.15Å; T225-S229 PolarHBondContact O-OG 3.46Å; L226-S229 PolarHBondContact O-N 3.19Å; L226-S229 PolarHBondContact O-OG 3.28Å; S229-Q232 PolarHBondContact O-N 3.35Å; S229-G233 PolarHBondContact O-N 2.86Å
230D72.6Confident68.6Low72 Ų7293.5 Ų93.539%0.38549%0.494SS..Hα-helixtrans-63-43.7178.1-70.3-6.9000111.1Y178 L226 Q232 G233 D234Y178-D230 PolarHBondContact OH-OD2 3.42Å; L226-D230 PolarHBondContact O-N 2.77Å; L226-D230 VanDerWaalsContact O-N 3.1Å; D230-Q232 VanDerWaalsContact C-N 3.31Å; D230-Q232 PolarHBondContact O-N 3.4Å; D230-G233 PolarHBondContact O-N 3.28Å; D230-D234 PolarHBondContact O-N 3.15Å
231V64.6Low65.7Low76 Ų76102.7 Ų102.746%0.46154%0.538SS..Hα-helixtrans-66.7-30.2178.4173.60000112.6P184 W227P184-V231 HydrophobicContact CB-CG2 4.49Å; W227-V231 VanDerWaalsContact O-CG2 3.26Å; W227-V231 WeakPolarHBondContact O-CG2 3.25Å; W227-V231 PolarHBondContact O-N 2.7Å; W227-V231 VanDerWaalsContact O-N 3.16Å
232Q57.7Low62.6Low147 Ų147100.5 Ų100.569%0.68755%0.548SS*.Hα-helixtrans-77.7-30.1175.2-73.5177.76.200112.5T228 S229 D230T228-Q232 WeakPolarHBondContact O-CG 3.27Å; T228-Q232 PolarHBondContact O-N 3.3Å; S229-Q232 PolarHBondContact O-N 3.35Å; D230-Q232 VanDerWaalsContact C-N 3.31Å; D230-Q232 PolarHBondContact O-N 3.4Å
233G50.4Low59.8Low47 Ų47102.3 Ų102.349%0.48556%0.564SS.*Hα-helixtrans-69.5-39.6175.700000113.7S229 D230 G235S229-G233 PolarHBondContact O-N 2.86Å; D230-G233 PolarHBondContact O-N 3.28Å; G233-G235 VanDerWaalsContact C-N 3.31Å; G233-G235 PolarHBondContact O-N 3.16Å
234D49.6Very low57Low123 Ų123109.6 Ų109.666%0.65860%0.598SS**Hα-helixtrans-77-15.3178.6-82.8-7000113.6D230D230-D234 PolarHBondContact O-N 3.15Å
235G41.2Very low54.2Low52 Ų52115.7 Ų115.754%0.53663%0.63SS.*THydrogen-bonded Turntrans-79.3-15.7-178.700000115.3G233G233-G235 VanDerWaalsContact C-N 3.31Å; G233-G235 PolarHBondContact O-N 3.16Å
236E38Very low51.5Low163 Ų163116.1 Ų116.176%0.76264%0.642SS**THydrogen-bonded Turntrans-92-19.7-178-67.7-168.7163.600113.7
237E37.7Very low48.7Very low174 Ų174121.4 Ų121.481%0.81367%0.665SS**THydrogen-bonded Turntrans-88.2-17.1-178.6-71.9-165.2159.400114.4
238Q35Very low46.1Very low178 Ų178129.6 Ų129.683%0.83270%0.703SS**SBendtrans-91.31.6-176.4-75.2-172400115.9
239N32.5Very low43.6Very low149 Ų149135.1 Ų135.180%0.79772%0.724SS**SBendtrans-117.227.3-173.4-143.36.7000115.4
240K37.8Very low41.2Very low189 Ų189137.2 Ų137.282%0.82275%0.745SS**SBendtrans-121.88.8-179.3-86.2-167-178.7175.60118.1
241E35Very low39.5Very low194 Ų194143.1 Ų143.191%0.90777%0.77SS**  trans-135.782.9170.8-71.4-172.5165.800111.8
242A31.5Very low38.2Very low90 Ų90150.7 Ų150.774%0.74479%0.791SS**  trans-105.1118.4148.200000107Q244A242-Q244 PolarHBondContact O-N 3.28Å
243P37.4Very low37.2Very low116 Ų116155.1 Ų155.175%0.75382%0.819SS**  trans-68.8117.3171.4-0.814.4000108.4D245P243-D245 VanDerWaalsContact C-N 3.33Å; P243-D245 PolarHBondContact O-N 3.23Å
244Q35.4Very low36.6Very low191 Ų191160.5 Ų160.589%0.89384%0.836SS**  trans-76.591158.4-75.8179.9-19.300107.2A242A242-Q244 PolarHBondContact O-N 3.28Å
245D34.1Very low35.9Very low155 Ų155162.5 Ų162.583%0.82985%0.845SS**  trans-102.7128.4159.9-83.6-34.6000109.4P243P243-D245 VanDerWaalsContact C-N 3.33Å; P243-D245 PolarHBondContact O-N 3.23Å
246A37.7Very low35.6Very low94 Ų94168.6 Ų168.678%0.77786%0.862SS**  trans-70.7145.9-177.900000111.5
247E33.6Very low35.5Very low205 Ų205168.9 Ų168.996%0.95887%0.868SS**  trans-148104.7145.9-110.3169.9-159.900109.2
248E36.8Very low35.3Very low179 Ų179168.6 Ų168.684%0.83687%0.872SS**  trans-81.1153.2166.3-125.7174.5178.200109.3
249E33.9Very low35.3Very low184 Ų184168 Ų16886%0.8687%0.874SS**  trans78.7106.2161.5-62.7-170.515400120.5
250A33.1Very low35.5Very low103 Ų103169.4 Ų169.485%0.85188%0.88SS**  -170.593.4115.700000111.2
251Q36.2Very low35.4Very low197 Ų197167.8 Ų167.892%0.92188%0.884SS**  trans-104.3104.6153.7-86.3179.8-0.400108.3
252R38.8Very low35.4Very low234 Ų234165.7 Ų165.788%0.88388%0.882SS**  trans-140.197.7156.6-88.4-172178.3177.41.2107.5
253D36.7Very low35.8Very low240 Ų240172.5 Ų172.5100%1.28390%0.895SS**  156.90129.5-78.5-14.3000110.6

Retrieved 253 of 253 residues in 290.6 ms (Link to these results)

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