A0A087YJE2_POEFO Loading...

Solute carrier family 2, facilitated glucose transporter member 5

AlphaFold DB , UniProt , Accession A0A087YJE2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 499 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
1Q32.7Very low70.6Confident251 Ų25171.5 Ų71.5100%1.17341%0.409SS*.  077.70-70.1178.1-5.200108.5
2G42.9Very low71.9Confident34 Ų3468 Ų6835%0.35140%0.395SS..  trans-103.2123.6164.500000107.1G232G2-G232 WeakPolarHBondContact CA-O 3.28Å; G2-G232 PolarHBondContact N-O 2.94Å; G2-G232 CarbonylContact O-C 3.58Å; G2-G232 WeakPolarHBondContact O-CA 3.37Å
3S52.1Low72.9Confident57 Ų5763.2 Ų63.240%0.39937%0.368SS..  trans-84.5156.5-173.659.50000110.6L5 T6S3-L5 PolarHBondContact O-N 3.05Å; S3-L5 WeakPolarHBondContact OG-CB 3.35Å; S3-T6 PolarHBondContact O-N 3.22Å
4P67Low73.6Confident101 Ų10158.6 Ų58.666%0.65634%0.341SS*.THydrogen-bonded Turntrans-54.5-6.9168.522.8-34.6000113.9T6 L7 V8P4-T6 VanDerWaalsContact C-N 3.32Å; P4-T6 PolarHBondContact O-N 3.11Å; P4-L7 PolarHBondContact O-N 3.48Å; P4-V8 WeakPolarHBondContact O-CG2 3.22Å; P4-V8 PolarHBondContact O-N 3.26Å
5L79.1Confident74.4Confident98 Ų9854.7 Ų54.751%0.51332%0.319SS..Hα-helixtrans-56.1-38.7175.4-168.271.2000113S3 L7 V8 L9S3-L5 PolarHBondContact O-N 3.05Å; S3-L5 WeakPolarHBondContact OG-CB 3.35Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.11Å; L5-V8 PolarHBondContact O-N 3.19Å; L5-L9 HydrophobicContact CD1-CD1 4.49Å; L5-L9 HydrophobicContact CD1-CG 4.41Å; L5-L9 HydrophobicContact CD2-CD1 4.2Å; L5-L9 HydrophobicContact CG-CD1 3.79Å; L5-L9 HydrophobicContact CG-CG 4.11Å; L5-L9 VanDerWaalsContact O-CB 3.31Å; L5-L9 WeakPolarHBondContact O-CB 3.33Å; L5-L9 WeakPolarHBondContact O-CG 3.29Å; L5-L9 PolarHBondContact O-N 3.3Å
6T82.1Confident75.1Confident39 Ų3954.1 Ų54.124%0.23931%0.313CS..Hα-helixtrans-65.6-38-178.1-54.40000112S3 P4 M10 F206 R229S3-T6 PolarHBondContact O-N 3.22Å; P4-T6 VanDerWaalsContact C-N 3.32Å; P4-T6 PolarHBondContact O-N 3.11Å; T6-M10 WeakPolarHBondContact O-CB 3.27Å; T6-M10 PolarHBondContact O-N 3.09Å; T6-F206 HydrophobicContact CG2-CD1 4.37Å; T6-F206 HydrophobicContact CG2-CE1 4.41Å; T6-R229 WeakPolarHBondContact CG2-O 3.26Å
7L80.8Confident75.3Confident14 Ų1450.9 Ų50.97%0.07329%0.294CS..Hα-helixtrans-66.9-44.6174.8-17861.8000111.1P4 L5 M10 V11 P148 I155 L230P4-L7 PolarHBondContact O-N 3.48Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.11Å; L7-M10 HydrophobicContact CD1-CE 3.77Å; L7-M10 PolarHBondContact O-N 3.45Å; L7-V11 VanDerWaalsContact O-CG2 3.3Å; L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.13Å; L7-P148 HydrophobicContact CD2-CG 4.45Å; L7-I155 HydrophobicContact CD1-CD1 4.49Å; L7-I155 HydrophobicContact CD2-CD1 3.64Å; L7-I155 HydrophobicContact CG-CD1 4.16Å; L7-L230 HydrophobicContact CD1-CD2 4.39Å
8V84.1Confident75.8Confident92 Ų9248.1 Ų48.156%0.55828%0.278SS*.Hα-helixtrans-62.9-44177.8174.90000111.4P4 L5 M10 V11 A12P4-V8 WeakPolarHBondContact O-CG2 3.22Å; P4-V8 PolarHBondContact O-N 3.26Å; L5-V8 PolarHBondContact O-N 3.19Å; V8-M10 VanDerWaalsContact C-N 3.34Å; V8-M10 PolarHBondContact O-N 3.41Å; V8-V11 PolarHBondContact O-N 3.33Å; V8-A12 WeakPolarHBondContact O-CB 3.48Å; V8-A12 PolarHBondContact O-N 3.02Å
9L85.1Confident76.4Confident86 Ų8645.8 Ų45.845%0.4527%0.265SS..Hα-helixtrans-65.9-36.5177.6-71.4173.6000112.1L5 A12 S13 F206L5-L9 HydrophobicContact CD1-CD1 4.49Å; L5-L9 HydrophobicContact CD1-CG 4.41Å; L5-L9 HydrophobicContact CD2-CD1 4.2Å; L5-L9 HydrophobicContact CG-CD1 3.79Å; L5-L9 HydrophobicContact CG-CG 4.11Å; L5-L9 VanDerWaalsContact O-CB 3.31Å; L5-L9 WeakPolarHBondContact O-CB 3.33Å; L5-L9 WeakPolarHBondContact O-CG 3.29Å; L5-L9 PolarHBondContact O-N 3.3Å; L9-A12 PolarHBondContact O-N 3.1Å; L9-S13 VanDerWaalsContact O-CB 3.25Å; L9-S13 WeakPolarHBondContact O-CB 3.41Å; L9-S13 PolarHBondContact O-N 3.45Å; L9-F206 HydrophobicContact CB-CE1 3.8Å; L9-F206 HydrophobicContact CB-CZ 3.69Å
10M85.1Confident77.1Confident1 Ų143.8 Ų43.81%0.00525%0.253CS..Hα-helixtrans-64.8-45.5173.6178.6-96.8-83.500111.2T6 L7 V8 A12 S13 A14 Y142 F143 F206 L230T6-M10 WeakPolarHBondContact O-CB 3.27Å; T6-M10 PolarHBondContact O-N 3.09Å; L7-M10 HydrophobicContact CD1-CE 3.77Å; L7-M10 PolarHBondContact O-N 3.45Å; V8-M10 VanDerWaalsContact C-N 3.34Å; V8-M10 PolarHBondContact O-N 3.41Å; M10-A12 PolarHBondContact O-N 3.28Å; M10-S13 PolarHBondContact O-N 2.81Å; M10-A14 VanDerWaalsContact O-CB 3.28Å; M10-A14 WeakPolarHBondContact O-CB 3.37Å; M10-A14 PolarHBondContact O-N 3.2Å; M10-Y142 HydrophobicContact CE-CE1 4.21Å; M10-Y142 HydrophobicContact CG-CE1 3.76Å; M10-Y142 HydrophobicContact SD-CD1 3.95Å; M10-Y142 HydrophobicContact SD-CE1 3.28Å; M10-Y142 WeakPolarHBondContact SD-CE1 3.44Å; M10-F143 HydrophobicContact SD-CE1 4.37Å; M10-F206 HydrophobicContact CB-CB 4.28Å; M10-F206 HydrophobicContact CB-CD1 3.48Å; M10-F206 VanDerWaalsContact CB-CD1 3.48Å; M10-F206 HydrophobicContact CB-CD2 4.44Å; M10-F206 HydrophobicContact CB-CE1 3.89Å; M10-F206 HydrophobicContact CB-CG 3.79Å; M10-F206 HydrophobicContact CG-CB 3.94Å; M10-F206 HydrophobicContact CG-CD1 4.12Å; M10-F206 HydrophobicContact CG-CG 3.96Å; M10-L230 HydrophobicContact CE-CD2 3.59Å
11V85.4Confident77.8Confident13 Ų1341.8 Ų41.88%0.07924%0.241CC..Hα-helixtrans-60.7-45.2176.5168.50000110.7L7 V8 S15 F143 I155 S158 F162L7-V11 VanDerWaalsContact O-CG2 3.3Å; L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.13Å; V8-V11 PolarHBondContact O-N 3.33Å; V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.33Å; V11-S15 PolarHBondContact O-OG 3.43Å; V11-F143 HydrophobicContact CB-CE1 4.27Å; V11-F143 HydrophobicContact CB-CZ 4.11Å; V11-F143 HydrophobicContact CG1-CE1 4.36Å; V11-F143 HydrophobicContact CG1-CE2 3.92Å; V11-F143 HydrophobicContact CG1-CZ 3.73Å; V11-F143 HydrophobicContact CG2-CD1 4.32Å; V11-F143 HydrophobicContact CG2-CE1 4.07Å; V11-F143 HydrophobicContact CG2-CZ 4.26Å; V11-F143 WeakPolarHBondContact O-CZ 3.12Å; V11-I155 HydrophobicContact CG2-CG2 3.69Å; V11-S158 WeakPolarHBondContact CG1-OG 3.46Å; V11-F162 HydrophobicContact CG1-CE2 3.99Å
12A85.9Confident80.5Confident30 Ų3030.3 Ų30.325%0.24819%0.187CC..Hα-helixtrans-61.8-50.9176.700000111.6V8 L9 M10 A14 S15 I16 F162V8-A12 WeakPolarHBondContact O-CB 3.48Å; V8-A12 PolarHBondContact O-N 3.02Å; L9-A12 PolarHBondContact O-N 3.1Å; M10-A12 PolarHBondContact O-N 3.28Å; A12-A14 PolarHBondContact O-N 3.07Å; A12-S15 PolarHBondContact O-N 2.66Å; A12-I16 WeakPolarHBondContact O-CD1 3.47Å; A12-I16 WeakPolarHBondContact O-CG1 3.35Å; A12-I16 PolarHBondContact O-N 2.99Å; A12-F162 HydrophobicContact CB-CZ 4.46Å
13S84.9Confident82.8Confident5 Ų528.7 Ų28.74%0.03517%0.171CC..Hα-helixtrans-58.3-48.7179.5170.20000112.5L9 M10 S15 T202 L203L9-S13 VanDerWaalsContact O-CB 3.25Å; L9-S13 WeakPolarHBondContact O-CB 3.41Å; L9-S13 PolarHBondContact O-N 3.45Å; M10-S13 PolarHBondContact O-N 2.81Å; S13-S15 VanDerWaalsContact C-N 3.33Å; S13-S15 PolarHBondContact O-N 3.31Å; S13-T202 VanDerWaalsContact OG-CB 3.28Å; S13-T202 WeakPolarHBondContact OG-CB 3.49Å; S13-T202 PolarHBondContact OG-OG1 3.24Å; S13-L203 PolarHBondContact OG-N 3.26Å
14A83.6Confident84.7Confident0 Ų026.2 Ų26.20%015%0.153CC..Hα-helixtrans-67.5-33.9179.100000112.3M10 A12 G18 Y142 F143 Q199 L203M10-A14 VanDerWaalsContact O-CB 3.28Å; M10-A14 WeakPolarHBondContact O-CB 3.37Å; M10-A14 PolarHBondContact O-N 3.2Å; A12-A14 PolarHBondContact O-N 3.07Å; A14-G18 PolarHBondContact O-N 3.45Å; A14-Y142 HydrophobicContact CB-CD1 4.17Å; A14-Y142 HydrophobicContact CB-CE1 4.21Å; A14-F143 HydrophobicContact CB-CE1 3.73Å; A14-F143 HydrophobicContact CB-CZ 4.17Å; A14-Q199 PolarHBondContact O-NE2 3.12Å; A14-L203 HydrophobicContact CB-CD1 4.05Å
15S85.4Confident85.9Confident0 Ų021.4 Ų21.40%012%0.122CC..Hα-helixtrans-72.2-38.3178.2-57.10000113.8V11 A12 S13 G17 G18 T19 L20 Q139 F143 F162V11-S15 WeakPolarHBondContact O-CB 3.45Å; V11-S15 PolarHBondContact O-N 3.33Å; V11-S15 PolarHBondContact O-OG 3.43Å; A12-S15 PolarHBondContact O-N 2.66Å; S13-S15 VanDerWaalsContact C-N 3.33Å; S13-S15 PolarHBondContact O-N 3.31Å; S15-G17 VanDerWaalsContact C-N 3.25Å; S15-G17 PolarHBondContact O-N 2.97Å; S15-G18 PolarHBondContact O-N 3.19Å; S15-T19 PolarHBondContact O-N 2.85Å; S15-L20 WeakPolarHBondContact O-CB 3.42Å; S15-L20 PolarHBondContact O-N 3.41Å; S15-L20 VanDerWaalsContact O-N 3.07Å; S15-Q139 PolarHBondContact OG-NE2 3.33Å; S15-F143 VanDerWaalsContact OG-CZ 3.23Å; S15-F143 WeakPolarHBondContact OG-CZ 3.14Å; S15-F162 WeakPolarHBondContact OG-CD2 3.4Å; S15-F162 WeakPolarHBondContact OG-CE2 3.46Å
16I86.3Confident86.4Confident44 Ų4416.9 Ų16.923%0.22610%0.098CC..Hα-helixtrans-56.1-42.5-179.1-74162.5000111.1A12 L20 P195 I198A12-I16 WeakPolarHBondContact O-CD1 3.47Å; A12-I16 WeakPolarHBondContact O-CG1 3.35Å; A12-I16 PolarHBondContact O-N 2.99Å; I16-L20 HydrophobicContact CG1-CD1 4.29Å; I16-P195 HydrophobicContact CG2-CB 3.91Å; I16-P195 WeakPolarHBondContact O-CB 3.36Å; I16-I198 HydrophobicContact CD1-CG2 4.32Å; I16-I198 HydrophobicContact CG2-CB 4.15Å; I16-I198 HydrophobicContact CG2-CG2 4Å
17G77.6Confident86.8Confident0 Ų015.2 Ų15.20%09%0.088CC..THydrogen-bonded Turntrans-96.711.1178.400000115.7S15 Q21 Q199S15-G17 VanDerWaalsContact C-N 3.25Å; S15-G17 PolarHBondContact O-N 2.97Å; G17-Q21 VanDerWaalsContact CA-NE2 3.29Å; G17-Q21 VanDerWaalsContact O-CD 3.28Å; G17-Q21 PolarHBondContact O-NE2 3.39Å; G17-Q21 PolarHBondContact O-OE1 3.35Å; G17-Q199 PolarHBondContact O-OE1 3.43Å; G17-Q199 VanDerWaalsContact O-OE1 3.14Å
18G84.2Confident87.3Confident0 Ų014.6 Ų14.60%09%0.085CC..THydrogen-bonded Turntrans-123.1-100.6-179.300000112.5A14 S15 L20 Q21 Y22A14-G18 PolarHBondContact O-N 3.45Å; S15-G18 PolarHBondContact O-N 3.19Å; G18-L20 VanDerWaalsContact C-N 3.3Å; G18-L20 PolarHBondContact O-N 3.44Å; G18-Q21 WeakPolarHBondContact O-CB 3.48Å; G18-Q21 PolarHBondContact O-N 3.13Å; G18-Y22 PolarHBondContact O-N 3.14Å; G18-Y22 VanDerWaalsContact O-N 3.11Å
19T87.2Confident87.5Confident5 Ų510.2 Ų10.23%0.0316%0.058CC..Hα-helixtrans-60.3-33.7-178.6400000113.6S15 Y22 G23 Q139 S159 T163S15-T19 PolarHBondContact O-N 2.85Å; T19-Y22 PolarHBondContact O-N 3.49Å; T19-G23 PolarHBondContact O-N 3.12Å; T19-Q139 VanDerWaalsContact OG1-CD 3.24Å; T19-Q139 PolarHBondContact OG1-NE2 2.95Å; T19-Q139 PolarHBondContact OG1-OE1 2.82Å; T19-S159 WeakPolarHBondContact CB-O 3.46Å; T19-T163 WeakPolarHBondContact CB-OG1 3.26Å; T19-T163 WeakPolarHBondContact O-CA 3.34Å; T19-T163 PolarHBondContact O-OG1 3.07Å
20L91Very high87.7Confident6 Ų66.3 Ų6.33%0.0314%0.038CC..Hα-helixtrans-63.2-45.2171.7-175.3160.7000110.7S15 I16 G18 Y22 G23 Y24 F162 F165 G166 L169 P195S15-L20 WeakPolarHBondContact O-CB 3.42Å; S15-L20 PolarHBondContact O-N 3.41Å; S15-L20 VanDerWaalsContact O-N 3.07Å; I16-L20 HydrophobicContact CG1-CD1 4.29Å; G18-L20 VanDerWaalsContact C-N 3.3Å; G18-L20 PolarHBondContact O-N 3.44Å; L20-Y22 VanDerWaalsContact C-N 3.31Å; L20-Y22 PolarHBondContact O-N 2.94Å; L20-G23 PolarHBondContact O-N 3.07Å; L20-Y24 WeakPolarHBondContact O-CB 3.27Å; L20-Y24 PolarHBondContact O-N 3.04Å; L20-F162 WeakPolarHBondContact CA-O 3.24Å; L20-F165 HydrophobicContact CD1-CD1 3.67Å; L20-F165 HydrophobicContact CD1-CE1 3.94Å; L20-F165 HydrophobicContact CG-CD1 4.41Å; L20-G166 WeakPolarHBondContact O-CA 3.37Å; L20-L169 HydrophobicContact CD2-CD2 4.22Å; L20-P195 HydrophobicContact CD2-CB 4.33Å; L20-P195 HydrophobicContact CD2-CG 4.24Å
21Q90.6Very high87.8Confident1 Ų17 Ų71%0.0054%0.043CC..Hα-helixtrans-62-40.2177.4-68-178.9-1.400111.7G17 G18 G23 Y24 N25 N131 P195 G196G17-Q21 VanDerWaalsContact CA-NE2 3.29Å; G17-Q21 VanDerWaalsContact O-CD 3.28Å; G17-Q21 PolarHBondContact O-NE2 3.39Å; G17-Q21 PolarHBondContact O-OE1 3.35Å; G18-Q21 WeakPolarHBondContact O-CB 3.48Å; G18-Q21 PolarHBondContact O-N 3.13Å; Q21-G23 PolarHBondContact O-N 3.5Å; Q21-Y24 WeakPolarHBondContact O-CB 3.27Å; Q21-Y24 PolarHBondContact O-N 3.05Å; Q21-N25 PolarHBondContact O-N 2.94Å; Q21-N25 PolarHBondContact O-ND2 2.91Å; Q21-N131 PolarHBondContact OE1-ND2 3.23Å; Q21-P195 HydrophobicContact CG-CB 4.03Å; Q21-G196 VanDerWaalsContact NE2-N 3.12Å
22Y90.5Very high88Confident10 Ų106.3 Ų6.34%0.0394%0.039CC..Hα-helixtrans-55.5-53.6175.2169.5-113.6000111.3G18 T19 L20 Y24 N25 L26 F68 A132 M136 T163 D287 W414G18-Y22 PolarHBondContact O-N 3.14Å; G18-Y22 VanDerWaalsContact O-N 3.11Å; T19-Y22 PolarHBondContact O-N 3.49Å; L20-Y22 VanDerWaalsContact C-N 3.31Å; L20-Y22 PolarHBondContact O-N 2.94Å; Y22-Y24 VanDerWaalsContact C-N 3.32Å; Y22-Y24 PolarHBondContact O-N 3.11Å; Y22-N25 PolarHBondContact O-N 3.09Å; Y22-L26 HydrophobicContact CD1-CD1 4.37Å; Y22-L26 HydrophobicContact CE1-CD1 3.78Å; Y22-L26 HydrophobicContact CE2-CD1 4.19Å; Y22-L26 HydrophobicContact CE2-CD2 4.04Å; Y22-L26 HydrophobicContact CE2-CG 4.14Å; Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 3.29Å; Y22-L26 VanDerWaalsContact O-N 3.11Å; Y22-F68 HydrophobicContact CD2-CE1 4.31Å; Y22-F68 AromaticContact CD2-CZ 3.99Å; Y22-F68 HydrophobicContact CD2-CZ 3.99Å; Y22-F68 HydrophobicContact CE2-CE1 4.11Å; Y22-F68 HydrophobicContact CE2-CZ 4.26Å; Y22-A132 HydrophobicContact CD2-CB 4.01Å; Y22-M136 HydrophobicContact CD1-CE 3.72Å; Y22-M136 HydrophobicContact CD1-CG 4.28Å; Y22-M136 HydrophobicContact CD1-SD 3.55Å; Y22-M136 VanDerWaalsContact CD1-SD 3.55Å; Y22-M136 HydrophobicContact CD2-CG 4.49Å; Y22-M136 HydrophobicContact CD2-SD 3.56Å; Y22-M136 VanDerWaalsContact CD2-SD 3.56Å; Y22-M136 HydrophobicContact CE1-CE 3.5Å; Y22-M136 HydrophobicContact CE1-SD 3.64Å; Y22-M136 HydrophobicContact CE2-SD 3.66Å; Y22-M136 HydrophobicContact CG-CE 4.3Å; Y22-M136 HydrophobicContact CG-CG 4.06Å; Y22-M136 HydrophobicContact CG-SD 3.49Å; Y22-T163 HydrophobicContact CD1-CG2 3.62Å; Y22-T163 HydrophobicContact CE1-CG2 3.97Å; Y22-D287 PolarHBondContact OH-OD2 2.72Å; Y22-W414 AromaticContact CD2-CH2 3.83Å; Y22-W414 HydrophobicContact CD2-CH2 3.83Å; Y22-W414 AromaticContact CE2-CH2 3.52Å; Y22-W414 HydrophobicContact CE2-CH2 3.52Å; Y22-W414 HydrophobicContact CE2-CZ2 4.37Å; Y22-W414 AromaticContact CE2-CZ3 3.99Å; Y22-W414 HydrophobicContact CE2-CZ3 3.99Å
23G90.9Very high88.1Confident0 Ų05.1 Ų5.10%03%0.029CC..Hα-helixtrans-60.8-39.5177.400000113.3T19 L20 Q21 N25 L26 A27 T163 V167T19-G23 PolarHBondContact O-N 3.12Å; L20-G23 PolarHBondContact O-N 3.07Å; Q21-G23 PolarHBondContact O-N 3.5Å; G23-N25 PolarHBondContact O-N 3.27Å; G23-L26 WeakPolarHBondContact O-CB 3.41Å; G23-L26 PolarHBondContact O-N 2.98Å; G23-A27 PolarHBondContact O-N 2.82Å; G23-T163 WeakPolarHBondContact CA-O 3.42Å; G23-V167 WeakPolarHBondContact O-CA 3.32Å; G23-V167 WeakPolarHBondContact O-CG2 3.38Å
24Y92.8Very high88.3Confident6 Ų68.3 Ų8.32%0.0245%0.049CC..Hα-helixtrans-57.4-48.4174.8-167.3-98.1000111.4L20 Q21 Y22 L26 A27 I28 G166 L169 G170 V173 S191 N192L20-Y24 WeakPolarHBondContact O-CB 3.27Å; L20-Y24 PolarHBondContact O-N 3.04Å; Q21-Y24 WeakPolarHBondContact O-CB 3.27Å; Q21-Y24 PolarHBondContact O-N 3.05Å; Y22-Y24 VanDerWaalsContact C-N 3.32Å; Y22-Y24 PolarHBondContact O-N 3.11Å; Y24-L26 VanDerWaalsContact C-N 3.28Å; Y24-L26 PolarHBondContact O-N 3.07Å; Y24-A27 PolarHBondContact O-N 3.19Å; Y24-A27 VanDerWaalsContact O-N 3.15Å; Y24-I28 HydrophobicContact CD1-CD1 4.19Å; Y24-I28 HydrophobicContact CD1-CG2 3.64Å; Y24-I28 HydrophobicContact CD2-CG2 4.41Å; Y24-I28 HydrophobicContact CE1-CD1 4.19Å; Y24-I28 HydrophobicContact CE1-CG2 3.33Å; Y24-I28 HydrophobicContact CE2-CG2 4.15Å; Y24-I28 HydrophobicContact CG-CG2 4.17Å; Y24-I28 VanDerWaalsContact O-CG2 3.32Å; Y24-I28 WeakPolarHBondContact O-CG2 3.48Å; Y24-I28 PolarHBondContact O-N 3.47Å; Y24-G166 VanDerWaalsContact CA-O 3.28Å; Y24-G166 WeakPolarHBondContact CA-O 3.17Å; Y24-G166 PolarHBondContact N-O 3.13Å; Y24-L169 HydrophobicContact CD2-CB 4.25Å; Y24-L169 HydrophobicContact CD2-CD2 4.3Å; Y24-L169 HydrophobicContact CD2-CG 4.18Å; Y24-L169 HydrophobicContact CE2-CB 4.49Å; Y24-L169 HydrophobicContact CE2-CD2 4.37Å; Y24-L169 HydrophobicContact CE2-CG 4.05Å; Y24-G170 VanDerWaalsContact CD2-CA 3.47Å; Y24-G170 VanDerWaalsContact CE2-CA 3.44Å; Y24-V173 HydrophobicContact CE2-CB 4.43Å; Y24-V173 HydrophobicContact CE2-CG2 4.29Å; Y24-V173 WeakPolarHBondContact OH-CG1 3.3Å; Y24-S191 PolarHBondContact OH-OG 3.47Å; Y24-N192 HydrophobicContact CD1-CB 3.98Å; Y24-N192 HydrophobicContact CE1-CB 3.96Å
25N91.6Very high88.6Confident0 Ų010.6 Ų10.60%06%0.058CC..Hα-helixtrans-71.3-19.4-178.6-73.9-71.9000114.8Q21 Y22 G23 I28 F68 R125 I128 N192Q21-N25 PolarHBondContact O-N 2.94Å; Q21-N25 PolarHBondContact O-ND2 2.91Å; Y22-N25 PolarHBondContact O-N 3.09Å; G23-N25 PolarHBondContact O-N 3.27Å; N25-I28 WeakPolarHBondContact OD1-CD1 3.45Å; N25-F68 HydrophobicContact CB-CE2 3.93Å; N25-F68 HydrophobicContact CB-CZ 4.07Å; N25-R125 PolarHBondContact O-NH1 3.08Å; N25-R125 PolarHBondContact O-NH2 3.11Å; N25-I128 HydrophobicContact CB-CG2 4.19Å; N25-I128 VanDerWaalsContact OD1-CG2 3.25Å; N25-I128 WeakPolarHBondContact OD1-CG2 3.35Å; N25-N192 VanDerWaalsContact CG-ND2 3.31Å; N25-N192 VanDerWaalsContact ND2-CG 3.29Å; N25-N192 PolarHBondContact ND2-ND2 2.84Å; N25-N192 PolarHBondContact ND2-OD1 3.43Å; N25-N192 PolarHBondContact OD1-ND2 3.28Å
26L89Confident88.9Confident2 Ų210.6 Ų10.61%0.016%0.058CC..Hα-helixtrans-68-47.1168.3-68.6179.3000110.6Y22 G23 Y24 F68 D287 F291Y22-L26 HydrophobicContact CD1-CD1 4.37Å; Y22-L26 HydrophobicContact CE1-CD1 3.78Å; Y22-L26 HydrophobicContact CE2-CD1 4.19Å; Y22-L26 HydrophobicContact CE2-CD2 4.04Å; Y22-L26 HydrophobicContact CE2-CG 4.14Å; Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 3.29Å; Y22-L26 VanDerWaalsContact O-N 3.11Å; G23-L26 WeakPolarHBondContact O-CB 3.41Å; G23-L26 PolarHBondContact O-N 2.98Å; Y24-L26 VanDerWaalsContact C-N 3.28Å; Y24-L26 PolarHBondContact O-N 3.07Å; L26-F68 HydrophobicContact CD2-CE1 4.11Å; L26-D287 HydrophobicContact CD2-CB 4.47Å; L26-F291 HydrophobicContact CB-CE1 4.41Å; L26-F291 HydrophobicContact CD2-CE1 3.65Å; L26-F291 HydrophobicContact CD2-CE2 4.13Å; L26-F291 HydrophobicContact CD2-CZ 3.35Å; L26-F291 VanDerWaalsContact O-CD1 3.26Å; L26-F291 WeakPolarHBondContact O-CD1 3.29Å
27A90.5Very high89.1Confident4 Ų410 Ų103%0.0335%0.054CC..Hα-helixtrans-81.4-37.4-172.700000115G23 Y24 M29 N30 V167 Q171G23-A27 PolarHBondContact O-N 2.82Å; Y24-A27 PolarHBondContact O-N 3.19Å; Y24-A27 VanDerWaalsContact O-N 3.15Å; A27-M29 PolarHBondContact O-N 2.95Å; A27-M29 VanDerWaalsContact O-N 3.11Å; A27-N30 PolarHBondContact O-N 3.47Å; A27-V167 HydrophobicContact CB-CG1 4.23Å; A27-V167 WeakPolarHBondContact CB-O 3.41Å; A27-Q171 HydrophobicContact CB-CG 3.79Å
28I90.9Very high89.8Confident1 Ų113.4 Ų13.41%0.0058%0.076CC..THydrogen-bonded Turntrans-63.2-22.7-171.462.7-178.4000114.5Y24 N25 N30 P32 L188 L189Y24-I28 HydrophobicContact CD1-CD1 4.19Å; Y24-I28 HydrophobicContact CD1-CG2 3.64Å; Y24-I28 HydrophobicContact CD2-CG2 4.41Å; Y24-I28 HydrophobicContact CE1-CD1 4.19Å; Y24-I28 HydrophobicContact CE1-CG2 3.33Å; Y24-I28 HydrophobicContact CE2-CG2 4.15Å; Y24-I28 HydrophobicContact CG-CG2 4.17Å; Y24-I28 VanDerWaalsContact O-CG2 3.32Å; Y24-I28 WeakPolarHBondContact O-CG2 3.48Å; Y24-I28 PolarHBondContact O-N 3.47Å; N25-I28 WeakPolarHBondContact OD1-CD1 3.45Å; I28-N30 VanDerWaalsContact C-N 3.28Å; I28-N30 PolarHBondContact O-N 3.13Å; I28-P32 WeakPolarHBondContact O-CD 3.2Å; I28-P32 WeakPolarHBondContact O-CG 3.34Å; I28-L188 HydrophobicContact CB-CG 4.5Å; I28-L188 HydrophobicContact CG2-CD1 4.27Å; I28-L189 HydrophobicContact CD1-CD2 4.17Å; I28-L189 HydrophobicContact CG1-CD2 4.34Å
29M89.4Confident90.1Very high0 Ų014.2 Ų14.20%08%0.079CC..THydrogen-bonded Turntrans-72.9-23.4-178.6-70.5-57.2-63.200112.5A27 P32 T33 I36 W61 I64 V65 L189A27-M29 PolarHBondContact O-N 2.95Å; A27-M29 VanDerWaalsContact O-N 3.11Å; M29-P32 WeakPolarHBondContact O-CD 3.45Å; M29-T33 PolarHBondContact O-OG1 3.16Å; M29-I36 HydrophobicContact CE-CD1 4.39Å; M29-W61 HydrophobicContact CE-CH2 3.52Å; M29-W61 HydrophobicContact CE-CZ2 4.49Å; M29-W61 HydrophobicContact CE-CZ3 3.62Å; M29-W61 WeakPolarHBondContact O-CH2 3.28Å; M29-I64 HydrophobicContact CE-CG2 4.07Å; M29-V65 HydrophobicContact CE-CG2 4.09Å; M29-L189 HydrophobicContact SD-CD2 3.61Å
30N89.1Confident90.3Very high5 Ų514 Ų143%0.0278%0.078CC..THydrogen-bonded Turntrans-71.2-45.8-175.2177.959.1000113A27 I28 T33 Y290 A293 S294A27-N30 PolarHBondContact O-N 3.47Å; I28-N30 VanDerWaalsContact C-N 3.28Å; I28-N30 PolarHBondContact O-N 3.13Å; N30-T33 WeakPolarHBondContact O-CB 3.42Å; N30-T33 PolarHBondContact O-N 3.16Å; N30-T33 PolarHBondContact O-OG1 3.34Å; N30-Y290 VanDerWaalsContact CB-O 3.32Å; N30-Y290 WeakPolarHBondContact CB-O 3.32Å; N30-A293 PolarHBondContact OD1-N 3.18Å; N30-A293 VanDerWaalsContact OD1-N 3.15Å; N30-S294 PolarHBondContact ND2-OG 3.49Å; N30-S294 WeakPolarHBondContact OD1-CB 3.45Å; N30-S294 PolarHBondContact OD1-N 3.28Å; N30-S294 PolarHBondContact OD1-OG 2.96Å
31A87.3Confident90.4Very high14 Ų1415.4 Ų15.412%0.1169%0.085CC..THydrogen-bonded Turntrans-60.6-43.4-175.800000114.3T33 G174 L188A31-T33 VanDerWaalsContact C-N 3.32Å; A31-T33 PolarHBondContact O-N 3.25Å; A31-G174 WeakPolarHBondContact CB-O 3.35Å; A31-L188 HydrophobicContact CB-CD2 4.2Å
32P89.2Confident90.4Very high0 Ų020 Ų200%011%0.107CC..THydrogen-bonded Turntrans-89.314.5179.937.1-38000114.3I28 M29 T34 F35 I36 W185 L188I28-P32 WeakPolarHBondContact O-CD 3.2Å; I28-P32 WeakPolarHBondContact O-CG 3.34Å; M29-P32 WeakPolarHBondContact O-CD 3.45Å; P32-T34 PolarHBondContact O-N 2.88Å; P32-F35 HydrophobicContact CB-CD2 4.44Å; P32-F35 PolarHBondContact O-N 3.5Å; P32-I36 HydrophobicContact CB-CD1 3.95Å; P32-I36 HydrophobicContact CB-CG1 4.21Å; P32-I36 HydrophobicContact CG-CD1 3.8Å; P32-I36 WeakPolarHBondContact O-CG1 3.46Å; P32-I36 PolarHBondContact O-N 3Å; P32-W185 HydrophobicContact CB-CB 3.64Å; P32-L188 HydrophobicContact CG-CD2 4.13Å
33T89.4Confident90.4Very high4 Ų419.6 Ų19.63%0.02511%0.105CC..Hα-helixtrans-49.3-55.6-175.3-64.60000112.5M29 N30 A31 F35 I36 Q37 W61 Y295M29-T33 PolarHBondContact O-OG1 3.16Å; N30-T33 WeakPolarHBondContact O-CB 3.42Å; N30-T33 PolarHBondContact O-N 3.16Å; N30-T33 PolarHBondContact O-OG1 3.34Å; A31-T33 VanDerWaalsContact C-N 3.32Å; A31-T33 PolarHBondContact O-N 3.25Å; T33-F35 PolarHBondContact O-N 3.46Å; T33-I36 PolarHBondContact O-N 3.49Å; T33-Q37 WeakPolarHBondContact O-CB 3.34Å; T33-Q37 VanDerWaalsContact O-CG 3.25Å; T33-Q37 WeakPolarHBondContact O-CG 3.31Å; T33-Q37 PolarHBondContact O-N 2.95Å; T33-W61 HydrophobicContact CG2-CZ2 3.78Å; T33-W61 WeakPolarHBondContact OG1-CZ2 3.45Å; T33-Y295 HydrophobicContact CG2-CE2 3.79Å
34T88.4Confident90.3Very high73 Ų7321.4 Ų21.445%0.44811%0.114SC..Hα-helixtrans-65.2-41-177.750.10000111.7P32 Q37 T38P32-T34 PolarHBondContact O-N 2.88Å; T34-Q37 PolarHBondContact O-N 3.24Å; T34-T38 PolarHBondContact O-N 3.12Å; T34-T38 PolarHBondContact O-OG1 2.91Å; T34-T38 VanDerWaalsContact O-OG1 3.07Å
35F90.3Very high90.2Very high47 Ų4724.8 Ų24.821%0.20613%0.132CC..Hα-helixtrans-66-40.4179.7-53.7-49.2000112.8P32 T33 Q37 T38 F39 G180 E182P32-F35 HydrophobicContact CB-CD2 4.44Å; P32-F35 PolarHBondContact O-N 3.5Å; T33-F35 PolarHBondContact O-N 3.46Å; F35-Q37 VanDerWaalsContact C-N 3.35Å; F35-T38 PolarHBondContact O-N 3.49Å; F35-F39 WeakPolarHBondContact O-CB 3.34Å; F35-F39 PolarHBondContact O-N 3.34Å; F35-G180 WeakPolarHBondContact CE2-O 3.17Å; F35-E182 HydrophobicContact CD1-CB 3.8Å; F35-E182 HydrophobicContact CD1-CG 3.77Å; F35-E182 HydrophobicContact CE1-CB 3.77Å; F35-E182 HydrophobicContact CE1-CG 4.16Å; F35-E182 HydrophobicContact CG-CB 4.3Å; F35-E182 HydrophobicContact CG-CG 4.35Å; F35-E182 HydrophobicContact CZ-CB 4.25Å
36I90.6Very high90.2Very high0 Ų032.1 Ų32.10%017%0.166CC..Hα-helixtrans-70.3-35.8177.6-64.6169.8000110.3M29 P32 T33 F39 I40 W61 I121 W185 L189M29-I36 HydrophobicContact CE-CD1 4.39Å; P32-I36 HydrophobicContact CB-CD1 3.95Å; P32-I36 HydrophobicContact CB-CG1 4.21Å; P32-I36 HydrophobicContact CG-CD1 3.8Å; P32-I36 WeakPolarHBondContact O-CG1 3.46Å; P32-I36 PolarHBondContact O-N 3Å; T33-I36 PolarHBondContact O-N 3.49Å; I36-F39 PolarHBondContact O-N 3.02Å; I36-I40 HydrophobicContact CG2-CD1 4.04Å; I36-I40 HydrophobicContact CG2-CG1 4.43Å; I36-I40 WeakPolarHBondContact O-CD1 3.48Å; I36-I40 VanDerWaalsContact O-CG1 3.24Å; I36-I40 WeakPolarHBondContact O-CG1 3.34Å; I36-I40 PolarHBondContact O-N 2.99Å; I36-W61 HydrophobicContact CB-CE3 4.22Å; I36-W61 HydrophobicContact CB-CZ3 3.73Å; I36-W61 HydrophobicContact CD1-CH2 4.12Å; I36-W61 HydrophobicContact CD1-CZ3 3.74Å; I36-W61 HydrophobicContact CG1-CZ3 4.33Å; I36-W61 HydrophobicContact CG2-CE3 3.84Å; I36-W61 HydrophobicContact CG2-CZ3 3.62Å; I36-I121 HydrophobicContact CG2-CD1 4.34Å; I36-W185 HydrophobicContact CD1-CE3 4.15Å; I36-W185 HydrophobicContact CD1-CZ3 4.46Å; I36-W185 HydrophobicContact CG1-CD2 4.22Å; I36-W185 HydrophobicContact CG1-CE3 3.87Å; I36-W185 HydrophobicContact CG1-CZ3 4.15Å; I36-L189 HydrophobicContact CD1-CD1 4.27Å
37Q91.5Very high90.3Very high31 Ų3136.8 Ų36.815%0.14518%0.183CC..Hα-helixtrans-63-45.5174.2-75174.8-15.400112.6T33 T34 F35 F39 I40 N41 V57 W61 Y295T33-Q37 WeakPolarHBondContact O-CB 3.34Å; T33-Q37 VanDerWaalsContact O-CG 3.25Å; T33-Q37 WeakPolarHBondContact O-CG 3.31Å; T33-Q37 PolarHBondContact O-N 2.95Å; T34-Q37 PolarHBondContact O-N 3.24Å; F35-Q37 VanDerWaalsContact C-N 3.35Å; Q37-F39 VanDerWaalsContact C-N 3.33Å; Q37-F39 PolarHBondContact O-N 2.89Å; Q37-I40 PolarHBondContact O-N 2.8Å; Q37-N41 PolarHBondContact O-N 3.32Å; Q37-N41 VanDerWaalsContact O-N 3.08Å; Q37-V57 HydrophobicContact CB-CG1 3.7Å; Q37-V57 HydrophobicContact CG-CG1 3.87Å; Q37-W61 HydrophobicContact CG-CB 4.07Å; Q37-W61 HydrophobicContact CG-CD2 4.38Å; Q37-W61 HydrophobicContact CG-CG 4.1Å; Q37-Y295 PolarHBondContact NE2-OH 3.01Å
38T91.3Very high90.2Very high73 Ų7343 Ų4345%0.44821%0.206SC..Hα-helixtrans-59.5-45.5173-55.60000110.9T34 F35 I40 N41 E42T34-T38 PolarHBondContact O-N 3.12Å; T34-T38 PolarHBondContact O-OG1 2.91Å; T34-T38 VanDerWaalsContact O-OG1 3.07Å; F35-T38 PolarHBondContact O-N 3.49Å; T38-I40 VanDerWaalsContact C-N 3.33Å; T38-I40 PolarHBondContact O-N 2.99Å; T38-N41 PolarHBondContact O-N 3.06Å; T38-N41 VanDerWaalsContact O-N 3.14Å; T38-E42 HydrophobicContact CG2-CG 4.28Å; T38-E42 WeakPolarHBondContact O-CG 3.36Å; T38-E42 PolarHBondContact O-N 2.97Å
39F91.4Very high90Very high17 Ų1749.7 Ų49.78%0.07524%0.242CC..Hα-helixtrans-60.2-38.9177.3175.4-108.5000113.2F35 I36 Q37 T43 R113 F118 I121 W185F35-F39 WeakPolarHBondContact O-CB 3.34Å; F35-F39 PolarHBondContact O-N 3.34Å; I36-F39 PolarHBondContact O-N 3.02Å; Q37-F39 VanDerWaalsContact C-N 3.33Å; Q37-F39 PolarHBondContact O-N 2.89Å; F39-T43 VanDerWaalsContact O-CB 3.28Å; F39-T43 WeakPolarHBondContact O-CB 3.39Å; F39-T43 PolarHBondContact O-N 3.5Å; F39-T43 PolarHBondContact O-OG1 2.76Å; F39-R113 HydrophobicContact CE2-CG 4.39Å; F39-F118 HydrophobicContact CE1-CB 4.28Å; F39-I121 HydrophobicContact CD1-CD1 4.17Å; F39-I121 HydrophobicContact CE1-CD1 4.03Å; F39-W185 HydrophobicContact CD1-CH2 4.22Å; F39-W185 HydrophobicContact CD1-CZ2 4.2Å; F39-W185 HydrophobicContact CD2-CZ2 4.43Å; F39-W185 HydrophobicContact CE1-CH2 4.34Å; F39-W185 HydrophobicContact CG-CZ2 4.13Å
40I91.5Very high90Very high0 Ų053.4 Ų53.40%026%0.264CS..Hα-helixtrans-61.2-49.2174.3-69.3159.1000109.8I36 Q37 T38 T43 F44 L52 V60 I64 F118I36-I40 HydrophobicContact CG2-CD1 4.04Å; I36-I40 HydrophobicContact CG2-CG1 4.43Å; I36-I40 WeakPolarHBondContact O-CD1 3.48Å; I36-I40 VanDerWaalsContact O-CG1 3.24Å; I36-I40 WeakPolarHBondContact O-CG1 3.34Å; I36-I40 PolarHBondContact O-N 2.99Å; Q37-I40 PolarHBondContact O-N 2.8Å; T38-I40 VanDerWaalsContact C-N 3.33Å; T38-I40 PolarHBondContact O-N 2.99Å; I40-T43 PolarHBondContact O-N 3.42Å; I40-F44 HydrophobicContact CG2-CD2 4.05Å; I40-F44 HydrophobicContact CG2-CE2 4.23Å; I40-F44 WeakPolarHBondContact O-CD2 3.49Å; I40-F44 PolarHBondContact O-N 3.34Å; I40-L52 HydrophobicContact CG2-CD1 4.12Å; I40-V60 HydrophobicContact CD1-CG1 4.05Å; I40-V60 HydrophobicContact CG1-CG1 4.42Å; I40-V60 HydrophobicContact CG2-CB 4.27Å; I40-V60 HydrophobicContact CG2-CG1 3.95Å; I40-I64 HydrophobicContact CD1-CD1 3.59Å; I40-I64 HydrophobicContact CG1-CD1 4.25Å; I40-F118 HydrophobicContact CG1-CB 4.05Å; I40-F118 HydrophobicContact CG1-CG 4.38Å
41N92.7Very high89.9Confident35 Ų3560 Ų6019%0.18730%0.295CS..Hα-helixtrans-63.7-45.1-178.4-160.213.9000112Q37 T38 T43 F44 L45 L52 V57Q37-N41 PolarHBondContact O-N 3.32Å; Q37-N41 VanDerWaalsContact O-N 3.08Å; T38-N41 PolarHBondContact O-N 3.06Å; T38-N41 VanDerWaalsContact O-N 3.14Å; N41-T43 VanDerWaalsContact C-N 3.35Å; N41-T43 PolarHBondContact O-N 3.09Å; N41-F44 PolarHBondContact O-N 3.46Å; N41-L45 WeakPolarHBondContact O-CB 3.41Å; N41-L45 PolarHBondContact O-N 3.11Å; N41-L52 PolarHBondContact OD1-N 3.42Å; N41-L52 VanDerWaalsContact OD1-N 3.09Å; N41-V57 HydrophobicContact CB-CG2 4.33Å
42E90.3Very high89.9Confident97 Ų9760.3 Ų60.345%0.45330%0.295SS..Hα-helixtrans-60.2-42.6175.7-73.4177.6174.800112.2T38 L45 Q46T38-E42 HydrophobicContact CG2-CG 4.28Å; T38-E42 WeakPolarHBondContact O-CG 3.36Å; T38-E42 PolarHBondContact O-N 2.97Å; E42-L45 PolarHBondContact O-N 3.49Å; E42-Q46 WeakPolarHBondContact O-CB 3.05Å; E42-Q46 VanDerWaalsContact O-CG 3.29Å; E42-Q46 WeakPolarHBondContact O-CG 3.4Å; E42-Q46 PolarHBondContact O-N 3.28Å
43T90.1Very high89.9Confident2 Ų266.8 Ų66.81%0.01233%0.325CS..Hα-helixtrans-65.2-40178.6-58.70000111.4F39 I40 N41 Q46 R47 G116 F118F39-T43 VanDerWaalsContact O-CB 3.28Å; F39-T43 WeakPolarHBondContact O-CB 3.39Å; F39-T43 PolarHBondContact O-N 3.5Å; F39-T43 PolarHBondContact O-OG1 2.76Å; I40-T43 PolarHBondContact O-N 3.42Å; N41-T43 VanDerWaalsContact C-N 3.35Å; N41-T43 PolarHBondContact O-N 3.09Å; T43-Q46 PolarHBondContact O-N 3.31Å; T43-R47 HydrophobicContact CG2-CG 4.49Å; T43-R47 WeakPolarHBondContact O-CB 3.34Å; T43-R47 WeakPolarHBondContact O-CG 3.31Å; T43-R47 PolarHBondContact O-N 2.71Å; T43-R47 VanDerWaalsContact O-N 3.1Å; T43-G116 WeakPolarHBondContact CG2-O 3.48Å; T43-F118 HydrophobicContact CG2-CD1 4.02Å; T43-F118 HydrophobicContact CG2-CE1 4.38Å
44F89.6Confident89.7Confident39 Ų3973.2 Ų73.217%0.17136%0.359CS..Hα-helixtrans-65.5-44.5176.7-98.4-93.8000112I40 N41 Q46 R47 W48 L52 F118I40-F44 HydrophobicContact CG2-CD2 4.05Å; I40-F44 HydrophobicContact CG2-CE2 4.23Å; I40-F44 WeakPolarHBondContact O-CD2 3.49Å; I40-F44 PolarHBondContact O-N 3.34Å; N41-F44 PolarHBondContact O-N 3.46Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 2.98Å; F44-R47 PolarHBondContact O-N 3.48Å; F44-W48 HydrophobicContact CB-CE3 4.27Å; F44-W48 HydrophobicContact CD1-CD2 4.38Å; F44-W48 AromaticContact CD1-CE3 3.25Å; F44-W48 HydrophobicContact CD1-CE3 3.25Å; F44-W48 AromaticContact CD1-CZ3 3.35Å; F44-W48 HydrophobicContact CD1-CZ3 3.35Å; F44-W48 HydrophobicContact CD2-CZ3 4.07Å; F44-W48 AromaticContact CE1-CE3 3.61Å; F44-W48 HydrophobicContact CE1-CE3 3.61Å; F44-W48 HydrophobicContact CE1-CH2 4.2Å; F44-W48 AromaticContact CE1-CZ3 3.36Å; F44-W48 HydrophobicContact CE1-CZ3 3.36Å; F44-W48 HydrophobicContact CE2-CZ3 4.11Å; F44-W48 AromaticContact CG-CE3 3.81Å; F44-W48 HydrophobicContact CG-CE3 3.81Å; F44-W48 AromaticContact CG-CZ3 3.72Å; F44-W48 HydrophobicContact CG-CZ3 3.72Å; F44-W48 HydrophobicContact CZ-CE3 4.45Å; F44-W48 HydrophobicContact CZ-CH2 4.39Å; F44-W48 AromaticContact CZ-CZ3 3.76Å; F44-W48 HydrophobicContact CZ-CZ3 3.76Å; F44-W48 PolarHBondContact O-N 3.3Å; F44-L52 HydrophobicContact CB-CD1 4.02Å; F44-L52 HydrophobicContact CB-CG 4.07Å; F44-L52 HydrophobicContact CD1-CD1 4.02Å; F44-L52 HydrophobicContact CD1-CD2 3.98Å; F44-L52 HydrophobicContact CD1-CG 4.08Å; F44-L52 HydrophobicContact CD2-CD1 3.5Å; F44-L52 VanDerWaalsContact CD2-CD1 3.5Å; F44-L52 HydrophobicContact CD2-CG 4.36Å; F44-L52 HydrophobicContact CE1-CD1 4.38Å; F44-L52 HydrophobicContact CE1-CD2 4.24Å; F44-L52 HydrophobicContact CE2-CD1 3.86Å; F44-L52 HydrophobicContact CG-CD1 3.57Å; F44-L52 HydrophobicContact CG-CD2 4.32Å; F44-L52 HydrophobicContact CG-CG 3.92Å; F44-L52 HydrophobicContact CZ-CD1 4.3Å; F44-F118 HydrophobicContact CD2-CD1 4.46Å; F44-F118 AromaticContact CD2-CE1 3.73Å; F44-F118 HydrophobicContact CD2-CE1 3.73Å; F44-F118 HydrophobicContact CD2-CZ 4.24Å; F44-F118 HydrophobicContact CE2-CD1 4.26Å; F44-F118 AromaticContact CE2-CE1 3.3Å; F44-F118 HydrophobicContact CE2-CE1 3.3Å; F44-F118 HydrophobicContact CE2-CE2 4.3Å; F44-F118 AromaticContact CE2-CZ 3.34Å; F44-F118 HydrophobicContact CE2-CZ 3.34Å; F44-F118 HydrophobicContact CZ-CE1 4.15Å; F44-F118 AromaticContact CZ-CZ 3.86Å; F44-F118 HydrophobicContact CZ-CZ 3.86Å
45L90.1Very high89.6Confident77 Ų7776.6 Ų76.640%0.40337%0.365SS..Hα-helixtrans-60-45.2176.3-173.666.6000111N41 E42 R47 D49 V50 Q51N41-L45 WeakPolarHBondContact O-CB 3.41Å; N41-L45 PolarHBondContact O-N 3.11Å; E42-L45 PolarHBondContact O-N 3.49Å; L45-R47 PolarHBondContact O-N 3.38Å; L45-D49 WeakPolarHBondContact O-CA 3.42Å; L45-D49 PolarHBondContact O-N 2.94Å; L45-V50 PolarHBondContact N-O 2.94Å; L45-Q51 HydrophobicContact CD1-CB 4.46Å
46Q90.8Very high89.6Confident154 Ų15478.2 Ų78.272%0.7237%0.373SS*.Hα-helixtrans-65.7-34.3179.3-74.3176.57.300113.9E42 T43 F44E42-Q46 WeakPolarHBondContact O-CB 3.05Å; E42-Q46 VanDerWaalsContact O-CG 3.29Å; E42-Q46 WeakPolarHBondContact O-CG 3.4Å; E42-Q46 PolarHBondContact O-N 3.28Å; T43-Q46 PolarHBondContact O-N 3.31Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 2.98Å
47R91.1Very high89.6Confident99 Ų9978.8 Ų78.837%0.37438%0.376SS..Hα-helixtrans-87.7-36.6-175-72.4-179.9-179.9-1726.1113.8T43 F44 L45 G116 S117 E119T43-R47 HydrophobicContact CG2-CG 4.49Å; T43-R47 WeakPolarHBondContact O-CB 3.34Å; T43-R47 WeakPolarHBondContact O-CG 3.31Å; T43-R47 PolarHBondContact O-N 2.71Å; T43-R47 VanDerWaalsContact O-N 3.1Å; F44-R47 PolarHBondContact O-N 3.48Å; L45-R47 PolarHBondContact O-N 3.38Å; R47-G116 PolarHBondContact NH2-O 3.15Å; R47-S117 VanDerWaalsContact NH2-CA 3.33Å; R47-E119 IonicContact CZ-OE1 3.1Å; R47-E119 IonicContact CZ-OE2 3.8Å; R47-E119 IonicContact NH1-OE1 3.13Å; R47-E119 PolarHBondContact NH1-OE1 3.01Å; R47-E119 IonicContact NH1-OE2 3.17Å; R47-E119 PolarHBondContact NH1-OE2 3.26Å; R47-E119 IonicContact NH2-OE1 3.28Å; R47-E119 IonicContact NH2-OE2 2.89Å; R47-E119 PolarHBondContact NH2-OE2 3.42Å; R47-E119 VanDerWaalsContact NH2-OE2 3.17Å
48W89.6Confident89.5Confident134 Ų13478.6 Ų78.651%0.50838%0.377SS..Hα-helixtrans-127.2-1.5-169.9-62.2-68.5000113.9F44 V50F44-W48 HydrophobicContact CB-CE3 4.27Å; F44-W48 HydrophobicContact CD1-CD2 4.38Å; F44-W48 AromaticContact CD1-CE3 3.25Å; F44-W48 HydrophobicContact CD1-CE3 3.25Å; F44-W48 AromaticContact CD1-CZ3 3.35Å; F44-W48 HydrophobicContact CD1-CZ3 3.35Å; F44-W48 HydrophobicContact CD2-CZ3 4.07Å; F44-W48 AromaticContact CE1-CE3 3.61Å; F44-W48 HydrophobicContact CE1-CE3 3.61Å; F44-W48 HydrophobicContact CE1-CH2 4.2Å; F44-W48 AromaticContact CE1-CZ3 3.36Å; F44-W48 HydrophobicContact CE1-CZ3 3.36Å; F44-W48 HydrophobicContact CE2-CZ3 4.11Å; F44-W48 AromaticContact CG-CE3 3.81Å; F44-W48 HydrophobicContact CG-CE3 3.81Å; F44-W48 AromaticContact CG-CZ3 3.72Å; F44-W48 HydrophobicContact CG-CZ3 3.72Å; F44-W48 HydrophobicContact CZ-CE3 4.45Å; F44-W48 HydrophobicContact CZ-CH2 4.39Å; F44-W48 AromaticContact CZ-CZ3 3.76Å; F44-W48 HydrophobicContact CZ-CZ3 3.76Å; F44-W48 PolarHBondContact O-N 3.3Å; W48-V50 HydrophobicContact CB-CG2 4.49Å; W48-V50 PolarHBondContact O-N 2.9Å
49D87.1Confident89.5Confident142 Ų14278.1 Ų78.176%0.75937%0.372SS*.SBendtrans57.327.5-176.5-15338.7000113L45L45-D49 WeakPolarHBondContact O-CA 3.42Å; L45-D49 PolarHBondContact O-N 2.94Å
50V88.4Confident89.5Confident79 Ų7978.5 Ų78.548%0.47938%0.376SS..  trans-117.1124178.4176.40000109L45 W48L45-V50 PolarHBondContact N-O 2.94Å; W48-V50 HydrophobicContact CB-CG2 4.49Å; W48-V50 PolarHBondContact O-N 2.9Å
51Q87.7Confident89.5Confident143 Ų14378.5 Ų78.567%0.66838%0.376SS*.PPolyproline II helixtrans-85.1126.2170.1-169.5172.40.100109.4L45L45-Q51 HydrophobicContact CD1-CB 4.46Å
52L87.2Confident89.5Confident20 Ų2076.9 Ų76.911%0.10537%0.367CS..PPolyproline II helixtrans-77.2145.5179.9-68.3175.6000111I40 N41 F44 Q56 V57I40-L52 HydrophobicContact CG2-CD1 4.12Å; N41-L52 PolarHBondContact OD1-N 3.42Å; N41-L52 VanDerWaalsContact OD1-N 3.09Å; F44-L52 HydrophobicContact CB-CD1 4.02Å; F44-L52 HydrophobicContact CB-CG 4.07Å; F44-L52 HydrophobicContact CD1-CD1 4.02Å; F44-L52 HydrophobicContact CD1-CD2 3.98Å; F44-L52 HydrophobicContact CD1-CG 4.08Å; F44-L52 HydrophobicContact CD2-CD1 3.5Å; F44-L52 VanDerWaalsContact CD2-CD1 3.5Å; F44-L52 HydrophobicContact CD2-CG 4.36Å; F44-L52 HydrophobicContact CE1-CD1 4.38Å; F44-L52 HydrophobicContact CE1-CD2 4.24Å; F44-L52 HydrophobicContact CE2-CD1 3.86Å; F44-L52 HydrophobicContact CG-CD1 3.57Å; F44-L52 HydrophobicContact CG-CD2 4.32Å; F44-L52 HydrophobicContact CG-CG 3.92Å; F44-L52 HydrophobicContact CZ-CD1 4.3Å; L52-Q56 HydrophobicContact CB-CB 4.29Å; L52-Q56 HydrophobicContact CD2-CB 4.19Å; L52-V57 HydrophobicContact CB-CG2 3.6Å; L52-V57 HydrophobicContact CD1-CG2 4.16Å
53E89Confident89.7Confident136 Ų13675 Ų7564%0.63636%0.359SS*.PPolyproline II helixtrans-72.1154.3168.7-67.4-179.4178.400111.2Y55 Q56 V57E53-Y55 PolarHBondContact O-N 3.24Å; E53-Y55 VanDerWaalsContact O-N 3.13Å; E53-Q56 HydrophobicContact CB-CG 4.33Å; E53-Q56 VanDerWaalsContact N-OE1 3.12Å; E53-Q56 WeakPolarHBondContact O-CA 3.27Å; E53-Q56 WeakPolarHBondContact O-CB 3.5Å; E53-Q56 PolarHBondContact O-N 3.39Å; E53-V57 PolarHBondContact O-N 2.95Å
54D84.9Confident89.8Confident139 Ų13975 Ų7574%0.74336%0.359SS*.Hα-helixtrans-54.1-37.6-178.2-67.7-17.1000113.2T58D54-T58 WeakPolarHBondContact O-CB 3.27Å; D54-T58 PolarHBondContact O-N 2.96Å; D54-T58 PolarHBondContact O-OG1 3.49Å
55Y86.8Confident89.9Confident144 Ų14473.1 Ų73.157%0.56535%0.351SS*.Hα-helixtrans-64.2-41.2175.3175.6-95.3000112E53 T58 L59 F426E53-Y55 PolarHBondContact O-N 3.24Å; E53-Y55 VanDerWaalsContact O-N 3.13Å; Y55-T58 PolarHBondContact O-N 3.3Å; Y55-L59 WeakPolarHBondContact O-CB 3.44Å; Y55-L59 PolarHBondContact O-N 3.42Å; Y55-F426 HydrophobicContact CD2-CD1 4.39Å; Y55-F426 AromaticContact CD2-CE1 3.83Å; Y55-F426 HydrophobicContact CD2-CE1 3.83Å; Y55-F426 AromaticContact CE2-CD1 3.82Å; Y55-F426 HydrophobicContact CE2-CD1 3.82Å; Y55-F426 AromaticContact CE2-CE1 3.33Å; Y55-F426 HydrophobicContact CE2-CE1 3.33Å; Y55-F426 HydrophobicContact CE2-CZ 4.29Å
56Q90Very high90.1Very high81 Ų8169.4 Ų69.438%0.37933%0.332SS..Hα-helixtrans-69.7-41.3179.3-63.3177.5-3900111.3L52 E53 T58 L59 V60L52-Q56 HydrophobicContact CB-CB 4.29Å; L52-Q56 HydrophobicContact CD2-CB 4.19Å; E53-Q56 HydrophobicContact CB-CG 4.33Å; E53-Q56 VanDerWaalsContact N-OE1 3.12Å; E53-Q56 WeakPolarHBondContact O-CA 3.27Å; E53-Q56 WeakPolarHBondContact O-CB 3.5Å; E53-Q56 PolarHBondContact O-N 3.39Å; Q56-T58 VanDerWaalsContact C-N 3.33Å; Q56-L59 WeakPolarHBondContact O-CB 3.31Å; Q56-L59 PolarHBondContact O-N 3.11Å; Q56-V60 WeakPolarHBondContact O-CG2 3.44Å; Q56-V60 PolarHBondContact O-N 3.22Å
57V90.3Very high90.2Very high12 Ų1263.6 Ų63.67%0.07331%0.305CS..Hα-helixtrans-61.2-45174177.40000110.4Q37 N41 L52 E53 L59 V60 W61Q37-V57 HydrophobicContact CB-CG1 3.7Å; Q37-V57 HydrophobicContact CG-CG1 3.87Å; N41-V57 HydrophobicContact CB-CG2 4.33Å; L52-V57 HydrophobicContact CB-CG2 3.6Å; L52-V57 HydrophobicContact CD1-CG2 4.16Å; E53-V57 PolarHBondContact O-N 2.95Å; V57-L59 VanDerWaalsContact C-N 3.33Å; V57-L59 PolarHBondContact O-N 3.13Å; V57-V60 PolarHBondContact O-N 3.38Å; V57-W61 WeakPolarHBondContact O-CB 3.44Å; V57-W61 PolarHBondContact O-N 3.11Å
58T89.4Confident90.4Very high27 Ų2758.9 Ų58.917%0.16629%0.287CS..Hα-helixtrans-61.2-41.8176.2-58.80000111.1D54 Y55 Q56 W61 T62 P425 F426D54-T58 WeakPolarHBondContact O-CB 3.27Å; D54-T58 PolarHBondContact O-N 2.96Å; D54-T58 PolarHBondContact O-OG1 3.49Å; Y55-T58 PolarHBondContact O-N 3.3Å; Q56-T58 VanDerWaalsContact C-N 3.33Å; T58-W61 WeakPolarHBondContact O-CB 3.4Å; T58-W61 PolarHBondContact O-N 3.15Å; T58-T62 HydrophobicContact CG2-CG2 4.13Å; T58-T62 WeakPolarHBondContact O-CG2 3.42Å; T58-T62 PolarHBondContact O-N 3.27Å; T58-T62 PolarHBondContact O-OG1 2.96Å; T58-P425 HydrophobicContact CG2-CB 4.34Å; T58-F426 HydrophobicContact CG2-CE1 4.4Å; T58-F426 HydrophobicContact CG2-CZ 4.48Å
59L91.5Very high90.5Very high63 Ų6352.5 Ų52.533%0.3326%0.263SS..Hα-helixtrans-59.1-51.6175.7-172.377.5000111.6Y55 Q56 V57 W61 T62 I63 F426Y55-L59 WeakPolarHBondContact O-CB 3.44Å; Y55-L59 PolarHBondContact O-N 3.42Å; Q56-L59 WeakPolarHBondContact O-CB 3.31Å; Q56-L59 PolarHBondContact O-N 3.11Å; V57-L59 VanDerWaalsContact C-N 3.33Å; V57-L59 PolarHBondContact O-N 3.13Å; L59-W61 VanDerWaalsContact C-N 3.3Å; L59-W61 PolarHBondContact O-N 3.15Å; L59-T62 PolarHBondContact O-N 3.5Å; L59-T62 PolarHBondContact O-OG1 3.03Å; L59-I63 HydrophobicContact CG-CD1 4.25Å; L59-I63 VanDerWaalsContact O-CG1 3.32Å; L59-I63 WeakPolarHBondContact O-CG1 3.46Å; L59-I63 PolarHBondContact O-N 2.88Å; L59-F426 HydrophobicContact CD1-CE2 4.47Å; L59-F426 HydrophobicContact CD1-CZ 3.96Å
60V92.3Very high90.9Very high26 Ų2648.9 Ų48.916%0.15824%0.243CC..Hα-helixtrans-60.9-41.7178.4178.50000111I40 Q56 V57 I63 I64 F118I40-V60 HydrophobicContact CD1-CG1 4.05Å; I40-V60 HydrophobicContact CG1-CG1 4.42Å; I40-V60 HydrophobicContact CG2-CB 4.27Å; I40-V60 HydrophobicContact CG2-CG1 3.95Å; Q56-V60 WeakPolarHBondContact O-CG2 3.44Å; Q56-V60 PolarHBondContact O-N 3.22Å; V57-V60 PolarHBondContact O-N 3.38Å; V60-I63 PolarHBondContact O-N 2.98Å; V60-I64 HydrophobicContact CG1-CD1 4.02Å; V60-I64 WeakPolarHBondContact O-CG1 3.28Å; V60-I64 PolarHBondContact O-N 2.99Å; V60-F118 HydrophobicContact CG1-CD2 4.19Å; V60-F118 HydrophobicContact CG1-CE2 4.19Å
61W91.5Very high91.1Very high0 Ų045.1 Ų45.10%022%0.221CC..Hα-helixtrans-60.1-48.2174.4171.1-114.4000112.6M29 T33 I36 Q37 V57 T58 L59 I63 I64 V65 Y292M29-W61 HydrophobicContact CE-CH2 3.52Å; M29-W61 HydrophobicContact CE-CZ2 4.49Å; M29-W61 HydrophobicContact CE-CZ3 3.62Å; M29-W61 WeakPolarHBondContact O-CH2 3.28Å; T33-W61 HydrophobicContact CG2-CZ2 3.78Å; T33-W61 WeakPolarHBondContact OG1-CZ2 3.45Å; I36-W61 HydrophobicContact CB-CE3 4.22Å; I36-W61 HydrophobicContact CB-CZ3 3.73Å; I36-W61 HydrophobicContact CD1-CH2 4.12Å; I36-W61 HydrophobicContact CD1-CZ3 3.74Å; I36-W61 HydrophobicContact CG1-CZ3 4.33Å; I36-W61 HydrophobicContact CG2-CE3 3.84Å; I36-W61 HydrophobicContact CG2-CZ3 3.62Å; Q37-W61 HydrophobicContact CG-CB 4.07Å; Q37-W61 HydrophobicContact CG-CD2 4.38Å; Q37-W61 HydrophobicContact CG-CG 4.1Å; V57-W61 WeakPolarHBondContact O-CB 3.44Å; V57-W61 PolarHBondContact O-N 3.11Å; T58-W61 WeakPolarHBondContact O-CB 3.4Å; T58-W61 PolarHBondContact O-N 3.15Å; L59-W61 VanDerWaalsContact C-N 3.3Å; L59-W61 PolarHBondContact O-N 3.15Å; W61-I63 PolarHBondContact O-N 2.89Å; W61-I64 PolarHBondContact O-N 3.44Å; W61-I64 VanDerWaalsContact O-N 3.12Å; W61-V65 HydrophobicContact CD2-CG2 3.89Å; W61-V65 VanDerWaalsContact CE2-CG2 3.49Å; W61-V65 HydrophobicContact CE3-CG2 4.19Å; W61-V65 HydrophobicContact CH2-CG2 3.86Å; W61-V65 HydrophobicContact CZ2-CG2 3.49Å; W61-V65 VanDerWaalsContact CZ2-CG2 3.49Å; W61-V65 HydrophobicContact CZ3-CG2 4.17Å; W61-V65 WeakPolarHBondContact O-CG2 3.42Å; W61-V65 PolarHBondContact O-N 2.96Å; W61-Y292 AromaticContact NE1-CE1 3.59Å
62T91.9Very high91.3Very high0 Ų038.3 Ų38.30%019%0.189CC..Hα-helixtrans-60.4-36.5178630000112T58 L59 V65 S66 P425 F426T58-T62 HydrophobicContact CG2-CG2 4.13Å; T58-T62 WeakPolarHBondContact O-CG2 3.42Å; T58-T62 PolarHBondContact O-N 3.27Å; T58-T62 PolarHBondContact O-OG1 2.96Å; L59-T62 PolarHBondContact O-N 3.5Å; L59-T62 PolarHBondContact O-OG1 3.03Å; T62-V65 PolarHBondContact O-N 3.44Å; T62-S66 WeakPolarHBondContact O-CB 3.31Å; T62-S66 PolarHBondContact O-N 3.13Å; T62-S66 PolarHBondContact O-OG 3.02Å; T62-P425 HydrophobicContact CG2-CB 4.01Å; T62-P425 HydrophobicContact CG2-CG 3.61Å; T62-F426 HydrophobicContact CG2-CE2 3.98Å; T62-F426 HydrophobicContact CG2-CZ 4.31Å
63I93.9Very high91.5Very high59 Ų5939.9 Ų39.930%0.30320%0.195SC..Hα-helixtrans-64.6-47.6174.1-67.8166.5000110.4L59 V60 W61 V65 S66 I67 M122 M422L59-I63 HydrophobicContact CG-CD1 4.25Å; L59-I63 VanDerWaalsContact O-CG1 3.32Å; L59-I63 WeakPolarHBondContact O-CG1 3.46Å; L59-I63 PolarHBondContact O-N 2.88Å; V60-I63 PolarHBondContact O-N 2.98Å; W61-I63 PolarHBondContact O-N 2.89Å; I63-V65 VanDerWaalsContact C-N 3.32Å; I63-V65 PolarHBondContact O-N 3.4Å; I63-S66 PolarHBondContact O-N 2.86Å; I63-I67 VanDerWaalsContact O-CB 3.3Å; I63-I67 WeakPolarHBondContact O-CB 3.4Å; I63-I67 PolarHBondContact O-N 3.29Å; I63-M122 HydrophobicContact CG2-CE 3.57Å; I63-M422 HydrophobicContact CG1-CE 3.86Å; I63-M422 HydrophobicContact CG1-SD 4.07Å
64I93Very high91.6Very high0 Ų035 Ų350%018%0.178CC..Hα-helixtrans-58.9-43178.3-71.5161.3000111.5M29 I40 V60 W61 I67 I121 M122 R125M29-I64 HydrophobicContact CE-CG2 4.07Å; I40-I64 HydrophobicContact CD1-CD1 3.59Å; I40-I64 HydrophobicContact CG1-CD1 4.25Å; V60-I64 HydrophobicContact CG1-CD1 4.02Å; V60-I64 WeakPolarHBondContact O-CG1 3.28Å; V60-I64 PolarHBondContact O-N 2.99Å; W61-I64 PolarHBondContact O-N 3.44Å; W61-I64 VanDerWaalsContact O-N 3.12Å; I64-I67 WeakPolarHBondContact O-CG2 3.44Å; I64-I121 HydrophobicContact CG2-CG2 3.82Å; I64-M122 HydrophobicContact CD1-CG 4.48Å; I64-M122 HydrophobicContact CG1-CG 3.51Å; I64-M122 HydrophobicContact CG1-SD 4.35Å; I64-R125 HydrophobicContact CG2-CG 4.29Å
65V91.6Very high91.8Very high0 Ų028.4 Ų28.40%014%0.143CC..Hα-helixtrans-68.4-46.7178.7174.10000110.7M29 W61 T62 I63 F68 F291 Y292M29-V65 HydrophobicContact CE-CG2 4.09Å; W61-V65 HydrophobicContact CD2-CG2 3.89Å; W61-V65 VanDerWaalsContact CE2-CG2 3.49Å; W61-V65 HydrophobicContact CE3-CG2 4.19Å; W61-V65 HydrophobicContact CH2-CG2 3.86Å; W61-V65 HydrophobicContact CZ2-CG2 3.49Å; W61-V65 VanDerWaalsContact CZ2-CG2 3.49Å; W61-V65 HydrophobicContact CZ3-CG2 4.17Å; W61-V65 WeakPolarHBondContact O-CG2 3.42Å; W61-V65 PolarHBondContact O-N 2.96Å; T62-V65 PolarHBondContact O-N 3.44Å; I63-V65 VanDerWaalsContact C-N 3.32Å; I63-V65 PolarHBondContact O-N 3.4Å; V65-F68 WeakPolarHBondContact O-CB 3.43Å; V65-F291 HydrophobicContact CG1-CB 3.82Å; V65-F291 HydrophobicContact CG1-CD1 3.79Å; V65-F291 HydrophobicContact CG1-CD2 3.88Å; V65-F291 HydrophobicContact CG1-CE1 4.27Å; V65-F291 HydrophobicContact CG1-CE2 4.34Å; V65-F291 HydrophobicContact CG1-CG 3.59Å; V65-Y292 WeakPolarHBondContact CB-OH 3.49Å; V65-Y292 HydrophobicContact CG1-CE1 4.4Å; V65-Y292 HydrophobicContact CG1-CE2 4.41Å; V65-Y292 WeakPolarHBondContact CG1-OH 3.45Å; V65-Y292 HydrophobicContact CG2-CE1 4.35Å
66S92.9Very high91.6Very high0 Ų022.1 Ų22.10%012%0.121CC..Hα-helixtrans-76.7-27-172.4-570000113.9T62 I63 F68 S69 F418 G421 M422T62-S66 WeakPolarHBondContact O-CB 3.31Å; T62-S66 PolarHBondContact O-N 3.13Å; T62-S66 PolarHBondContact O-OG 3.02Å; I63-S66 PolarHBondContact O-N 2.86Å; S66-F68 PolarHBondContact O-N 3.42Å; S66-F68 VanDerWaalsContact O-N 3.11Å; S66-S69 VanDerWaalsContact O-CB 3.27Å; S66-S69 WeakPolarHBondContact O-CB 3.27Å; S66-S69 PolarHBondContact O-N 3.33Å; S66-S69 PolarHBondContact O-OG 2.98Å; S66-F418 WeakPolarHBondContact O-CD2 3.22Å; S66-G421 PolarHBondContact OG-O 3.02Å; S66-M422 PolarHBondContact OG-N 3.05Å; S66-M422 VanDerWaalsContact OG-N 3.1Å
67I94.8Very high91.3Very high31 Ų3121.7 Ų21.716%0.15912%0.121CC..Hα-helixtrans-62.8-21.3-179.9-152.3175.9000112.6I63 I64 S69 L70 G71 M122 R125 V126I63-I67 VanDerWaalsContact O-CB 3.3Å; I63-I67 WeakPolarHBondContact O-CB 3.4Å; I63-I67 PolarHBondContact O-N 3.29Å; I64-I67 WeakPolarHBondContact O-CG2 3.44Å; I67-S69 PolarHBondContact O-N 2.91Å; I67-L70 HydrophobicContact CG1-CD1 4.44Å; I67-L70 PolarHBondContact O-N 2.92Å; I67-G71 PolarHBondContact O-N 3.31Å; I67-M122 HydrophobicContact CD1-CE 3.89Å; I67-R125 HydrophobicContact CG2-CB 3.78Å; I67-V126 HydrophobicContact CB-CG2 4.41Å; I67-V126 HydrophobicContact CD1-CG2 3.55Å; I67-V126 HydrophobicContact CG1-CG2 3.59Å; I67-V126 HydrophobicContact CG2-CG2 4.11Å
68F93.9Very high90.9Very high0 Ų024.2 Ų24.20%013%0.133CC..Hα-helixtrans-54-42.1167.8169.3-103000112.2Y22 N25 L26 V65 S66 G71 G72 R125 I128 G129 A132 F291 W414Y22-F68 HydrophobicContact CD2-CE1 4.31Å; Y22-F68 AromaticContact CD2-CZ 3.99Å; Y22-F68 HydrophobicContact CD2-CZ 3.99Å; Y22-F68 HydrophobicContact CE2-CE1 4.11Å; Y22-F68 HydrophobicContact CE2-CZ 4.26Å; N25-F68 HydrophobicContact CB-CE2 3.93Å; N25-F68 HydrophobicContact CB-CZ 4.07Å; L26-F68 HydrophobicContact CD2-CE1 4.11Å; V65-F68 WeakPolarHBondContact O-CB 3.43Å; S66-F68 PolarHBondContact O-N 3.42Å; S66-F68 VanDerWaalsContact O-N 3.11Å; F68-G71 WeakPolarHBondContact O-CA 3.42Å; F68-G71 PolarHBondContact O-N 2.95Å; F68-G72 PolarHBondContact O-N 3.43Å; F68-R125 HydrophobicContact CB-CB 4.46Å; F68-I128 HydrophobicContact CD2-CG2 4.41Å; F68-I128 HydrophobicContact CE2-CG2 4.09Å; F68-G129 VanDerWaalsContact CD2-CA 3.48Å; F68-G129 WeakPolarHBondContact O-CA 3.47Å; F68-A132 HydrophobicContact CE2-CB 3.96Å; F68-A132 HydrophobicContact CZ-CB 3.81Å; F68-F291 HydrophobicContact CD1-CZ 4.02Å; F68-F291 HydrophobicContact CE1-CZ 4.38Å; F68-W414 HydrophobicContact CD1-CZ3 4.43Å; F68-W414 HydrophobicContact CE1-CH2 4.35Å; F68-W414 AromaticContact CE1-CZ3 3.93Å; F68-W414 HydrophobicContact CE1-CZ3 3.93Å; F68-W414 HydrophobicContact CZ-CH2 4.43Å; F68-W414 HydrophobicContact CZ-CZ3 4.41Å
69S93.4Very high90.1Very high0 Ų023.2 Ų23.20%013%0.127CC..Hα-helixtrans-68.4-35.6-179.2-49.50000112.1S66 I67 G72 F73 L417S66-S69 VanDerWaalsContact O-CB 3.27Å; S66-S69 WeakPolarHBondContact O-CB 3.27Å; S66-S69 PolarHBondContact O-N 3.33Å; S66-S69 PolarHBondContact O-OG 2.98Å; I67-S69 PolarHBondContact O-N 2.91Å; S69-G72 PolarHBondContact O-N 3.1Å; S69-F73 PolarHBondContact O-N 2.68Å; S69-L417 WeakPolarHBondContact OG-CD2 3.2Å; S69-L417 VanDerWaalsContact OG-CG 3.25Å; S69-L417 WeakPolarHBondContact OG-CG 3.26Å
70L93.8Very high89Confident66 Ų6621.5 Ų21.535%0.34613%0.125SC..Hα-helixtrans-67.8-38.3171.9-69.3177.8000111.8I67 G72 F73 A74 F418I67-L70 HydrophobicContact CG1-CD1 4.44Å; I67-L70 PolarHBondContact O-N 2.92Å; L70-G72 VanDerWaalsContact C-N 3.33Å; L70-F73 WeakPolarHBondContact O-CB 3.41Å; L70-F73 PolarHBondContact O-N 2.93Å; L70-A74 PolarHBondContact O-N 3.5Å; L70-F418 HydrophobicContact CD1-CD2 3.94Å; L70-F418 HydrophobicContact CD1-CE2 3.61Å; L70-F418 HydrophobicContact CD1-CZ 4.03Å; L70-F418 HydrophobicContact CD2-CB 4.5Å; L70-F418 HydrophobicContact CD2-CD1 4.35Å; L70-F418 HydrophobicContact CD2-CD2 4.12Å; L70-F418 HydrophobicContact CD2-CE2 4.47Å; L70-F418 HydrophobicContact CD2-CG 4.06Å; L70-F418 HydrophobicContact CG-CD2 3.61Å; L70-F418 HydrophobicContact CG-CE2 3.85Å; L70-F418 HydrophobicContact CG-CG 4.06Å; L70-F418 HydrophobicContact CG-CZ 4.48Å
71G93.1Very high87.8Confident1 Ų123.5 Ų23.51%0.0114%0.139CC..Hα-helixtrans-57.4-47.2168.900000111.4I67 F68 F73 A74 G75 G129 I130I67-G71 PolarHBondContact O-N 3.31Å; F68-G71 WeakPolarHBondContact O-CA 3.42Å; F68-G71 PolarHBondContact O-N 2.95Å; G71-F73 PolarHBondContact O-N 3.22Å; G71-A74 PolarHBondContact O-N 3.49Å; G71-G75 PolarHBondContact O-N 3.36Å; G71-G129 CarbonylContact C-O 3.59Å; G71-G129 CarbonylContact O-C 3.59Å; G71-I130 VanDerWaalsContact C-N 3.32Å; G71-I130 VanDerWaalsContact O-CA 3.23Å; G71-I130 WeakPolarHBondContact O-CA 3.34Å; G71-I130 WeakPolarHBondContact O-CG1 3.22Å; G71-I130 PolarHBondContact O-N 3.43Å
72G91.3Very high86.4Confident0 Ų024.8 Ų24.80%015%0.145CC..Hα-helixtrans-60.2-41.9176.100000113.6F68 S69 L70 G75 A76 G129 G133F68-G72 PolarHBondContact O-N 3.43Å; S69-G72 PolarHBondContact O-N 3.1Å; L70-G72 VanDerWaalsContact C-N 3.33Å; G72-G75 PolarHBondContact O-N 2.8Å; G72-A76 WeakPolarHBondContact O-CB 3.18Å; G72-A76 PolarHBondContact O-N 3.45Å; G72-G129 WeakPolarHBondContact CA-O 3.49Å; G72-G129 VanDerWaalsContact N-C 3.29Å; G72-G129 PolarHBondContact N-O 2.68Å; G72-G133 WeakPolarHBondContact O-CA 3.45Å
73F91.9Very high84.9Confident52 Ų5225.8 Ų25.823%0.22815%0.151CC..Hα-helixtrans-59.4-49.5172.8176.9-111.7000111.8S69 L70 G71 G75 A76 L77 W414 L415S69-F73 PolarHBondContact O-N 2.68Å; L70-F73 WeakPolarHBondContact O-CB 3.41Å; L70-F73 PolarHBondContact O-N 2.93Å; G71-F73 PolarHBondContact O-N 3.22Å; F73-G75 VanDerWaalsContact C-N 3.34Å; F73-G75 PolarHBondContact O-N 2.89Å; F73-A76 PolarHBondContact O-N 3.18Å; F73-L77 HydrophobicContact CD1-CD1 4.21Å; F73-L77 HydrophobicContact CE1-CD1 3.63Å; F73-L77 HydrophobicContact CE2-CD1 4.17Å; F73-L77 HydrophobicContact CE2-CG 4.33Å; F73-L77 HydrophobicContact CZ-CD1 3.61Å; F73-L77 HydrophobicContact CZ-CG 4.25Å; F73-L77 WeakPolarHBondContact O-CG 3.31Å; F73-L77 PolarHBondContact O-N 2.89Å; F73-W414 HydrophobicContact CB-CB 3.74Å; F73-W414 HydrophobicContact CB-CG 4.4Å; F73-W414 HydrophobicContact CD2-CB 4.42Å; F73-L415 HydrophobicContact CD1-CD2 4.44Å; F73-L415 HydrophobicContact CD2-CD1 4.44Å; F73-L415 HydrophobicContact CD2-CD2 4.32Å; F73-L415 HydrophobicContact CD2-CG 4Å; F73-L415 HydrophobicContact CE2-CD1 4Å; F73-L415 HydrophobicContact CE2-CD2 4.43Å; F73-L415 HydrophobicContact CE2-CG 4.06Å; F73-L415 HydrophobicContact CG-CD2 4.32Å; F73-L415 HydrophobicContact CG-CG 4.46Å; F73-L415 HydrophobicContact CZ-CD1 4.34Å
74A91.9Very high83.2Confident34 Ų3429.1 Ų29.128%0.28117%0.168SC..Hα-helixtrans-60.8-43.7176.300000111.5L70 G71 A76 L77 I78 I130L70-A74 PolarHBondContact O-N 3.5Å; G71-A74 PolarHBondContact O-N 3.49Å; A74-A76 PolarHBondContact O-N 3.08Å; A74-L77 PolarHBondContact O-N 3.11Å; A74-I78 WeakPolarHBondContact O-CB 3.47Å; A74-I78 WeakPolarHBondContact O-CD1 3.3Å; A74-I78 WeakPolarHBondContact O-CG1 3.19Å; A74-I78 PolarHBondContact O-N 3.02Å; A74-I130 HydrophobicContact CB-CG1 4.36Å
75G87.9Confident81.1Confident0 Ų039.7 Ų39.70%021%0.208CC..Hα-helixtrans-59.5-42.4175.400000112.9G71 G72 F73 L77 I78 A79 I134G71-G75 PolarHBondContact O-N 3.36Å; G72-G75 PolarHBondContact O-N 2.8Å; F73-G75 VanDerWaalsContact C-N 3.34Å; F73-G75 PolarHBondContact O-N 2.89Å; G75-L77 PolarHBondContact O-N 3.43Å; G75-I78 PolarHBondContact O-N 3.37Å; G75-A79 WeakPolarHBondContact O-CB 3.44Å; G75-A79 PolarHBondContact O-N 2.99Å; G75-I134 VanDerWaalsContact O-CG1 3.28Å; G75-I134 WeakPolarHBondContact O-CG1 3.41Å
76A83.9Confident79.1Confident13 Ų1345.8 Ų45.811%0.10724%0.235CC..Hα-helixtrans-63.4-40.7176.500000112.5G72 F73 A74 A79 N137G72-A76 WeakPolarHBondContact O-CB 3.18Å; G72-A76 PolarHBondContact O-N 3.45Å; F73-A76 PolarHBondContact O-N 3.18Å; A74-A76 PolarHBondContact O-N 3.08Å; A76-A79 PolarHBondContact O-N 3.22Å; A76-N137 WeakPolarHBondContact CA-ND2 3.22Å; A76-N137 VanDerWaalsContact CB-ND2 3.33Å; A76-N137 WeakPolarHBondContact CB-ND2 3.14Å
77L83.9Confident76.7Confident71 Ų7148.7 Ų48.737%0.37227%0.265SS..Hα-helixtrans-68-34.8175.6-68.5179.3000112.6F73 A74 G75 P81 M407F73-L77 HydrophobicContact CD1-CD1 4.21Å; F73-L77 HydrophobicContact CE1-CD1 3.63Å; F73-L77 HydrophobicContact CE2-CD1 4.17Å; F73-L77 HydrophobicContact CE2-CG 4.33Å; F73-L77 HydrophobicContact CZ-CD1 3.61Å; F73-L77 HydrophobicContact CZ-CG 4.25Å; F73-L77 WeakPolarHBondContact O-CG 3.31Å; F73-L77 PolarHBondContact O-N 2.89Å; A74-L77 PolarHBondContact O-N 3.11Å; G75-L77 PolarHBondContact O-N 3.43Å; L77-P81 WeakPolarHBondContact O-CD 3.29Å; L77-M407 HydrophobicContact CD2-CG 4.35Å; L77-M407 HydrophobicContact CD2-SD 4.39Å
78I81.6Confident74.2Confident66 Ų6651.6 Ų51.634%0.33829%0.288SS..Hα-helixtrans-74.5-33.6178.7-69.7166.2000111.3A74 G75 G80 P81 M82 I134A74-I78 WeakPolarHBondContact O-CB 3.47Å; A74-I78 WeakPolarHBondContact O-CD1 3.3Å; A74-I78 WeakPolarHBondContact O-CG1 3.19Å; A74-I78 PolarHBondContact O-N 3.02Å; G75-I78 PolarHBondContact O-N 3.37Å; I78-G80 VanDerWaalsContact C-N 3.31Å; I78-G80 PolarHBondContact O-N 3.41Å; I78-P81 WeakPolarHBondContact O-CD 3.45Å; I78-M82 HydrophobicContact CG2-CG 3.58Å; I78-M82 HydrophobicContact CG2-SD 3.3Å; I78-M82 WeakPolarHBondContact CG2-SD 3.38Å; I78-M82 VanDerWaalsContact O-CB 3.29Å; I78-M82 WeakPolarHBondContact O-CB 3.46Å; I78-M82 WeakPolarHBondContact O-CG 3.5Å; I78-M82 PolarHBondContact O-N 3.14Å; I78-I134 HydrophobicContact CG2-CD1 4.42Å
79A72.5Confident72Confident5 Ų553 Ų534%0.04130%0.295CS..Hα-helixtrans-57.5-39.7-176.900000113.3G75 A76 T83 I134 N137 V138G75-A79 WeakPolarHBondContact O-CB 3.44Å; G75-A79 PolarHBondContact O-N 2.99Å; A76-A79 PolarHBondContact O-N 3.22Å; A79-T83 WeakPolarHBondContact O-CB 3.47Å; A79-T83 WeakPolarHBondContact O-CG2 3.4Å; A79-T83 PolarHBondContact O-N 2.64Å; A79-T83 VanDerWaalsContact O-N 3.08Å; A79-T83 PolarHBondContact O-OG1 2.85Å; A79-I134 HydrophobicContact CB-CG1 4.39Å; A79-N137 HydrophobicContact CB-CB 4.26Å; A79-V138 HydrophobicContact CB-CG2 4.39Å
80G67.7Low70.6Confident28 Ų2855.5 Ų55.529%0.28931%0.307SS..Hα-helixtrans-62.7-61.6178.700000112.8I78 M82 T83 I84I78-G80 VanDerWaalsContact C-N 3.31Å; I78-G80 PolarHBondContact O-N 3.41Å; G80-M82 VanDerWaalsContact C-N 3.3Å; G80-M82 PolarHBondContact O-N 3.25Å; G80-T83 PolarHBondContact O-N 3.44Å; G80-T83 PolarHBondContact O-OG1 3.23Å; G80-I84 WeakPolarHBondContact O-CG1 3.29Å; G80-I84 PolarHBondContact O-N 3.5Å; G80-I84 VanDerWaalsContact O-N 3.16Å
81P66.6Low69.5Low67 Ų6753.4 Ų53.444%0.43529%0.294SS..Hα-helixtrans-59.7-35.3174.9-24.334.4000113.6L77 I78 T83 I84 R85L77-P81 WeakPolarHBondContact O-CD 3.29Å; I78-P81 WeakPolarHBondContact O-CD 3.45Å; P81-T83 VanDerWaalsContact C-N 3.27Å; P81-T83 PolarHBondContact O-N 3.49Å; P81-I84 PolarHBondContact O-N 3.17Å; P81-R85 WeakPolarHBondContact O-CA 3.08Å; P81-R85 WeakPolarHBondContact O-CB 3.45Å; P81-R85 PolarHBondContact O-N 2.87Å
82M63.2Low68.6Low28 Ų2854.7 Ų54.714%0.13830%0.3CS..Hα-helixtrans-62.8-36176.5-82.4-171.772.700112.4I78 G80 I134I78-M82 HydrophobicContact CG2-CG 3.58Å; I78-M82 HydrophobicContact CG2-SD 3.3Å; I78-M82 WeakPolarHBondContact CG2-SD 3.38Å; I78-M82 VanDerWaalsContact O-CB 3.29Å; I78-M82 WeakPolarHBondContact O-CB 3.46Å; I78-M82 WeakPolarHBondContact O-CG 3.5Å; I78-M82 PolarHBondContact O-N 3.14Å; G80-M82 VanDerWaalsContact C-N 3.3Å; G80-M82 PolarHBondContact O-N 3.25Å; M82-I134 HydrophobicContact SD-CD1 4.28Å
83T59.8Low67.9Low20 Ų2059 Ų5912%0.12332%0.318CS..Hα-helixtrans-82.2-19.7-17955.40000113.2A79 G80 P81 V138A79-T83 WeakPolarHBondContact O-CB 3.47Å; A79-T83 WeakPolarHBondContact O-CG2 3.4Å; A79-T83 PolarHBondContact O-N 2.64Å; A79-T83 VanDerWaalsContact O-N 3.08Å; A79-T83 PolarHBondContact O-OG1 2.85Å; G80-T83 PolarHBondContact O-N 3.44Å; G80-T83 PolarHBondContact O-OG1 3.23Å; P81-T83 VanDerWaalsContact C-N 3.27Å; P81-T83 PolarHBondContact O-N 3.49Å; T83-V138 HydrophobicContact CG2-CG2 4.13Å
84I58.3Low67.4Low130 Ų13056.5 Ų56.567%0.66731%0.308SS*.Hα-helixtrans-107.2-46.3-176.4-60.6168.6000112.8G80 P81 G87G80-I84 WeakPolarHBondContact O-CG1 3.29Å; G80-I84 PolarHBondContact O-N 3.5Å; G80-I84 VanDerWaalsContact O-N 3.16Å; P81-I84 PolarHBondContact O-N 3.17Å; I84-G87 PolarHBondContact O-N 2.88Å
85R49.4Very low66.8Low221 Ų22154.9 Ų54.983%0.83429%0.294SS*.THydrogen-bonded Turntrans-82.2-34.5-169.1-136.5-178.3-164.3176.73.3112.2P81 G87P81-R85 WeakPolarHBondContact O-CA 3.08Å; P81-R85 WeakPolarHBondContact O-CB 3.45Å; P81-R85 PolarHBondContact O-N 2.87Å; R85-G87 PolarHBondContact O-N 3.27Å; R85-G87 VanDerWaalsContact O-N 3.12Å
86F50Low66.5Low129 Ų12956.6 Ų56.657%0.56630%0.303SS*.SBendtrans-83.365.5161.1-65.4-80.1000108.6S88 L89F86-S88 PolarHBondContact O-N 2.61Å; F86-L89 HydrophobicContact CB-CB 3.74Å; F86-L89 WeakPolarHBondContact O-CB 3.09Å; F86-L89 PolarHBondContact O-N 3.12Å
87G41.3Very low66.6Low61 Ų6160 Ų6063%0.62932%0.319SS*.THydrogen-bonded Turntrans-59.716.6-17900000116.3I84 R85I84-G87 PolarHBondContact O-N 2.88Å; R85-G87 PolarHBondContact O-N 3.27Å; R85-G87 VanDerWaalsContact O-N 3.12Å
88S42.3Very low66.8Low91 Ų9156.7 Ų56.764%0.63630%0.302SS*.THydrogen-bonded Turntrans-124.1-2.2168.385.90000113.7F86 Q90F86-S88 PolarHBondContact O-N 2.61Å; S88-Q90 PolarHBondContact O-N 2.85Å
89L47.4Very low67Low30 Ų3053.6 Ų53.616%0.15729%0.286CS..  trans-94.591.7-177-145.691.7000110.2F86 K93 C94 L97F86-L89 HydrophobicContact CB-CB 3.74Å; F86-L89 WeakPolarHBondContact O-CB 3.09Å; F86-L89 PolarHBondContact O-N 3.12Å; L89-K93 HydrophobicContact CD1-CB 4.23Å; L89-K93 HydrophobicContact CD1-CD 4.29Å; L89-K93 HydrophobicContact CD2-CB 4.29Å; L89-K93 HydrophobicContact CG-CB 3.76Å; L89-K93 HydrophobicContact CG-CD 4.42Å; L89-C94 HydrophobicContact CD2-CB 4.31Å; L89-L97 HydrophobicContact CD1-CD1 4.1Å; L89-L97 HydrophobicContact CD2-CD1 3.55Å; L89-L97 HydrophobicContact CD2-CG 4.49Å; L89-L97 HydrophobicContact CG-CD1 4.42Å
90Q65.3Low67.9Low52 Ų5257.9 Ų57.924%0.24331%0.311CS..  trans-33138.4166-83.7-179.7-53.200113.7S88 K92 K93 C94 E208 Y212S88-Q90 PolarHBondContact O-N 2.85Å; Q90-K92 HydrophobicContact CB-CB 4.39Å; Q90-K92 CarbonylContact O-C 3.56Å; Q90-K92 PolarHBondContact O-N 3.5Å; Q90-K92 VanDerWaalsContact O-N 3.09Å; Q90-K93 HydrophobicContact CB-CB 3.99Å; Q90-K93 HydrophobicContact CB-CD 3.98Å; Q90-K93 HydrophobicContact CB-CG 3.83Å; Q90-K93 CarbonylContact O-C 3.48Å; Q90-K93 WeakPolarHBondContact O-CA 3.41Å; Q90-K93 WeakPolarHBondContact O-CB 3.31Å; Q90-K93 PolarHBondContact O-N 2.94Å; Q90-C94 PolarHBondContact O-N 3.14Å; Q90-E208 VanDerWaalsContact C-OE1 3.29Å; Q90-E208 WeakPolarHBondContact CA-OE1 3.4Å; Q90-E208 HydrophobicContact CB-CG 4.16Å; Q90-E208 WeakPolarHBondContact CB-OE1 3.26Å; Q90-E208 WeakPolarHBondContact CB-OE2 3.5Å; Q90-E208 HydrophobicContact CG-CG 3.6Å; Q90-E208 VanDerWaalsContact CG-OE2 3.23Å; Q90-E208 WeakPolarHBondContact CG-OE2 3.46Å; Q90-E208 PolarHBondContact NE2-OE2 3.08Å; Q90-Y212 HydrophobicContact CG-CE1 4.17Å
91R69.3Low69Low23 Ų2359.6 Ų59.69%0.08731%0.311CS..Hα-helixtrans-46.6-41172-67.2-76.7176-165.5-13.7110.8C94 L95 V138 M141 Y142 E208R91-C94 WeakPolarHBondContact O-CB 3.39Å; R91-C94 PolarHBondContact O-N 3.4Å; R91-L95 PolarHBondContact O-N 2.84Å; R91-V138 HydrophobicContact CB-CG1 4.47Å; R91-M141 PolarHBondContact NH1-SD 2.95Å; R91-M141 PolarHBondContact NH2-SD 2.68Å; R91-Y142 HydrophobicContact CB-CD2 4.19Å; R91-E208 PolarHBondContact N-OE1 3.42Å
92K74.2Confident70.2Confident28 Ų2856.4 Ų56.412%0.12229%0.29CS..Hα-helixtrans-59.8-49.4171.6175.1176.3170.2176.20113.8Q90 C94 L95 L96 L203 P204 F206 E208Q90-K92 HydrophobicContact CB-CB 4.39Å; Q90-K92 CarbonylContact O-C 3.56Å; Q90-K92 PolarHBondContact O-N 3.5Å; Q90-K92 VanDerWaalsContact O-N 3.09Å; K92-C94 VanDerWaalsContact C-N 3.28Å; K92-C94 PolarHBondContact O-N 2.9Å; K92-L95 PolarHBondContact O-N 3.3Å; K92-L96 HydrophobicContact CG-CD1 4.22Å; K92-L96 WeakPolarHBondContact O-CG 3.48Å; K92-L96 PolarHBondContact O-N 3.34Å; K92-L203 WeakPolarHBondContact CE-O 3.47Å; K92-L203 HydrophobicContact CG-CD2 4.22Å; K92-L203 HydrophobicContact CG-CG 4.09Å; K92-L203 PolarHBondContact NZ-O 3.49Å; K92-P204 VanDerWaalsContact NZ-C 3.27Å; K92-P204 PolarHBondContact NZ-O 3.32Å; K92-F206 PolarHBondContact NZ-O 3.17Å; K92-E208 WeakPolarHBondContact CB-OE2 2.97Å; K92-E208 PolarHBondContact N-OE1 3.31Å
93K77.8Confident71.6Confident89 Ų8958.1 Ų58.139%0.38730%0.298SS..Hα-helixtrans-64.4-34.3178.6-74.2178.4-176.5170.80111.6L89 Q90 L96 L97L89-K93 HydrophobicContact CD1-CB 4.23Å; L89-K93 HydrophobicContact CD1-CD 4.29Å; L89-K93 HydrophobicContact CD2-CB 4.29Å; L89-K93 HydrophobicContact CG-CB 3.76Å; L89-K93 HydrophobicContact CG-CD 4.42Å; Q90-K93 HydrophobicContact CB-CB 3.99Å; Q90-K93 HydrophobicContact CB-CD 3.98Å; Q90-K93 HydrophobicContact CB-CG 3.83Å; Q90-K93 CarbonylContact O-C 3.48Å; Q90-K93 WeakPolarHBondContact O-CA 3.41Å; Q90-K93 WeakPolarHBondContact O-CB 3.31Å; Q90-K93 PolarHBondContact O-N 2.94Å; K93-L96 PolarHBondContact O-N 3.28Å; K93-L97 WeakPolarHBondContact O-CB 3.48Å; K93-L97 WeakPolarHBondContact O-CG 3.07Å; K93-L97 PolarHBondContact O-N 2.91Å
94C80.3Confident73.2Confident1 Ų159.2 Ų59.21%0.00731%0.307CS..Hα-helixtrans-60.6-48.9172.7-175.60000110.8L89 Q90 R91 K92 L96 L97 N98L89-C94 HydrophobicContact CD2-CB 4.31Å; Q90-C94 PolarHBondContact O-N 3.14Å; R91-C94 WeakPolarHBondContact O-CB 3.39Å; R91-C94 PolarHBondContact O-N 3.4Å; K92-C94 VanDerWaalsContact C-N 3.28Å; K92-C94 PolarHBondContact O-N 2.9Å; C94-L96 VanDerWaalsContact C-N 3.32Å; C94-L96 PolarHBondContact O-N 3.05Å; C94-L97 PolarHBondContact O-N 2.94Å; C94-N98 WeakPolarHBondContact O-CB 3.47Å; C94-N98 PolarHBondContact O-N 2.67Å
95L80.2Confident74.9Confident0 Ų053 Ų530%028%0.275CS..Hα-helixtrans-61.2-37.4174.6-68172.9000112.7R91 K92 N98 N99 V138 L203R91-L95 PolarHBondContact O-N 2.84Å; K92-L95 PolarHBondContact O-N 3.3Å; L95-N98 WeakPolarHBondContact O-CB 3.49Å; L95-N98 PolarHBondContact O-N 3.29Å; L95-N99 PolarHBondContact O-ND2 3.16Å; L95-V138 HydrophobicContact CD1-CG1 4.39Å; L95-V138 HydrophobicContact CD2-CB 4.13Å; L95-V138 HydrophobicContact CD2-CG1 4Å; L95-V138 HydrophobicContact CG-CG1 3.9Å; L95-L203 HydrophobicContact CB-CD2 3.75Å; L95-L203 HydrophobicContact CD1-CD2 4.13Å
96L82.7Confident77Confident36 Ų3642.7 Ų42.719%0.18824%0.237CC..Hα-helixtrans-67.2-46176-69.3171.1000112.4K92 K93 C94 N98 N99 L200 L203 P204K92-L96 HydrophobicContact CG-CD1 4.22Å; K92-L96 WeakPolarHBondContact O-CG 3.48Å; K92-L96 PolarHBondContact O-N 3.34Å; K93-L96 PolarHBondContact O-N 3.28Å; C94-L96 VanDerWaalsContact C-N 3.32Å; C94-L96 PolarHBondContact O-N 3.05Å; L96-N98 PolarHBondContact O-N 2.62Å; L96-N99 WeakPolarHBondContact O-CB 3.34Å; L96-N99 PolarHBondContact O-N 2.73Å; L96-L200 HydrophobicContact CD2-CD2 3.91Å; L96-L203 HydrophobicContact CD2-CB 4.22Å; L96-L203 HydrophobicContact CD2-CD2 4.25Å; L96-L203 HydrophobicContact CG-CD2 4.22Å; L96-P204 HydrophobicContact CD1-CG 4.37Å; L96-P204 HydrophobicContact CD2-CG 4.26Å
97L84.6Confident79.1Confident85 Ų8541.7 Ų41.745%0.44524%0.237SC..Hα-helixtrans-64.4-31.7175.5-71.5-175.5000111.9L89 K93 C94 N99 V100L89-L97 HydrophobicContact CD1-CD1 4.1Å; L89-L97 HydrophobicContact CD2-CD1 3.55Å; L89-L97 HydrophobicContact CD2-CG 4.49Å; L89-L97 HydrophobicContact CG-CD1 4.42Å; K93-L97 WeakPolarHBondContact O-CB 3.48Å; K93-L97 WeakPolarHBondContact O-CG 3.07Å; K93-L97 PolarHBondContact O-N 2.91Å; C94-L97 PolarHBondContact O-N 2.94Å; L97-N99 PolarHBondContact O-N 3.01Å; L97-V100 VanDerWaalsContact O-CB 3.27Å; L97-V100 WeakPolarHBondContact O-CB 3.23Å; L97-V100 WeakPolarHBondContact O-CG2 3.26Å; L97-V100 PolarHBondContact O-N 3.41Å
98N87.5Confident81.5Confident1 Ų140.6 Ų40.61%0.00522%0.217CC..Hα-helixtrans-59.1-33.1178.1-159.629000112.7C94 L95 L96 V100 F101 L102 N131 I134 S135C94-N98 WeakPolarHBondContact O-CB 3.47Å; C94-N98 PolarHBondContact O-N 2.67Å; L95-N98 WeakPolarHBondContact O-CB 3.49Å; L95-N98 PolarHBondContact O-N 3.29Å; L96-N98 PolarHBondContact O-N 2.62Å; N98-V100 PolarHBondContact O-N 3.29Å; N98-V100 VanDerWaalsContact O-N 3.12Å; N98-F101 PolarHBondContact O-N 3.23Å; N98-F101 VanDerWaalsContact O-N 3.08Å; N98-L102 PolarHBondContact O-N 3.18Å; N98-N131 VanDerWaalsContact CG-OD1 3.22Å; N98-N131 PolarHBondContact ND2-O 3.1Å; N98-N131 PolarHBondContact ND2-OD1 2.78Å; N98-N131 VanDerWaalsContact OD1-CA 3.29Å; N98-N131 WeakPolarHBondContact OD1-CA 3.49Å; N98-I134 HydrophobicContact CB-CG2 4.27Å; N98-I134 WeakPolarHBondContact OD1-CD1 3.46Å; N98-S135 PolarHBondContact ND2-OG 2.87Å
99N87.1Confident83.9Confident1 Ų136.2 Ų36.21%0.00519%0.186CC..Hα-helixtrans-62.6-17.1175.4-75.4-69.2000113.4L95 L96 L97 F101 L102 M103 G196 Q199 L200L95-N99 PolarHBondContact O-ND2 3.16Å; L96-N99 WeakPolarHBondContact O-CB 3.34Å; L96-N99 PolarHBondContact O-N 2.73Å; L97-N99 PolarHBondContact O-N 3.01Å; N99-F101 VanDerWaalsContact C-N 3.35Å; N99-L102 WeakPolarHBondContact O-CB 3.48Å; N99-L102 PolarHBondContact O-N 3.43Å; N99-L102 WeakPolarHBondContact OD1-CD2 3.41Å; N99-M103 WeakPolarHBondContact O-CB 3.45Å; N99-M103 VanDerWaalsContact O-CG 3.24Å; N99-M103 WeakPolarHBondContact O-CG 3.49Å; N99-M103 PolarHBondContact O-N 3.47Å; N99-G196 WeakPolarHBondContact OD1-CA 3.37Å; N99-G196 PolarHBondContact OD1-O 3.37Å; N99-Q199 PolarHBondContact ND2-OE1 3.47Å; N99-Q199 PolarHBondContact OD1-OE1 3.35Å; N99-L200 HydrophobicContact CB-CD1 3.94Å; N99-L200 HydrophobicContact CB-CD2 3.94Å; N99-L200 HydrophobicContact CB-CG 3.86Å
100V90.2Very high86Confident94 Ų9437.9 Ų37.957%0.5720%0.195SC*.Hα-helixtrans-65.3-40.6173.1178.70000110.7L97 N98 L102 M103 S104L97-V100 VanDerWaalsContact O-CB 3.27Å; L97-V100 WeakPolarHBondContact O-CB 3.23Å; L97-V100 WeakPolarHBondContact O-CG2 3.26Å; L97-V100 PolarHBondContact O-N 3.41Å; N98-V100 PolarHBondContact O-N 3.29Å; N98-V100 VanDerWaalsContact O-N 3.12Å; V100-L102 VanDerWaalsContact C-N 3.33Å; V100-M103 PolarHBondContact O-N 2.96Å; V100-S104 WeakPolarHBondContact O-CB 3.45Å; V100-S104 PolarHBondContact O-N 3.44Å; V100-S104 PolarHBondContact O-OG 2.97Å
101F92Very high87.3Confident65 Ų6538 Ų3829%0.28520%0.199SC..Hα-helixtrans-66.2-39175.5-64.1-64.3000111.3N98 N99 S104 G105 L127 I130 N131 I134N98-F101 PolarHBondContact O-N 3.23Å; N98-F101 VanDerWaalsContact O-N 3.08Å; N99-F101 VanDerWaalsContact C-N 3.35Å; F101-S104 WeakPolarHBondContact CA-OG 3.33Å; F101-S104 PolarHBondContact O-OG 2.88Å; F101-G105 PolarHBondContact O-N 3.5Å; F101-L127 HydrophobicContact CD1-CD2 3.95Å; F101-I130 HydrophobicContact CD1-CG2 4.46Å; F101-I130 HydrophobicContact CD2-CG2 3.98Å; F101-I130 HydrophobicContact CE2-CG2 4.12Å; F101-I130 HydrophobicContact CG-CG2 4.16Å; F101-I130 HydrophobicContact CZ-CG2 4.42Å; F101-N131 HydrophobicContact CB-CB 4.28Å; F101-I134 HydrophobicContact CD2-CD1 4.5Å; F101-I134 HydrophobicContact CE2-CD1 4.32Å
102L91.4Very high88.3Confident0 Ų036.9 Ų36.90%020%0.195CC..Hα-helixtrans-61.7-51.8174.9177.565.5000112.6N98 N99 V100 S104 G105 A106 N131 N192 G196N98-L102 PolarHBondContact O-N 3.18Å; N99-L102 WeakPolarHBondContact O-CB 3.48Å; N99-L102 PolarHBondContact O-N 3.43Å; N99-L102 WeakPolarHBondContact OD1-CD2 3.41Å; V100-L102 VanDerWaalsContact C-N 3.33Å; L102-S104 PolarHBondContact O-N 2.91Å; L102-G105 PolarHBondContact O-N 2.82Å; L102-A106 WeakPolarHBondContact O-CB 3.35Å; L102-A106 PolarHBondContact O-N 2.88Å; L102-N131 HydrophobicContact CB-CB 4.49Å; L102-N192 HydrophobicContact CD1-CB 4.3Å; L102-N192 VanDerWaalsContact CD1-CG 3.47Å; L102-N192 WeakPolarHBondContact CD1-ND2 3.06Å; L102-G196 VanDerWaalsContact CD2-CA 3.48Å
103M92.6Very high88.8Confident63 Ų6340 Ų4031%0.3121%0.206SC..Hα-helixtrans-65.1-40.9-176.7-70.9-61-151.600111.6N99 V100 A106 L107 A193 F197 L200N99-M103 WeakPolarHBondContact O-CB 3.45Å; N99-M103 VanDerWaalsContact O-CG 3.24Å; N99-M103 WeakPolarHBondContact O-CG 3.49Å; N99-M103 PolarHBondContact O-N 3.47Å; V100-M103 PolarHBondContact O-N 2.96Å; M103-A106 PolarHBondContact O-N 2.93Å; M103-L107 WeakPolarHBondContact O-CB 3.17Å; M103-L107 PolarHBondContact O-N 3.35Å; M103-A193 HydrophobicContact SD-CB 3.85Å; M103-F197 HydrophobicContact CE-CB 4.01Å; M103-F197 HydrophobicContact CE-CD2 3.93Å; M103-F197 HydrophobicContact CE-CG 4.48Å; M103-L200 HydrophobicContact CE-CD1 3.94Å
104S93.9Very high89.3Confident43 Ų4340.4 Ų40.430%0.30123%0.226SC..Hα-helixtrans-65.5-41.9174.451.40000111.9V100 F101 L102 L107 L108V100-S104 WeakPolarHBondContact O-CB 3.45Å; V100-S104 PolarHBondContact O-N 3.44Å; V100-S104 PolarHBondContact O-OG 2.97Å; F101-S104 WeakPolarHBondContact CA-OG 3.33Å; F101-S104 PolarHBondContact O-OG 2.88Å; L102-S104 PolarHBondContact O-N 2.91Å; S104-L107 PolarHBondContact O-N 3.34Å; S104-L108 WeakPolarHBondContact O-CG 3.12Å; S104-L108 PolarHBondContact O-N 3.1Å
105G93.1Very high89.7Confident0 Ų043.2 Ų43.20%025%0.25CC..Hα-helixtrans-60.4-4517300000113.1F101 L102 L107 L108 A109 S124F101-G105 PolarHBondContact O-N 3.5Å; L102-G105 PolarHBondContact O-N 2.82Å; G105-L107 PolarHBondContact O-N 3.24Å; G105-L108 PolarHBondContact O-N 2.84Å; G105-A109 PolarHBondContact O-N 3.37Å; G105-S124 WeakPolarHBondContact O-CB 3.3Å; G105-S124 PolarHBondContact O-OG 3.43Å
106A92.9Very high90Very high5 Ų544.1 Ų44.14%0.04126%0.259CS..Hα-helixtrans-63.6-39.7177.700000112.4L102 M103 A109 L110 A193L102-A106 WeakPolarHBondContact O-CB 3.35Å; L102-A106 PolarHBondContact O-N 2.88Å; M103-A106 PolarHBondContact O-N 2.93Å; A106-A109 PolarHBondContact O-N 2.79Å; A106-L110 WeakPolarHBondContact O-CB 3.43Å; A106-L110 PolarHBondContact O-N 2.83Å; A106-A193 HydrophobicContact CB-CB 3.87Å
107L94.2Very high90.4Very high107 Ų10743.1 Ų43.156%0.5626%0.255SS*.Hα-helixtrans-64.3-41.4176.1-17963.4000112.1M103 S104 G105 L110 T111M103-L107 WeakPolarHBondContact O-CB 3.17Å; M103-L107 PolarHBondContact O-N 3.35Å; S104-L107 PolarHBondContact O-N 3.34Å; G105-L107 PolarHBondContact O-N 3.24Å; L107-L110 PolarHBondContact O-N 3.44Å; L107-T111 HydrophobicContact CD1-CG2 4.32Å; L107-T111 WeakPolarHBondContact O-CG2 3.25Å; L107-T111 PolarHBondContact O-N 2.88Å; L107-T111 PolarHBondContact O-OG1 3.49Å
108L93.4Very high90.6Very high38 Ų3839.8 Ų39.820%0.19924%0.237CC..Hα-helixtrans-64.9-40.7175.9-72.5173.4000112S104 G105 L110 T111 S112 M120 L123 L127S104-L108 WeakPolarHBondContact O-CG 3.12Å; S104-L108 PolarHBondContact O-N 3.1Å; G105-L108 PolarHBondContact O-N 2.84Å; L108-L110 VanDerWaalsContact C-N 3.35Å; L108-T111 PolarHBondContact O-N 3.25Å; L108-T111 PolarHBondContact O-OG1 3.43Å; L108-S112 WeakPolarHBondContact O-CB 3.33Å; L108-S112 PolarHBondContact O-N 2.94Å; L108-M120 HydrophobicContact CD2-CE 3.8Å; L108-L123 HydrophobicContact CD1-CB 4.16Å; L108-L123 HydrophobicContact CD1-CD2 3.72Å; L108-L123 HydrophobicContact CD1-CG 3.73Å; L108-L127 HydrophobicContact CD1-CD1 3.64Å
109A91.1Very high90.8Very high0 Ų043 Ų430%025%0.252CS..Hα-helixtrans-62.6-43.3175.500000111.4G105 A106 T111 S112 L189G105-A109 PolarHBondContact O-N 3.37Å; A106-A109 PolarHBondContact O-N 2.79Å; A109-T111 VanDerWaalsContact C-N 3.34Å; A109-T111 PolarHBondContact O-N 2.8Å; A109-S112 WeakPolarHBondContact O-CB 3.49Å; A109-S112 PolarHBondContact O-N 3.33Å; A109-S112 PolarHBondContact O-OG 2.98Å; A109-L189 HydrophobicContact CB-CB 3.71Å; A109-L189 HydrophobicContact CB-CD1 4.4Å
110L92.1Very high91.1Very high65 Ų6545 Ų4534%0.3426%0.261SS..Hα-helixtrans-63.6-38.1179.2-17662.6000113A106 L107 L108 Y187 A190A106-L110 WeakPolarHBondContact O-CB 3.43Å; A106-L110 PolarHBondContact O-N 2.83Å; L107-L110 PolarHBondContact O-N 3.44Å; L108-L110 VanDerWaalsContact C-N 3.35Å; L110-Y187 HydrophobicContact CD1-CD1 3.48Å; L110-Y187 VanDerWaalsContact CD1-CD1 3.48Å; L110-Y187 HydrophobicContact CD1-CE1 3.47Å; L110-Y187 VanDerWaalsContact CD1-CE1 3.47Å; L110-Y187 HydrophobicContact CD1-CG 4.44Å; L110-A190 HydrophobicContact CB-CB 4.06Å; L110-A190 HydrophobicContact CD1-CB 4.4Å
111T92Very high91.3Very high53 Ų5340.5 Ų40.533%0.32523%0.234SC..Hα-helixtrans-88.3-10.4-176.850.30000113.7L107 L108 A109 R113 A114 A115 M120L107-T111 HydrophobicContact CD1-CG2 4.32Å; L107-T111 WeakPolarHBondContact O-CG2 3.25Å; L107-T111 PolarHBondContact O-N 2.88Å; L107-T111 PolarHBondContact O-OG1 3.49Å; L108-T111 PolarHBondContact O-N 3.25Å; L108-T111 PolarHBondContact O-OG1 3.43Å; A109-T111 VanDerWaalsContact C-N 3.34Å; A109-T111 PolarHBondContact O-N 2.8Å; T111-R113 PolarHBondContact O-N 2.88Å; T111-A114 PolarHBondContact O-N 3.48Å; T111-A115 WeakPolarHBondContact O-CB 3.34Å; T111-A115 PolarHBondContact O-N 3.21Å; T111-M120 WeakPolarHBondContact OG1-CE 3.43Å
112S90.6Very high91.4Very high0 Ų039.6 Ų39.60%023%0.231CC..THydrogen-bonded Turntrans-56.5-44.1-175.863.70000114.5L108 A109 A115 G116 S117L108-S112 WeakPolarHBondContact O-CB 3.33Å; L108-S112 PolarHBondContact O-N 2.94Å; A109-S112 WeakPolarHBondContact O-CB 3.49Å; A109-S112 PolarHBondContact O-N 3.33Å; A109-S112 PolarHBondContact O-OG 2.98Å; S112-A115 PolarHBondContact O-N 2.9Å; S112-G116 PolarHBondContact O-N 2.9Å; S112-G116 VanDerWaalsContact O-N 3.11Å; S112-S117 PolarHBondContact O-N 3.34Å; S112-S117 VanDerWaalsContact O-N 3.12Å
113R86.1Confident91.6Very high93 Ų9344 Ų4435%0.35125%0.254SS..THydrogen-bonded Turntrans-69.2-42.2179.3-168.2179-173.6157.37112F39 T111 A115 G116 E182 W185F39-R113 HydrophobicContact CE2-CG 4.39Å; T111-R113 PolarHBondContact O-N 2.88Å; R113-A115 PolarHBondContact O-N 3.09Å; R113-G116 PolarHBondContact O-N 3.39Å; R113-G116 VanDerWaalsContact O-N 3.14Å; R113-E182 PolarHBondContact NH1-O 2.94Å; R113-W185 HydrophobicContact CB-CZ2 4.21Å; R113-W185 HydrophobicContact CG-CZ2 4.43Å
114A87.8Confident91.7Very high99 Ų9941 Ų4182%0.81824%0.24SC*.THydrogen-bonded Turntrans-64.9-31.7178.600000112.1T111T111-A114 PolarHBondContact O-N 3.48Å
115A87.7Confident91.7Very high60 Ų6039.1 Ų39.150%0.49623%0.226SC..THydrogen-bonded Turntrans-85.5-7.3176.100000114T111 S112 R113 S117 M120T111-A115 WeakPolarHBondContact O-CB 3.34Å; T111-A115 PolarHBondContact O-N 3.21Å; S112-A115 PolarHBondContact O-N 2.9Å; R113-A115 PolarHBondContact O-N 3.09Å; A115-S117 VanDerWaalsContact C-N 3.32Å; A115-S117 PolarHBondContact O-N 2.95Å; A115-M120 HydrophobicContact CB-CE 4.42Å; A115-M120 HydrophobicContact CB-SD 3.43Å; A115-M120 WeakPolarHBondContact CB-SD 3.46Å
116G86.7Confident91.8Very high19 Ų1940.9 Ų40.920%0.19624%0.237CC..THydrogen-bonded Turntrans55.344.3-174.800000112.6T43 R47 S112 R113T43-G116 WeakPolarHBondContact CG2-O 3.48Å; R47-G116 PolarHBondContact NH2-O 3.15Å; S112-G116 PolarHBondContact O-N 2.9Å; S112-G116 VanDerWaalsContact O-N 3.11Å; R113-G116 PolarHBondContact O-N 3.39Å; R113-G116 VanDerWaalsContact O-N 3.14Å
117S90.7Very high91.9Very high15 Ų1542 Ų4211%0.10524%0.242CC..  trans-135.8114.6-174.4174.70000112.9R47 S112 A115 E119 M120R47-S117 VanDerWaalsContact NH2-CA 3.33Å; S112-S117 PolarHBondContact O-N 3.34Å; S112-S117 VanDerWaalsContact O-N 3.12Å; A115-S117 VanDerWaalsContact C-N 3.32Å; A115-S117 PolarHBondContact O-N 2.95Å; S117-E119 VanDerWaalsContact C-N 3.3Å; S117-E119 WeakPolarHBondContact CA-OE2 3.44Å; S117-E119 WeakPolarHBondContact CB-OE2 3.4Å; S117-E119 PolarHBondContact OG-N 3.23Å; S117-E119 PolarHBondContact OG-OE2 3.4Å; S117-M120 PolarHBondContact OG-N 2.95Å
118F89.3Confident91.9Very high15 Ų1537.1 Ų37.17%0.06622%0.217CC..Hα-helixtrans-75.4-20.617066.5-94.3000112F39 I40 T43 F44 V60 M120 I121 M122F39-F118 HydrophobicContact CE1-CB 4.28Å; I40-F118 HydrophobicContact CG1-CB 4.05Å; I40-F118 HydrophobicContact CG1-CG 4.38Å; T43-F118 HydrophobicContact CG2-CD1 4.02Å; T43-F118 HydrophobicContact CG2-CE1 4.38Å; F44-F118 HydrophobicContact CD2-CD1 4.46Å; F44-F118 AromaticContact CD2-CE1 3.73Å; F44-F118 HydrophobicContact CD2-CE1 3.73Å; F44-F118 HydrophobicContact CD2-CZ 4.24Å; F44-F118 HydrophobicContact CE2-CD1 4.26Å; F44-F118 AromaticContact CE2-CE1 3.3Å; F44-F118 HydrophobicContact CE2-CE1 3.3Å; F44-F118 HydrophobicContact CE2-CE2 4.3Å; F44-F118 AromaticContact CE2-CZ 3.34Å; F44-F118 HydrophobicContact CE2-CZ 3.34Å; F44-F118 HydrophobicContact CZ-CE1 4.15Å; F44-F118 AromaticContact CZ-CZ 3.86Å; F44-F118 HydrophobicContact CZ-CZ 3.86Å; V60-F118 HydrophobicContact CG1-CD2 4.19Å; V60-F118 HydrophobicContact CG1-CE2 4.19Å; F118-M120 VanDerWaalsContact C-N 3.25Å; F118-M120 PolarHBondContact O-N 3.34Å; F118-I121 WeakPolarHBondContact O-CA 3.44Å; F118-I121 VanDerWaalsContact O-CB 3.3Å; F118-I121 WeakPolarHBondContact O-CB 3.34Å; F118-I121 PolarHBondContact O-N 3.46Å; F118-M122 HydrophobicContact CD2-SD 4.45Å; F118-M122 PolarHBondContact O-N 2.96Å; F118-M122 VanDerWaalsContact O-N 3.1Å
119E92.9Very high91.9Very high69 Ų6935.3 Ų35.332%0.32221%0.207SC..Hα-helixtrans-63.9-32.8175.4-55.689.6160.200111.8R47 S117 I121 M122 L123R47-E119 IonicContact CZ-OE1 3.1Å; R47-E119 IonicContact CZ-OE2 3.8Å; R47-E119 IonicContact NH1-OE1 3.13Å; R47-E119 PolarHBondContact NH1-OE1 3.01Å; R47-E119 IonicContact NH1-OE2 3.17Å; R47-E119 PolarHBondContact NH1-OE2 3.26Å; R47-E119 IonicContact NH2-OE1 3.28Å; R47-E119 IonicContact NH2-OE2 2.89Å; R47-E119 PolarHBondContact NH2-OE2 3.42Å; R47-E119 VanDerWaalsContact NH2-OE2 3.17Å; S117-E119 VanDerWaalsContact C-N 3.3Å; S117-E119 WeakPolarHBondContact CA-OE2 3.44Å; S117-E119 WeakPolarHBondContact CB-OE2 3.4Å; S117-E119 PolarHBondContact OG-N 3.23Å; S117-E119 PolarHBondContact OG-OE2 3.4Å; E119-I121 VanDerWaalsContact C-N 3.28Å; E119-I121 PolarHBondContact O-N 2.64Å; E119-M122 WeakPolarHBondContact O-CB 3.38Å; E119-M122 PolarHBondContact O-N 3.49Å; E119-L123 PolarHBondContact O-N 2.93Å
120M93.6Very high91.9Very high41 Ų4136.3 Ų36.320%0.20221%0.212CC..Hα-helixtrans-63.5-34.1171.7-69.2179.468.200112.3L108 T111 A115 S117 F118 L123 S124L108-M120 HydrophobicContact CD2-CE 3.8Å; T111-M120 WeakPolarHBondContact OG1-CE 3.43Å; A115-M120 HydrophobicContact CB-CE 4.42Å; A115-M120 HydrophobicContact CB-SD 3.43Å; A115-M120 WeakPolarHBondContact CB-SD 3.46Å; S117-M120 PolarHBondContact OG-N 2.95Å; F118-M120 VanDerWaalsContact C-N 3.25Å; F118-M120 PolarHBondContact O-N 3.34Å; M120-L123 PolarHBondContact O-N 3.38Å; M120-S124 VanDerWaalsContact O-CB 3.3Å; M120-S124 WeakPolarHBondContact O-CB 3.34Å; M120-S124 PolarHBondContact O-N 3.18Å
121I93.1Very high91.9Very high1 Ų133.2 Ų33.21%0.00520%0.196CC..Hα-helixtrans-67.4-43.4173.8-52.7175000109.5I36 F39 I64 F118 E119 L123 S124 R125 W185 L189I36-I121 HydrophobicContact CG2-CD1 4.34Å; F39-I121 HydrophobicContact CD1-CD1 4.17Å; F39-I121 HydrophobicContact CE1-CD1 4.03Å; I64-I121 HydrophobicContact CG2-CG2 3.82Å; F118-I121 WeakPolarHBondContact O-CA 3.44Å; F118-I121 VanDerWaalsContact O-CB 3.3Å; F118-I121 WeakPolarHBondContact O-CB 3.34Å; F118-I121 PolarHBondContact O-N 3.46Å; E119-I121 VanDerWaalsContact C-N 3.28Å; E119-I121 PolarHBondContact O-N 2.64Å; I121-L123 PolarHBondContact O-N 3.15Å; I121-S124 WeakPolarHBondContact O-CB 3.45Å; I121-S124 PolarHBondContact O-N 3.47Å; I121-R125 HydrophobicContact CG2-CG 4.48Å; I121-R125 VanDerWaalsContact O-CG 3.31Å; I121-R125 WeakPolarHBondContact O-CG 3.43Å; I121-R125 PolarHBondContact O-N 3.42Å; I121-W185 HydrophobicContact CD1-CH2 3.7Å; I121-W185 HydrophobicContact CD1-CZ3 3.79Å; I121-L189 HydrophobicContact CG2-CD1 4.4Å
122M94.3Very high91.8Very high45 Ų4530.8 Ų30.822%0.22218%0.181CC..Hα-helixtrans-57.7-47.9175-67-178.364.600111.7I63 I64 I67 F118 E119 S124 R125 V126I63-M122 HydrophobicContact CG2-CE 3.57Å; I64-M122 HydrophobicContact CD1-CG 4.48Å; I64-M122 HydrophobicContact CG1-CG 3.51Å; I64-M122 HydrophobicContact CG1-SD 4.35Å; I67-M122 HydrophobicContact CD1-CE 3.89Å; F118-M122 HydrophobicContact CD2-SD 4.45Å; F118-M122 PolarHBondContact O-N 2.96Å; F118-M122 VanDerWaalsContact O-N 3.1Å; E119-M122 WeakPolarHBondContact O-CB 3.38Å; E119-M122 PolarHBondContact O-N 3.49Å; M122-S124 PolarHBondContact O-N 3.01Å; M122-R125 PolarHBondContact O-N 3.38Å; M122-V126 WeakPolarHBondContact O-CG2 3.41Å; M122-V126 PolarHBondContact O-N 3.06Å
123L95.1Very high91.7Very high92 Ų9230.8 Ų30.848%0.48218%0.181SC..Hα-helixtrans-64.8-40.3178.7-174.560.8000111.8L108 E119 M120 I121 R125 V126 L127L108-L123 HydrophobicContact CD1-CB 4.16Å; L108-L123 HydrophobicContact CD1-CD2 3.72Å; L108-L123 HydrophobicContact CD1-CG 3.73Å; E119-L123 PolarHBondContact O-N 2.93Å; M120-L123 PolarHBondContact O-N 3.38Å; I121-L123 PolarHBondContact O-N 3.15Å; L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 2.83Å; L123-V126 PolarHBondContact O-N 3.24Å; L123-L127 HydrophobicContact CG-CD1 4.32Å; L123-L127 WeakPolarHBondContact O-CG 3.37Å; L123-L127 PolarHBondContact O-N 2.95Å
124S94.7Very high91.8Very high2 Ų226.4 Ų26.41%0.01417%0.165CC..Hα-helixtrans-55.7-47.7172.6175.40000111.6G105 M120 I121 M122 V126 L127 I128G105-S124 WeakPolarHBondContact O-CB 3.3Å; G105-S124 PolarHBondContact O-OG 3.43Å; M120-S124 VanDerWaalsContact O-CB 3.3Å; M120-S124 WeakPolarHBondContact O-CB 3.34Å; M120-S124 PolarHBondContact O-N 3.18Å; I121-S124 WeakPolarHBondContact O-CB 3.45Å; I121-S124 PolarHBondContact O-N 3.47Å; M122-S124 PolarHBondContact O-N 3.01Å; S124-V126 VanDerWaalsContact C-N 3.35Å; S124-V126 PolarHBondContact O-N 3.42Å; S124-L127 PolarHBondContact O-N 2.55Å; S124-I128 WeakPolarHBondContact O-CB 3.29Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.14Å; S124-I128 PolarHBondContact O-N 2.96Å
125R94.3Very high91.7Very high3 Ų321.7 Ų21.71%0.01113%0.126CC..Hα-helixtrans-63.7-37.5179.1-67.8-62-65.7174.5-2.4112.6N25 I64 I67 F68 I121 M122 L123 G129N25-R125 PolarHBondContact O-NH1 3.08Å; N25-R125 PolarHBondContact O-NH2 3.11Å; I64-R125 HydrophobicContact CG2-CG 4.29Å; I67-R125 HydrophobicContact CG2-CB 3.78Å; F68-R125 HydrophobicContact CB-CB 4.46Å; I121-R125 HydrophobicContact CG2-CG 4.48Å; I121-R125 VanDerWaalsContact O-CG 3.31Å; I121-R125 WeakPolarHBondContact O-CG 3.43Å; I121-R125 PolarHBondContact O-N 3.42Å; M122-R125 PolarHBondContact O-N 3.38Å; L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 2.83Å; R125-G129 PolarHBondContact O-N 3.42Å
126V95.4Very high91.4Very high37 Ų3720.7 Ų20.722%0.22411%0.111CC..Hα-helixtrans-61.5-49.4173.5172.60000111.1I67 M122 L123 S124 G129 I130I67-V126 HydrophobicContact CB-CG2 4.41Å; I67-V126 HydrophobicContact CD1-CG2 3.55Å; I67-V126 HydrophobicContact CG1-CG2 3.59Å; I67-V126 HydrophobicContact CG2-CG2 4.11Å; M122-V126 WeakPolarHBondContact O-CG2 3.41Å; M122-V126 PolarHBondContact O-N 3.06Å; L123-V126 PolarHBondContact O-N 3.24Å; S124-V126 VanDerWaalsContact C-N 3.35Å; S124-V126 PolarHBondContact O-N 3.42Å; V126-G129 WeakPolarHBondContact O-CA 3.35Å; V126-G129 PolarHBondContact O-N 3.4Å; V126-I130 HydrophobicContact CG1-CD1 4.11Å; V126-I130 WeakPolarHBondContact O-CG1 3.16Å; V126-I130 PolarHBondContact O-N 3.5Å
127L94.9Very high90.9Very high29 Ų2922 Ų2215%0.15211%0.114CC..Hα-helixtrans-65.6-43.2-177.5-65.9168.9000112F101 L108 L123 S124 G129 I130 N131F101-L127 HydrophobicContact CD1-CD2 3.95Å; L108-L127 HydrophobicContact CD1-CD1 3.64Å; L123-L127 HydrophobicContact CG-CD1 4.32Å; L123-L127 WeakPolarHBondContact O-CG 3.37Å; L123-L127 PolarHBondContact O-N 2.95Å; S124-L127 PolarHBondContact O-N 2.55Å; L127-G129 VanDerWaalsContact C-N 3.28Å; L127-G129 PolarHBondContact O-N 3.28Å; L127-I130 PolarHBondContact O-N 3.38Å; L127-N131 PolarHBondContact O-N 2.85Å
128I93.6Very high90.3Very high4 Ų421.3 Ų21.32%0.02111%0.109CC..Hα-helixtrans-65.1-36.1174.7-66.2172.3000110.6N25 F68 S124 N131 A132N25-I128 HydrophobicContact CB-CG2 4.19Å; N25-I128 VanDerWaalsContact OD1-CG2 3.25Å; N25-I128 WeakPolarHBondContact OD1-CG2 3.35Å; F68-I128 HydrophobicContact CD2-CG2 4.41Å; F68-I128 HydrophobicContact CE2-CG2 4.09Å; S124-I128 WeakPolarHBondContact O-CB 3.29Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.14Å; S124-I128 PolarHBondContact O-N 2.96Å; I128-N131 WeakPolarHBondContact O-CB 3.44Å; I128-N131 PolarHBondContact O-N 3.45Å; I128-A132 PolarHBondContact O-N 3.45Å
129G93.3Very high89.9Confident0 Ų020.6 Ų20.60%011%0.106CC..Hα-helixtrans-59.5-49.5171.900000112.2F68 G71 G72 R125 V126 L127 N131 A132 G133F68-G129 VanDerWaalsContact CD2-CA 3.48Å; F68-G129 WeakPolarHBondContact O-CA 3.47Å; G71-G129 CarbonylContact C-O 3.59Å; G71-G129 CarbonylContact O-C 3.59Å; G72-G129 WeakPolarHBondContact CA-O 3.49Å; G72-G129 VanDerWaalsContact N-C 3.29Å; G72-G129 PolarHBondContact N-O 2.68Å; R125-G129 PolarHBondContact O-N 3.42Å; V126-G129 WeakPolarHBondContact O-CA 3.35Å; V126-G129 PolarHBondContact O-N 3.4Å; L127-G129 VanDerWaalsContact C-N 3.28Å; L127-G129 PolarHBondContact O-N 3.28Å; G129-N131 PolarHBondContact O-N 2.98Å; G129-A132 PolarHBondContact O-N 3.06Å; G129-A132 VanDerWaalsContact O-N 3.11Å; G129-G133 PolarHBondContact O-N 3.07Å
130I92.5Very high89.1Confident20 Ų2019.1 Ų19.110%0.10310%0.102CC..Hα-helixtrans-55.4-44.4175.9-68.5166.7000110.3G71 A74 F101 V126 L127 G133 I134G71-I130 VanDerWaalsContact C-N 3.32Å; G71-I130 VanDerWaalsContact O-CA 3.23Å; G71-I130 WeakPolarHBondContact O-CA 3.34Å; G71-I130 WeakPolarHBondContact O-CG1 3.22Å; G71-I130 PolarHBondContact O-N 3.43Å; A74-I130 HydrophobicContact CB-CG1 4.36Å; F101-I130 HydrophobicContact CD1-CG2 4.46Å; F101-I130 HydrophobicContact CD2-CG2 3.98Å; F101-I130 HydrophobicContact CE2-CG2 4.12Å; F101-I130 HydrophobicContact CG-CG2 4.16Å; F101-I130 HydrophobicContact CZ-CG2 4.42Å; V126-I130 HydrophobicContact CG1-CD1 4.11Å; V126-I130 WeakPolarHBondContact O-CG1 3.16Å; V126-I130 PolarHBondContact O-N 3.5Å; L127-I130 PolarHBondContact O-N 3.38Å; I130-G133 PolarHBondContact O-N 3.37Å; I130-I134 HydrophobicContact CG2-CD1 3.82Å; I130-I134 WeakPolarHBondContact O-CG1 3.29Å; I130-I134 PolarHBondContact O-N 3.13Å
131N91.9Very high88.2Confident1 Ų121 Ų211%0.00511%0.111CC..Hα-helixtrans-58.1-51.6175.1168.637.6000112.4Q21 N98 F101 L102 L127 I128 G129 G133 I134 S135Q21-N131 PolarHBondContact OE1-ND2 3.23Å; N98-N131 VanDerWaalsContact CG-OD1 3.22Å; N98-N131 PolarHBondContact ND2-O 3.1Å; N98-N131 PolarHBondContact ND2-OD1 2.78Å; N98-N131 VanDerWaalsContact OD1-CA 3.29Å; N98-N131 WeakPolarHBondContact OD1-CA 3.49Å; F101-N131 HydrophobicContact CB-CB 4.28Å; L102-N131 HydrophobicContact CB-CB 4.49Å; L127-N131 PolarHBondContact O-N 2.85Å; I128-N131 WeakPolarHBondContact O-CB 3.44Å; I128-N131 PolarHBondContact O-N 3.45Å; G129-N131 PolarHBondContact O-N 2.98Å; N131-G133 VanDerWaalsContact C-N 3.33Å; N131-G133 PolarHBondContact O-N 3.42Å; N131-I134 PolarHBondContact O-N 2.86Å; N131-S135 WeakPolarHBondContact O-CB 3.28Å; N131-S135 PolarHBondContact O-N 3.47Å; N131-S135 PolarHBondContact O-OG 3.37Å; N131-S135 PolarHBondContact OD1-OG 3.44Å
132A90.3Very high87.5Confident1 Ų121 Ų211%0.00811%0.111CC..Hα-helixtrans-59.5-43.1178.400000112.3Y22 F68 I128 G129 I134 S135 M136 W414Y22-A132 HydrophobicContact CD2-CB 4.01Å; F68-A132 HydrophobicContact CE2-CB 3.96Å; F68-A132 HydrophobicContact CZ-CB 3.81Å; I128-A132 PolarHBondContact O-N 3.45Å; G129-A132 PolarHBondContact O-N 3.06Å; G129-A132 VanDerWaalsContact O-N 3.11Å; A132-I134 PolarHBondContact O-N 3.15Å; A132-S135 PolarHBondContact O-N 3.28Å; A132-M136 WeakPolarHBondContact O-CB 3.29Å; A132-M136 WeakPolarHBondContact O-CG 3.14Å; A132-M136 PolarHBondContact O-N 2.96Å; A132-W414 HydrophobicContact CB-CH2 4.07Å
133G88.5Confident86.8Confident0 Ų018.9 Ų18.90%010%0.101CC..Hα-helixtrans-60.8-43.5177.900000113.6G72 G129 I130 N131 N137G72-G133 WeakPolarHBondContact O-CA 3.45Å; G129-G133 PolarHBondContact O-N 3.07Å; I130-G133 PolarHBondContact O-N 3.37Å; N131-G133 VanDerWaalsContact C-N 3.33Å; N131-G133 PolarHBondContact O-N 3.42Å; G133-N137 PolarHBondContact O-ND2 3.24Å
134I86.5Confident85.7Confident1 Ų115.1 Ų15.11%0.0059%0.085CC..Hα-helixtrans-67.2-48.1175.9-67.8168.2000110G75 I78 A79 M82 N98 F101 I130 N131 A132 M136 N137 V138G75-I134 VanDerWaalsContact O-CG1 3.28Å; G75-I134 WeakPolarHBondContact O-CG1 3.41Å; I78-I134 HydrophobicContact CG2-CD1 4.42Å; A79-I134 HydrophobicContact CB-CG1 4.39Å; M82-I134 HydrophobicContact SD-CD1 4.28Å; N98-I134 HydrophobicContact CB-CG2 4.27Å; N98-I134 WeakPolarHBondContact OD1-CD1 3.46Å; F101-I134 HydrophobicContact CD2-CD1 4.5Å; F101-I134 HydrophobicContact CE2-CD1 4.32Å; I130-I134 HydrophobicContact CG2-CD1 3.82Å; I130-I134 WeakPolarHBondContact O-CG1 3.29Å; I130-I134 PolarHBondContact O-N 3.13Å; N131-I134 PolarHBondContact O-N 2.86Å; A132-I134 PolarHBondContact O-N 3.15Å; I134-M136 PolarHBondContact O-N 2.98Å; I134-N137 PolarHBondContact O-N 3.37Å; I134-V138 HydrophobicContact CG2-CG2 4.04Å; I134-V138 WeakPolarHBondContact O-CB 3.3Å; I134-V138 VanDerWaalsContact O-CG2 3.31Å; I134-V138 WeakPolarHBondContact O-CG2 3.18Å; I134-V138 PolarHBondContact O-N 3.38Å
135S86.4Confident84.9Confident0 Ų016.3 Ų16.30%09%0.09CC..Hα-helixtrans-60.7-44.2-177.7-77.20000113N98 N131 A132 N137 V138 Q139N98-S135 PolarHBondContact ND2-OG 2.87Å; N131-S135 WeakPolarHBondContact O-CB 3.28Å; N131-S135 PolarHBondContact O-N 3.47Å; N131-S135 PolarHBondContact O-OG 3.37Å; N131-S135 PolarHBondContact OD1-OG 3.44Å; A132-S135 PolarHBondContact O-N 3.28Å; S135-N137 VanDerWaalsContact C-N 3.26Å; S135-N137 PolarHBondContact O-N 3.48Å; S135-V138 PolarHBondContact O-N 3.46Å; S135-Q139 WeakPolarHBondContact O-CB 3.32Å; S135-Q139 PolarHBondContact O-N 3.07Å
136M81.1Confident84.2Confident40 Ų4016.2 Ų16.220%0.1979%0.09CC..Hα-helixtrans-64.3-27.1179.7-75.4-173.383.300113.7Y22 A132 I134 P140 M413 W414Y22-M136 HydrophobicContact CD1-CE 3.72Å; Y22-M136 HydrophobicContact CD1-CG 4.28Å; Y22-M136 HydrophobicContact CD1-SD 3.55Å; Y22-M136 VanDerWaalsContact CD1-SD 3.55Å; Y22-M136 HydrophobicContact CD2-CG 4.49Å; Y22-M136 HydrophobicContact CD2-SD 3.56Å; Y22-M136 VanDerWaalsContact CD2-SD 3.56Å; Y22-M136 HydrophobicContact CE1-CE 3.5Å; Y22-M136 HydrophobicContact CE1-SD 3.64Å; Y22-M136 HydrophobicContact CE2-SD 3.66Å; Y22-M136 HydrophobicContact CG-CE 4.3Å; Y22-M136 HydrophobicContact CG-CG 4.06Å; Y22-M136 HydrophobicContact CG-SD 3.49Å; A132-M136 WeakPolarHBondContact O-CB 3.29Å; A132-M136 WeakPolarHBondContact O-CG 3.14Å; A132-M136 PolarHBondContact O-N 2.96Å; I134-M136 PolarHBondContact O-N 2.98Å; M136-P140 WeakPolarHBondContact O-CD 3.45Å; M136-P140 VanDerWaalsContact O-CG 3.24Å; M136-P140 WeakPolarHBondContact O-CG 3.28Å; M136-M413 HydrophobicContact CE-CE 3.68Å; M136-M413 HydrophobicContact SD-CE 4.18Å; M136-W414 HydrophobicContact SD-CH2 3.99Å; M136-W414 HydrophobicContact SD-CZ2 3.55Å; M136-W414 VanDerWaalsContact SD-CZ2 3.55Å
137N76.6Confident83.4Confident46 Ų4614.5 Ų14.525%0.2468%0.079CC..Hα-helixtrans-89.8-41.4178.1-73.2-64.8000112.3A76 A79 G133 I134 S135A76-N137 WeakPolarHBondContact CA-ND2 3.22Å; A76-N137 VanDerWaalsContact CB-ND2 3.33Å; A76-N137 WeakPolarHBondContact CB-ND2 3.14Å; A79-N137 HydrophobicContact CB-CB 4.26Å; G133-N137 PolarHBondContact O-ND2 3.24Å; I134-N137 PolarHBondContact O-N 3.37Å; S135-N137 VanDerWaalsContact C-N 3.26Å; S135-N137 PolarHBondContact O-N 3.48Å
138V78.5Confident82.6Confident1 Ų113.7 Ų13.71%0.0068%0.076CC..Hα-helixtrans-77-36-174.6176.90000111.8A79 T83 R91 L95 I134 S135 M141 Y142A79-V138 HydrophobicContact CB-CG2 4.39Å; T83-V138 HydrophobicContact CG2-CG2 4.13Å; R91-V138 HydrophobicContact CB-CG1 4.47Å; L95-V138 HydrophobicContact CD1-CG1 4.39Å; L95-V138 HydrophobicContact CD2-CB 4.13Å; L95-V138 HydrophobicContact CD2-CG1 4Å; L95-V138 HydrophobicContact CG-CG1 3.9Å; I134-V138 HydrophobicContact CG2-CG2 4.04Å; I134-V138 WeakPolarHBondContact O-CB 3.3Å; I134-V138 VanDerWaalsContact O-CG2 3.31Å; I134-V138 WeakPolarHBondContact O-CG2 3.18Å; I134-V138 PolarHBondContact O-N 3.38Å; S135-V138 PolarHBondContact O-N 3.46Å; V138-M141 WeakPolarHBondContact O-CB 3.2Å; V138-M141 PolarHBondContact O-N 3.09Å; V138-Y142 PolarHBondContact O-N 3.04Å
139Q80.9Confident81.6Confident0 Ų019.8 Ų19.80%010%0.102CC..Hα-helixtrans-68.6-49.2-173.8-172.5-167.4-22.300113.6S15 T19 S135 M141 Y142 F143S15-Q139 PolarHBondContact OG-NE2 3.33Å; T19-Q139 VanDerWaalsContact OG1-CD 3.24Å; T19-Q139 PolarHBondContact OG1-NE2 2.95Å; T19-Q139 PolarHBondContact OG1-OE1 2.82Å; S135-Q139 WeakPolarHBondContact O-CB 3.32Å; S135-Q139 PolarHBondContact O-N 3.07Å; Q139-M141 PolarHBondContact O-N 3.14Å; Q139-Y142 PolarHBondContact O-N 3.42Å; Q139-Y142 VanDerWaalsContact O-N 3.12Å; Q139-F143 HydrophobicContact CG-CD1 4.4Å; Q139-F143 HydrophobicContact CG-CD2 4.39Å; Q139-F143 HydrophobicContact CG-CE1 4Å; Q139-F143 HydrophobicContact CG-CE2 3.99Å; Q139-F143 HydrophobicContact CG-CZ 3.77Å; Q139-F143 WeakPolarHBondContact O-CG 3.14Å; Q139-F143 PolarHBondContact O-N 3.05Å
140P75.1Confident80.6Confident37 Ų3726.9 Ų26.924%0.2414%0.135CC..Hα-helixtrans-60.1-31.6176.6-23.835.7000112.3M136 F143 G144M136-P140 WeakPolarHBondContact O-CD 3.45Å; M136-P140 VanDerWaalsContact O-CG 3.24Å; M136-P140 WeakPolarHBondContact O-CG 3.28Å; P140-F143 PolarHBondContact O-N 3.32Å; P140-G144 PolarHBondContact O-N 3.18Å
141M74.4Confident79.7Confident81 Ų8129.4 Ų29.440%0.39915%0.149SC..Hα-helixtrans-67.8-46.7174.9-167.5158.5-168.500111.7R91 V138 Q139 F143 G144 E145R91-M141 PolarHBondContact NH1-SD 2.95Å; R91-M141 PolarHBondContact NH2-SD 2.68Å; V138-M141 WeakPolarHBondContact O-CB 3.2Å; V138-M141 PolarHBondContact O-N 3.09Å; Q139-M141 PolarHBondContact O-N 3.14Å; M141-F143 PolarHBondContact O-N 3.29Å; M141-G144 PolarHBondContact O-N 3.48Å; M141-E145 VanDerWaalsContact CE-OE1 3.22Å; M141-E145 WeakPolarHBondContact CE-OE1 3.41Å; M141-E145 VanDerWaalsContact CG-OE1 3.28Å; M141-E145 WeakPolarHBondContact CG-OE1 3.25Å; M141-E145 WeakPolarHBondContact O-CB 3.4Å; M141-E145 VanDerWaalsContact O-CG 3.26Å; M141-E145 WeakPolarHBondContact O-CG 3.37Å; M141-E145 PolarHBondContact O-N 3.34Å
142Y78.8Confident78.7Confident0 Ų032.8 Ų32.80%016%0.161CC..Hα-helixtrans-59.5-37.7174.9-176.8-124.3000112.1M10 A14 R91 V138 Q139 S146 P207M10-Y142 HydrophobicContact CE-CE1 4.21Å; M10-Y142 HydrophobicContact CG-CE1 3.76Å; M10-Y142 HydrophobicContact SD-CD1 3.95Å; M10-Y142 HydrophobicContact SD-CE1 3.28Å; M10-Y142 WeakPolarHBondContact SD-CE1 3.44Å; A14-Y142 HydrophobicContact CB-CD1 4.17Å; A14-Y142 HydrophobicContact CB-CE1 4.21Å; R91-Y142 HydrophobicContact CB-CD2 4.19Å; V138-Y142 PolarHBondContact O-N 3.04Å; Q139-Y142 PolarHBondContact O-N 3.42Å; Q139-Y142 VanDerWaalsContact O-N 3.12Å; Y142-S146 WeakPolarHBondContact O-CB 3.44Å; Y142-S146 PolarHBondContact O-N 3.48Å; Y142-S146 VanDerWaalsContact O-N 3.09Å; Y142-S146 PolarHBondContact O-OG 3.29Å; Y142-P207 PolarHBondContact OH-O 2.89Å
143F79.6Confident77.8Confident1 Ų134 Ų340%0.00417%0.174CC..Hα-helixtrans-67.2-50.2175.4-76.55.4000112.4M10 V11 A14 S15 Q139 P140 M141 E145 S146 A147 I155 S159M10-F143 HydrophobicContact SD-CE1 4.37Å; V11-F143 HydrophobicContact CB-CE1 4.27Å; V11-F143 HydrophobicContact CB-CZ 4.11Å; V11-F143 HydrophobicContact CG1-CE1 4.36Å; V11-F143 HydrophobicContact CG1-CE2 3.92Å; V11-F143 HydrophobicContact CG1-CZ 3.73Å; V11-F143 HydrophobicContact CG2-CD1 4.32Å; V11-F143 HydrophobicContact CG2-CE1 4.07Å; V11-F143 HydrophobicContact CG2-CZ 4.26Å; V11-F143 WeakPolarHBondContact O-CZ 3.12Å; A14-F143 HydrophobicContact CB-CE1 3.73Å; A14-F143 HydrophobicContact CB-CZ 4.17Å; S15-F143 VanDerWaalsContact OG-CZ 3.23Å; S15-F143 WeakPolarHBondContact OG-CZ 3.14Å; Q139-F143 HydrophobicContact CG-CD1 4.4Å; Q139-F143 HydrophobicContact CG-CD2 4.39Å; Q139-F143 HydrophobicContact CG-CE1 4Å; Q139-F143 HydrophobicContact CG-CE2 3.99Å; Q139-F143 HydrophobicContact CG-CZ 3.77Å; Q139-F143 WeakPolarHBondContact O-CG 3.14Å; Q139-F143 PolarHBondContact O-N 3.05Å; P140-F143 PolarHBondContact O-N 3.32Å; M141-F143 PolarHBondContact O-N 3.29Å; F143-E145 VanDerWaalsContact C-N 3.25Å; F143-E145 PolarHBondContact O-N 3.01Å; F143-S146 PolarHBondContact O-N 3.16Å; F143-A147 WeakPolarHBondContact O-CB 3.48Å; F143-A147 PolarHBondContact O-N 3.49Å; F143-I155 HydrophobicContact CB-CG2 3.95Å; F143-I155 HydrophobicContact CD2-CG2 4.27Å; F143-I155 WeakPolarHBondContact CD2-O 3.24Å; F143-I155 HydrophobicContact CG-CG2 4.08Å; F143-S159 WeakPolarHBondContact CD2-OG 3.25Å; F143-S159 WeakPolarHBondContact CE2-OG 3.47Å
144G73.3Confident77.2Confident14 Ų1435.6 Ų35.614%0.14419%0.187CC..Hα-helixtrans-61.8-33.5178.900000113.2P140 M141 R152 R211P140-G144 PolarHBondContact O-N 3.18Å; M141-G144 PolarHBondContact O-N 3.48Å; G144-R152 WeakPolarHBondContact O-CD 3.21Å; G144-R152 PolarHBondContact O-NE 2.93Å; G144-R211 PolarHBondContact O-NH1 3.48Å; G144-R211 VanDerWaalsContact O-NH1 3.14Å
145E76.9Confident76.8Confident26 Ų2636.5 Ų36.512%0.12119%0.192CC..Hα-helixtrans-81.7-26.7179.4-68.7172.5-174.100114.1M141 F143 S209 R211M141-E145 VanDerWaalsContact CE-OE1 3.22Å; M141-E145 WeakPolarHBondContact CE-OE1 3.41Å; M141-E145 VanDerWaalsContact CG-OE1 3.28Å; M141-E145 WeakPolarHBondContact CG-OE1 3.25Å; M141-E145 WeakPolarHBondContact O-CB 3.4Å; M141-E145 VanDerWaalsContact O-CG 3.26Å; M141-E145 WeakPolarHBondContact O-CG 3.37Å; M141-E145 PolarHBondContact O-N 3.34Å; F143-E145 VanDerWaalsContact C-N 3.25Å; F143-E145 PolarHBondContact O-N 3.01Å; E145-S209 WeakPolarHBondContact CB-OG 3.33Å; E145-S209 WeakPolarHBondContact OE2-CB 3.47Å; E145-S209 PolarHBondContact OE2-OG 3.05Å; E145-R211 HydrophobicContact CB-CB 4.14Å; E145-R211 HydrophobicContact CB-CG 4.38Å; E145-R211 HydrophobicContact CG-CB 4.15Å
146S79.5Confident76.2Confident1 Ų137.9 Ų37.91%0.00720%0.201CC..Hα-helixtrans-94.8-24.4-178.3-55.40000113.3Y142 F143 R231Y142-S146 WeakPolarHBondContact O-CB 3.44Å; Y142-S146 PolarHBondContact O-N 3.48Å; Y142-S146 VanDerWaalsContact O-N 3.09Å; Y142-S146 PolarHBondContact O-OG 3.29Å; F143-S146 PolarHBondContact O-N 3.16Å; S146-R231 PolarHBondContact O-NH1 3.42Å; S146-R231 PolarHBondContact O-NH2 3.39Å; S146-R231 VanDerWaalsContact O-NH2 3.09Å
147A79.5Confident76Confident1 Ų136.4 Ų36.41%0.00819%0.193CC..SBendtrans-73.8142.1-178.100000113.1F143 R152 I155F143-A147 WeakPolarHBondContact O-CB 3.48Å; F143-A147 PolarHBondContact O-N 3.49Å; A147-R152 HydrophobicContact CB-CB 4.23Å; A147-R152 HydrophobicContact CB-CG 4.37Å; A147-I155 HydrophobicContact CB-CB 3.99Å; A147-I155 HydrophobicContact CB-CD1 3.56Å; A147-I155 HydrophobicContact CB-CG1 4.34Å; A147-I155 HydrophobicContact CB-CG2 4.14Å
148P78.1Confident76.2Confident12 Ų1235 Ų358%0.07819%0.188CC..  trans-67.2152.3171.228.9-31.3000109.9L7 H150 L151 R152L7-P148 HydrophobicContact CD2-CG 4.45Å; P148-H150 VanDerWaalsContact C-N 3.27Å; P148-H150 PolarHBondContact O-N 3.09Å; P148-H150 VanDerWaalsContact O-N 3.13Å; P148-L151 HydrophobicContact CG-CB 4Å; P148-L151 HydrophobicContact CG-CD1 3.96Å; P148-L151 HydrophobicContact CG-CG 4.14Å; P148-L151 CarbonylContact O-C 3.58Å; P148-L151 PolarHBondContact O-N 3.04Å; P148-R152 PolarHBondContact O-N 3.46Å
149K71.8Confident76.4Confident133 Ų13335.5 Ų35.558%0.57819%0.191SC*.G310 helixtrans-51-42.8-172.7-168.9-179.1-168.9172.20113.7L151 E242K149-L151 VanDerWaalsContact C-N 3.35Å; K149-L151 PolarHBondContact O-N 3.39Å; K149-E242 IonicContact NZ-OE1 2.74Å; K149-E242 PolarHBondContact NZ-OE1 3.29Å; K149-E242 IonicContact NZ-OE2 3.15Å
150H71.9Confident76.6Confident149 Ų14936.4 Ų36.469%0.6920%0.199SC*.G310 helixtrans-74.8-17.4-177.865.4-84.2000114.4P148P148-H150 VanDerWaalsContact C-N 3.27Å; P148-H150 PolarHBondContact O-N 3.09Å; P148-H150 VanDerWaalsContact O-N 3.13Å
151L73Confident77.2Confident73 Ų7335.9 Ų35.938%0.38220%0.195SC..G310 helixtrans-112-0.2176.8-59.2175.4000113.3P148 K149 G153 A154 I155P148-L151 HydrophobicContact CG-CB 4Å; P148-L151 HydrophobicContact CG-CD1 3.96Å; P148-L151 HydrophobicContact CG-CG 4.14Å; P148-L151 CarbonylContact O-C 3.58Å; P148-L151 PolarHBondContact O-N 3.04Å; K149-L151 VanDerWaalsContact C-N 3.35Å; K149-L151 PolarHBondContact O-N 3.39Å; L151-G153 VanDerWaalsContact C-N 3.3Å; L151-G153 PolarHBondContact O-N 3.1Å; L151-A154 PolarHBondContact O-N 3.3Å; L151-I155 HydrophobicContact CB-CD1 3.79Å; L151-I155 HydrophobicContact CB-CG1 4.24Å; L151-I155 WeakPolarHBondContact O-CB 3.44Å; L151-I155 WeakPolarHBondContact O-CG1 3.33Å; L151-I155 PolarHBondContact O-N 3.22Å
152R72.9Confident78Confident72 Ų7234.3 Ų34.327%0.27219%0.186SC..Hα-helixtrans-58.1-42.3-173.6-172.6178.4-64.5157.78.5112.6G144 A147 P148 S156 R211G144-R152 WeakPolarHBondContact O-CD 3.21Å; G144-R152 PolarHBondContact O-NE 2.93Å; A147-R152 HydrophobicContact CB-CB 4.23Å; A147-R152 HydrophobicContact CB-CG 4.37Å; P148-R152 PolarHBondContact O-N 3.46Å; R152-S156 VanDerWaalsContact O-CB 3.26Å; R152-S156 WeakPolarHBondContact O-CB 3.44Å; R152-S156 PolarHBondContact O-N 3.35Å; R152-R211 VanDerWaalsContact CZ-NH2 3.27Å; R152-R211 VanDerWaalsContact NH2-NH1 3.2Å
153G71Confident78.5Confident26 Ų2635.2 Ų35.227%0.26819%0.191SC..Hα-helixtrans-61.7-52.6176.400000111.9L151 I155 S156 Q157L151-G153 VanDerWaalsContact C-N 3.3Å; L151-G153 PolarHBondContact O-N 3.1Å; G153-I155 PolarHBondContact O-N 2.8Å; G153-S156 PolarHBondContact O-N 3.3Å; G153-Q157 WeakPolarHBondContact O-CB 3.19Å; G153-Q157 VanDerWaalsContact O-CG 3.28Å; G153-Q157 WeakPolarHBondContact O-CG 3.31Å; G153-Q157 PolarHBondContact O-N 3.47Å; G153-Q157 PolarHBondContact O-NE2 3.05Å
154A74.4Confident79.1Confident33 Ų3335.2 Ų35.227%0.27319%0.191SC..Hα-helixtrans-61.2-40.6179.400000113.2L151 Q157 S158L151-A154 PolarHBondContact O-N 3.3Å; A154-Q157 PolarHBondContact O-N 2.68Å; A154-S158 PolarHBondContact O-N 2.9Å
155I78.7Confident80Confident21 Ų2138.5 Ų38.511%0.10820%0.202CC..Hα-helixtrans-72.2-40178.9-66.5169.6000110.7L7 V11 F143 A147 L151 G153 Q157 S158L7-I155 HydrophobicContact CD1-CD1 4.49Å; L7-I155 HydrophobicContact CD2-CD1 3.64Å; L7-I155 HydrophobicContact CG-CD1 4.16Å; V11-I155 HydrophobicContact CG2-CG2 3.69Å; F143-I155 HydrophobicContact CB-CG2 3.95Å; F143-I155 HydrophobicContact CD2-CG2 4.27Å; F143-I155 WeakPolarHBondContact CD2-O 3.24Å; F143-I155 HydrophobicContact CG-CG2 4.08Å; A147-I155 HydrophobicContact CB-CB 3.99Å; A147-I155 HydrophobicContact CB-CD1 3.56Å; A147-I155 HydrophobicContact CB-CG1 4.34Å; A147-I155 HydrophobicContact CB-CG2 4.14Å; L151-I155 HydrophobicContact CB-CD1 3.79Å; L151-I155 HydrophobicContact CB-CG1 4.24Å; L151-I155 WeakPolarHBondContact O-CB 3.44Å; L151-I155 WeakPolarHBondContact O-CG1 3.33Å; L151-I155 PolarHBondContact O-N 3.22Å; G153-I155 PolarHBondContact O-N 2.8Å; I155-Q157 VanDerWaalsContact C-N 3.28Å; I155-Q157 PolarHBondContact O-N 2.95Å; I155-S158 WeakPolarHBondContact O-CB 3.32Å; I155-S158 PolarHBondContact O-N 2.81Å; I155-S158 PolarHBondContact O-OG 3.49Å
156S74.9Confident80.8Confident28 Ų2837.2 Ų37.220%0.19620%0.196CC..Hα-helixtrans-63.1-36.5173.9-171.20000111.9R152 G153 S158 S159R152-S156 VanDerWaalsContact O-CB 3.26Å; R152-S156 WeakPolarHBondContact O-CB 3.44Å; R152-S156 PolarHBondContact O-N 3.35Å; G153-S156 PolarHBondContact O-N 3.3Å; S156-S158 VanDerWaalsContact C-N 3.33Å; S156-S159 WeakPolarHBondContact O-CB 3.24Å
157Q75.3Confident81.5Confident9 Ų937.2 Ų37.24%0.04220%0.195CC..Hα-helixtrans-73.9-23.1177.3-74179.274.100113.5G153 A154 I155 S159 A160 N326 A386G153-Q157 WeakPolarHBondContact O-CB 3.19Å; G153-Q157 VanDerWaalsContact O-CG 3.28Å; G153-Q157 WeakPolarHBondContact O-CG 3.31Å; G153-Q157 PolarHBondContact O-N 3.47Å; G153-Q157 PolarHBondContact O-NE2 3.05Å; A154-Q157 PolarHBondContact O-N 2.68Å; I155-Q157 VanDerWaalsContact C-N 3.28Å; I155-Q157 PolarHBondContact O-N 2.95Å; Q157-S159 PolarHBondContact O-N 3.38Å; Q157-S159 VanDerWaalsContact O-N 3.1Å; Q157-A160 PolarHBondContact O-N 2.89Å; Q157-N326 PolarHBondContact NE2-OD1 3.35Å; Q157-N326 PolarHBondContact OE1-OD1 3.44Å; Q157-A386 PolarHBondContact OE1-O 3.47Å
158S80.8Confident82.2Confident18 Ų1838.2 Ų38.213%0.12620%0.202CC..Hα-helixtrans-56.2-28.6175.775.20000112.5V11 A154 I155 S156 A160 V161 F162V11-S158 WeakPolarHBondContact CG1-OG 3.46Å; A154-S158 PolarHBondContact O-N 2.9Å; I155-S158 WeakPolarHBondContact O-CB 3.32Å; I155-S158 PolarHBondContact O-N 2.81Å; I155-S158 PolarHBondContact O-OG 3.49Å; S156-S158 VanDerWaalsContact C-N 3.33Å; S158-A160 VanDerWaalsContact C-N 3.3Å; S158-A160 PolarHBondContact O-N 3.47Å; S158-V161 WeakPolarHBondContact O-CB 3.5Å; S158-V161 PolarHBondContact O-N 3.5Å; S158-V161 VanDerWaalsContact O-N 3.1Å; S158-F162 WeakPolarHBondContact O-CD2 3.38Å; S158-F162 PolarHBondContact O-N 2.87Å
159S83.1Confident83Confident11 Ų1140.4 Ų40.48%0.07721%0.212CC..Hα-helixtrans-53.1-42.9172.5-72.50000113.3T19 F143 S156 Q157 F162 T163T19-S159 WeakPolarHBondContact CB-O 3.46Å; F143-S159 WeakPolarHBondContact CD2-OG 3.25Å; F143-S159 WeakPolarHBondContact CE2-OG 3.47Å; S156-S159 WeakPolarHBondContact O-CB 3.24Å; Q157-S159 PolarHBondContact O-N 3.38Å; Q157-S159 VanDerWaalsContact O-N 3.1Å; S159-F162 PolarHBondContact O-N 2.98Å; S159-T163 PolarHBondContact O-N 3.32Å; S159-T163 PolarHBondContact O-OG1 2.9Å
160A84.7Confident84Confident19 Ų1934.1 Ų34.116%0.15719%0.185CC..Hα-helixtrans-68.2-37.5178.100000111.8Q157 S158 F162 T163 A164Q157-A160 PolarHBondContact O-N 2.89Å; S158-A160 VanDerWaalsContact C-N 3.3Å; S158-A160 PolarHBondContact O-N 3.47Å; A160-F162 VanDerWaalsContact C-N 3.34Å; A160-F162 PolarHBondContact O-N 3.27Å; A160-T163 PolarHBondContact O-N 3.45Å; A160-A164 PolarHBondContact O-N 3.04Å
161V88.6Confident85.1Confident26 Ų2627.6 Ų27.616%0.15816%0.155CC..Hα-helixtrans-62.9-42.1175.1179.60000110.9S158 A164 F165 F319 C322 I323S158-V161 WeakPolarHBondContact O-CB 3.5Å; S158-V161 PolarHBondContact O-N 3.5Å; S158-V161 VanDerWaalsContact O-N 3.1Å; V161-A164 PolarHBondContact O-N 3.32Å; V161-F165 WeakPolarHBondContact O-CB 3.46Å; V161-F165 PolarHBondContact O-N 2.97Å; V161-F319 HydrophobicContact CG1-CD2 4.2Å; V161-F319 HydrophobicContact CG1-CE2 3.63Å; V161-F319 HydrophobicContact CG1-CZ 4.48Å; V161-C322 HydrophobicContact CG2-CB 4.2Å; V161-I323 HydrophobicContact CG1-CG1 3.98Å; V161-I323 HydrophobicContact CG2-CG1 4.44Å
162F90.3Very high86.1Confident48 Ų4826.6 Ų26.621%0.21115%0.151CC..Hα-helixtrans-68.9-33.7175.9-80.6-74.9000113V11 A12 S15 L20 S158 S159 A160 F165 G166V11-F162 HydrophobicContact CG1-CE2 3.99Å; A12-F162 HydrophobicContact CB-CZ 4.46Å; S15-F162 WeakPolarHBondContact OG-CD2 3.4Å; S15-F162 WeakPolarHBondContact OG-CE2 3.46Å; L20-F162 WeakPolarHBondContact CA-O 3.24Å; S158-F162 WeakPolarHBondContact O-CD2 3.38Å; S158-F162 PolarHBondContact O-N 2.87Å; S159-F162 PolarHBondContact O-N 2.98Å; A160-F162 VanDerWaalsContact C-N 3.34Å; A160-F162 PolarHBondContact O-N 3.27Å; F162-F165 PolarHBondContact O-N 3.07Å; F162-G166 PolarHBondContact O-N 2.93Å
163T90.6Very high87Confident19 Ų1924.3 Ų24.312%0.11715%0.146CC..Hα-helixtrans-61.3-50.7170.4-67.90000111.3T19 Y22 G23 S159 A160 F165 G166 V167T19-T163 WeakPolarHBondContact CB-OG1 3.26Å; T19-T163 WeakPolarHBondContact O-CA 3.34Å; T19-T163 PolarHBondContact O-OG1 3.07Å; Y22-T163 HydrophobicContact CD1-CG2 3.62Å; Y22-T163 HydrophobicContact CE1-CG2 3.97Å; G23-T163 WeakPolarHBondContact CA-O 3.42Å; S159-T163 PolarHBondContact O-N 3.32Å; S159-T163 PolarHBondContact O-OG1 2.9Å; A160-T163 PolarHBondContact O-N 3.45Å; T163-F165 VanDerWaalsContact C-N 3.29Å; T163-F165 PolarHBondContact O-N 3.45Å; T163-G166 WeakPolarHBondContact O-CA 3.49Å; T163-G166 PolarHBondContact O-N 3.06Å; T163-V167 PolarHBondContact O-N 2.85Å
164A91.8Very high87.9Confident0 Ų023.2 Ų23.20%013%0.134CC..Hα-helixtrans-62.3-36.9177.500000112.2A160 V161 G166 V167 V168 E318 F319 C322A160-A164 PolarHBondContact O-N 3.04Å; V161-A164 PolarHBondContact O-N 3.32Å; A164-G166 VanDerWaalsContact C-N 3.32Å; A164-G166 PolarHBondContact O-N 2.89Å; A164-V167 WeakPolarHBondContact O-CB 3.38Å; A164-V167 PolarHBondContact O-N 3.13Å; A164-V168 WeakPolarHBondContact O-CG2 3.48Å; A164-V168 PolarHBondContact O-N 3.4Å; A164-E318 HydrophobicContact CB-CB 4.36Å; A164-E318 HydrophobicContact CB-CG 3.93Å; A164-F319 HydrophobicContact CB-CB 4.11Å; A164-F319 HydrophobicContact CB-CD2 4.25Å; A164-C322 HydrophobicContact CB-CB 4.46Å
165F93.1Very high88.7Confident83 Ų8322.7 Ų22.736%0.36413%0.126SC..Hα-helixtrans-63.3-38.5171.7-177.4-115000112.3L20 V161 F162 T163 V168 L169 F319L20-F165 HydrophobicContact CD1-CD1 3.67Å; L20-F165 HydrophobicContact CD1-CE1 3.94Å; L20-F165 HydrophobicContact CG-CD1 4.41Å; V161-F165 WeakPolarHBondContact O-CB 3.46Å; V161-F165 PolarHBondContact O-N 2.97Å; F162-F165 PolarHBondContact O-N 3.07Å; T163-F165 VanDerWaalsContact C-N 3.29Å; T163-F165 PolarHBondContact O-N 3.45Å; F165-V168 PolarHBondContact O-N 2.98Å; F165-L169 WeakPolarHBondContact O-CB 3.38Å; F165-L169 PolarHBondContact O-N 3.48Å; F165-F319 HydrophobicContact CB-CD2 3.95Å; F165-F319 HydrophobicContact CB-CE2 3.76Å; F165-F319 HydrophobicContact CD2-CE2 4.21Å; F165-F319 HydrophobicContact CD2-CZ 4.37Å; F165-F319 HydrophobicContact CG-CE2 4.37Å
166G93.6Very high89.1Confident0 Ų028.9 Ų28.90%015%0.149CC..Hα-helixtrans-60.7-42.217300000112.6L20 Y24 F162 T163 A164 L169 G170L20-G166 WeakPolarHBondContact O-CA 3.37Å; Y24-G166 VanDerWaalsContact CA-O 3.28Å; Y24-G166 WeakPolarHBondContact CA-O 3.17Å; Y24-G166 PolarHBondContact N-O 3.13Å; F162-G166 PolarHBondContact O-N 2.93Å; T163-G166 WeakPolarHBondContact O-CA 3.49Å; T163-G166 PolarHBondContact O-N 3.06Å; A164-G166 VanDerWaalsContact C-N 3.32Å; A164-G166 PolarHBondContact O-N 2.89Å; G166-L169 PolarHBondContact O-N 2.96Å; G166-G170 PolarHBondContact O-N 3.32Å
167V93.7Very high89.6Confident0 Ų033.4 Ų33.40%017%0.166CC..Hα-helixtrans-58-53.1173.81730000110G23 A27 T163 A164 L169 G170 Q171 Y290G23-V167 WeakPolarHBondContact O-CA 3.32Å; G23-V167 WeakPolarHBondContact O-CG2 3.38Å; A27-V167 HydrophobicContact CB-CG1 4.23Å; A27-V167 WeakPolarHBondContact CB-O 3.41Å; T163-V167 PolarHBondContact O-N 2.85Å; A164-V167 WeakPolarHBondContact O-CB 3.38Å; A164-V167 PolarHBondContact O-N 3.13Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.1Å; V167-G170 PolarHBondContact O-N 3.01Å; V167-G170 VanDerWaalsContact O-N 3.17Å; V167-Q171 HydrophobicContact CG1-CG 4.49Å; V167-Q171 VanDerWaalsContact O-CG 3.29Å; V167-Q171 WeakPolarHBondContact O-CG 3.47Å; V167-Q171 PolarHBondContact O-N 2.73Å; V167-Y290 HydrophobicContact CG1-CD1 3.87Å; V167-Y290 HydrophobicContact CG1-CE1 3.74Å; V167-Y290 HydrophobicContact CG1-CE2 4.42Å; V167-Y290 HydrophobicContact CG1-CG 4.31Å
168V94.9Very high90.2Very high23 Ų2337 Ų3714%0.13919%0.185CC..Hα-helixtrans-56.6-47.5177.9175.40000111.3A164 F165 G170 Q171 V172 G315 F319A164-V168 WeakPolarHBondContact O-CG2 3.48Å; A164-V168 PolarHBondContact O-N 3.4Å; F165-V168 PolarHBondContact O-N 2.98Å; V168-G170 VanDerWaalsContact C-N 3.32Å; V168-G170 PolarHBondContact O-N 3.32Å; V168-Q171 PolarHBondContact O-N 3.49Å; V168-V172 HydrophobicContact CG1-CG2 4.33Å; V168-V172 WeakPolarHBondContact O-CG2 3.48Å; V168-V172 PolarHBondContact O-N 3.23Å; V168-G315 VanDerWaalsContact CG2-O 3.26Å; V168-G315 WeakPolarHBondContact CG2-O 3.18Å; V168-F319 HydrophobicContact CG2-CB 4.12Å
169L94.5Very high90.6Very high58 Ų5838.2 Ų38.230%0.30419%0.19SC..Hα-helixtrans-61.8-41.1-180-173.765.4000111.5L20 Y24 F165 G166 V167 V172 V173L20-L169 HydrophobicContact CD2-CD2 4.22Å; Y24-L169 HydrophobicContact CD2-CB 4.25Å; Y24-L169 HydrophobicContact CD2-CD2 4.3Å; Y24-L169 HydrophobicContact CD2-CG 4.18Å; Y24-L169 HydrophobicContact CE2-CB 4.49Å; Y24-L169 HydrophobicContact CE2-CD2 4.37Å; Y24-L169 HydrophobicContact CE2-CG 4.05Å; F165-L169 WeakPolarHBondContact O-CB 3.38Å; F165-L169 PolarHBondContact O-N 3.48Å; G166-L169 PolarHBondContact O-N 2.96Å; V167-L169 VanDerWaalsContact C-N 3.33Å; V167-L169 PolarHBondContact O-N 3.1Å; L169-V172 PolarHBondContact O-N 2.96Å; L169-V173 HydrophobicContact CD1-CG2 4.39Å; L169-V173 VanDerWaalsContact O-CG2 3.28Å; L169-V173 WeakPolarHBondContact O-CG2 3.29Å; L169-V173 PolarHBondContact O-N 2.77Å
170G93.1Very high90.6Very high0 Ų037.7 Ų37.70%019%0.187CC..Hα-helixtrans-63.4-39.9175.700000112.7Y24 G166 V167 V168 G174Y24-G170 VanDerWaalsContact CD2-CA 3.47Å; Y24-G170 VanDerWaalsContact CE2-CA 3.44Å; G166-G170 PolarHBondContact O-N 3.32Å; V167-G170 PolarHBondContact O-N 3.01Å; V167-G170 VanDerWaalsContact O-N 3.17Å; V168-G170 VanDerWaalsContact C-N 3.32Å; V168-G170 PolarHBondContact O-N 3.32Å; G170-G174 PolarHBondContact O-N 3.39Å
171Q93.6Very high90.6Very high12 Ų1238.2 Ų38.26%0.05619%0.188CC..Hα-helixtrans-67.5-40.6176.3-65.5172.9-2500111.9A27 V167 V168 G174 L175 T311 I312 T314 G315A27-Q171 HydrophobicContact CB-CG 3.79Å; V167-Q171 HydrophobicContact CG1-CG 4.49Å; V167-Q171 VanDerWaalsContact O-CG 3.29Å; V167-Q171 WeakPolarHBondContact O-CG 3.47Å; V167-Q171 PolarHBondContact O-N 2.73Å; V168-Q171 PolarHBondContact O-N 3.49Å; Q171-G174 PolarHBondContact O-N 2.89Å; Q171-L175 PolarHBondContact O-N 3Å; Q171-T311 HydrophobicContact CG-CG2 3.93Å; Q171-T311 PolarHBondContact NE2-O 3.25Å; Q171-T311 PolarHBondContact OE1-O 3.2Å; Q171-I312 HydrophobicContact CB-CG1 3.82Å; Q171-T314 PolarHBondContact NE2-OG1 3.1Å; Q171-G315 VanDerWaalsContact OE1-CA 3.26Å; Q171-G315 VanDerWaalsContact OE1-N 3.14Å
172V93.8Very high90.4Very high52 Ų5242.4 Ų42.432%0.31521%0.206SC..Hα-helixtrans-65.2-50176.5171.50000110.8V168 L169 G174 L175 I178 I312V168-V172 HydrophobicContact CG1-CG2 4.33Å; V168-V172 WeakPolarHBondContact O-CG2 3.48Å; V168-V172 PolarHBondContact O-N 3.23Å; L169-V172 PolarHBondContact O-N 2.96Å; V172-G174 PolarHBondContact O-N 2.99Å; V172-L175 VanDerWaalsContact O-CB 3.27Å; V172-L175 WeakPolarHBondContact O-CB 3.49Å; V172-L175 VanDerWaalsContact O-CG 3.3Å; V172-L175 WeakPolarHBondContact O-CG 3.47Å; V172-L175 PolarHBondContact O-N 3.28Å; V172-L175 VanDerWaalsContact O-N 3.08Å; V172-I178 HydrophobicContact CG1-CD1 4.15Å; V172-I178 WeakPolarHBondContact O-CD1 3.4Å; V172-I312 HydrophobicContact CG2-CD1 4.32Å; V172-I312 HydrophobicContact CG2-CG1 4.49Å; V172-I312 HydrophobicContact CG2-CG2 4.37Å
173V93.2Very high90.1Very high25 Ų2543.6 Ų43.615%0.15222%0.221CC..Hα-helixtrans-65.1-29178.9-179.20000111.3Y24 L169 L175 I178 L179 L188Y24-V173 HydrophobicContact CE2-CB 4.43Å; Y24-V173 HydrophobicContact CE2-CG2 4.29Å; Y24-V173 WeakPolarHBondContact OH-CG1 3.3Å; L169-V173 HydrophobicContact CD1-CG2 4.39Å; L169-V173 VanDerWaalsContact O-CG2 3.28Å; L169-V173 WeakPolarHBondContact O-CG2 3.29Å; L169-V173 PolarHBondContact O-N 2.77Å; V173-L175 PolarHBondContact O-N 3.36Å; V173-I178 HydrophobicContact CG1-CG2 4.34Å; V173-L179 HydrophobicContact CG1-CB 4.28Å; V173-L179 HydrophobicContact CG1-CD1 3.72Å; V173-L179 HydrophobicContact CG1-CG 4.31Å; V173-L179 PolarHBondContact O-N 3.12Å; V173-L188 HydrophobicContact CB-CD1 4.28Å; V173-L188 HydrophobicContact CG1-CD1 3.7Å
174G90.3Very high90.1Very high2 Ų244.2 Ų44.22%0.02123%0.225CC..THydrogen-bonded Turntrans-72.5-0.4173.500000115.7A31 G170 Q171 V172 G180A31-G174 WeakPolarHBondContact CB-O 3.35Å; G170-G174 PolarHBondContact O-N 3.39Å; Q171-G174 PolarHBondContact O-N 2.89Å; V172-G174 PolarHBondContact O-N 2.99Å; G174-G180 WeakPolarHBondContact O-CA 3.37Å
175L90.4Very high90Very high22 Ų2244.4 Ų44.412%0.11523%0.226CC..SBendtrans-62.8144.9172.7-76.8173.4000111.8Q171 V172 V173 E177 I178 L179 G180 Q308 Y309 I312Q171-L175 PolarHBondContact O-N 3Å; V172-L175 VanDerWaalsContact O-CB 3.27Å; V172-L175 WeakPolarHBondContact O-CB 3.49Å; V172-L175 VanDerWaalsContact O-CG 3.3Å; V172-L175 WeakPolarHBondContact O-CG 3.47Å; V172-L175 PolarHBondContact O-N 3.28Å; V172-L175 VanDerWaalsContact O-N 3.08Å; V173-L175 PolarHBondContact O-N 3.36Å; L175-E177 PolarHBondContact O-N 2.87Å; L175-I178 HydrophobicContact CB-CG1 4.25Å; L175-I178 HydrophobicContact CD1-CD1 4.47Å; L175-I178 PolarHBondContact O-N 3.08Å; L175-L179 PolarHBondContact O-N 3.33Å; L175-G180 WeakPolarHBondContact O-CA 3.2Å; L175-G180 PolarHBondContact O-N 2.95Å; L175-Q308 HydrophobicContact CD2-CB 4.16Å; L175-Y309 HydrophobicContact CD2-CD1 4.19Å; L175-Y309 HydrophobicContact CD2-CE1 4.09Å; L175-I312 HydrophobicContact CD1-CD1 3.79Å; L175-I312 HydrophobicContact CD2-CD1 3.64Å; L175-I312 HydrophobicContact CG-CD1 3.79Å
176R86Confident89.8Confident152 Ų15241.5 Ų41.557%0.57421%0.214SC*.THydrogen-bonded Turntrans-58-32178.2-165.8175.5-178.6-176.71.3112.7I178 C181R176-I178 VanDerWaalsContact C-N 3.28Å; R176-I178 PolarHBondContact O-N 3.44Å; R176-C181 HydrophobicContact CG-CB 4.48Å
177E86.2Confident89.7Confident122 Ų12247.1 Ų47.157%0.5724%0.236SC*.THydrogen-bonded Turntrans-74.8-15.5178.4-59.376.4-168.500113.2L175 Y309L175-E177 PolarHBondContact O-N 2.87Å; E177-Y309 PolarHBondContact OE1-OH 3.36Å; E177-Y309 PolarHBondContact OE2-OH 2.87Å
178I88.7Confident89.7Confident85 Ų8547.1 Ų47.144%0.43624%0.236SC..THydrogen-bonded Turntrans-108.4-82.3-175.9-56.4-171.6000110.8V172 V173 L175 R176V172-I178 HydrophobicContact CG1-CD1 4.15Å; V172-I178 WeakPolarHBondContact O-CD1 3.4Å; V173-I178 HydrophobicContact CG1-CG2 4.34Å; L175-I178 HydrophobicContact CB-CG1 4.25Å; L175-I178 HydrophobicContact CD1-CD1 4.47Å; L175-I178 PolarHBondContact O-N 3.08Å; R176-I178 VanDerWaalsContact C-N 3.28Å; R176-I178 PolarHBondContact O-N 3.44Å
179L87.9Confident89.4Confident44 Ų4446.3 Ų46.323%0.2323%0.231CC..THydrogen-bonded Turntrans-133-2.6-179.2-68.6177.2000113.3V173 L175 C181 C184 L188V173-L179 HydrophobicContact CG1-CB 4.28Å; V173-L179 HydrophobicContact CG1-CD1 3.72Å; V173-L179 HydrophobicContact CG1-CG 4.31Å; V173-L179 PolarHBondContact O-N 3.12Å; L175-L179 PolarHBondContact O-N 3.33Å; L179-C181 PolarHBondContact O-N 3.14Å; L179-C181 VanDerWaalsContact O-N 3.13Å; L179-C184 HydrophobicContact CD2-CB 4.14Å; L179-C184 CarbonylContact O-C 3.54Å; L179-L188 HydrophobicContact CB-CB 3.92Å; L179-L188 HydrophobicContact CB-CD1 4.14Å
180G83.1Confident89.3Confident0 Ų044.3 Ų44.30%022%0.223CC..  trans-80.728.2179.300000115F35 G174 L175F35-G180 WeakPolarHBondContact CE2-O 3.17Å; G174-G180 WeakPolarHBondContact O-CA 3.37Å; L175-G180 WeakPolarHBondContact O-CA 3.2Å; L175-G180 PolarHBondContact O-N 2.95Å
181C84.9Confident89.3Confident29 Ų2944.9 Ų44.920%0.19623%0.227CC..SBendtrans-104.7160.7177.466.40000111.7R176 L179 S183 C184 W185R176-C181 HydrophobicContact CG-CB 4.48Å; L179-C181 PolarHBondContact O-N 3.14Å; L179-C181 VanDerWaalsContact O-N 3.13Å; C181-S183 VanDerWaalsContact C-N 3.27Å; C181-S183 PolarHBondContact O-N 3.01Å; C181-C184 PolarHBondContact O-N 2.97Å; C181-C184 WeakPolarHBondContact SG-CB 3.39Å; C181-W185 PolarHBondContact O-N 3.41Å; C181-W185 VanDerWaalsContact O-N 3.08Å
182E84.9Confident89Confident114 Ų11444.3 Ų44.353%0.53322%0.224SC..THydrogen-bonded Turntrans-59.2-33-174.3-169.6-171.6156.900113.7F35 R113F35-E182 HydrophobicContact CD1-CB 3.8Å; F35-E182 HydrophobicContact CD1-CG 3.77Å; F35-E182 HydrophobicContact CE1-CB 3.77Å; F35-E182 HydrophobicContact CE1-CG 4.16Å; F35-E182 HydrophobicContact CG-CB 4.3Å; F35-E182 HydrophobicContact CG-CG 4.35Å; F35-E182 HydrophobicContact CZ-CB 4.25Å; R113-E182 PolarHBondContact NH1-O 2.94Å
183S84.9Confident88.8Confident74 Ų7443 Ų4352%0.51722%0.218SC..THydrogen-bonded Turntrans-76.8-23.2176.251.60000112.8C181C181-S183 VanDerWaalsContact C-N 3.27Å; C181-S183 PolarHBondContact O-N 3.01Å
184C89.1Confident88.8Confident31 Ų3146.9 Ų46.921%0.20924%0.237CC..THydrogen-bonded Turntrans-115.20.2-168-60.50000116.5L179 C181 Q186 Y187 L188L179-C184 HydrophobicContact CD2-CB 4.14Å; L179-C184 CarbonylContact O-C 3.54Å; C181-C184 PolarHBondContact O-N 2.97Å; C181-C184 WeakPolarHBondContact SG-CB 3.39Å; C184-Q186 PolarHBondContact O-N 3.46Å; C184-Y187 HydrophobicContact CB-CD2 4.1Å; C184-Y187 WeakPolarHBondContact O-CA 3.49Å; C184-Y187 WeakPolarHBondContact O-CB 3.14Å; C184-Y187 PolarHBondContact O-N 3.31Å; C184-L188 PolarHBondContact O-N 3.28Å
185W89.6Confident88.7Confident4 Ų447.3 Ų47.32%0.01524%0.239CC..Hα-helixtrans-54.9-31.8-178.368.5-101.3000114.1P32 I36 F39 R113 I121 C181 L188 L189P32-W185 HydrophobicContact CB-CB 3.64Å; I36-W185 HydrophobicContact CD1-CE3 4.15Å; I36-W185 HydrophobicContact CD1-CZ3 4.46Å; I36-W185 HydrophobicContact CG1-CD2 4.22Å; I36-W185 HydrophobicContact CG1-CE3 3.87Å; I36-W185 HydrophobicContact CG1-CZ3 4.15Å; F39-W185 HydrophobicContact CD1-CH2 4.22Å; F39-W185 HydrophobicContact CD1-CZ2 4.2Å; F39-W185 HydrophobicContact CD2-CZ2 4.43Å; F39-W185 HydrophobicContact CE1-CH2 4.34Å; F39-W185 HydrophobicContact CG-CZ2 4.13Å; R113-W185 HydrophobicContact CB-CZ2 4.21Å; R113-W185 HydrophobicContact CG-CZ2 4.43Å; I121-W185 HydrophobicContact CD1-CH2 3.7Å; I121-W185 HydrophobicContact CD1-CZ3 3.79Å; C181-W185 PolarHBondContact O-N 3.41Å; C181-W185 VanDerWaalsContact O-N 3.08Å; W185-L188 WeakPolarHBondContact O-CB 3.18Å; W185-L188 PolarHBondContact O-N 2.95Å; W185-L189 HydrophobicContact CE3-CD1 3.86Å; W185-L189 HydrophobicContact CZ3-CD1 3.83Å; W185-L189 PolarHBondContact O-N 3.48Å
186Q90Very high88.6Confident23 Ų2346.2 Ų46.211%0.10723%0.234CC..Hα-helixtrans-66.1-37.1174.966.7-158.211.800112.7C184 L189 A190C184-Q186 PolarHBondContact O-N 3.46Å; Q186-L189 PolarHBondContact O-N 3.42Å; Q186-A190 WeakPolarHBondContact O-CB 3.46Å; Q186-A190 PolarHBondContact O-N 2.91Å
187Y91.9Very high88.7Confident118 Ų11844.3 Ų44.346%0.46323%0.23SC..Hα-helixtrans-72.9-33.6174.7-58.4-71.4000110.7L110 C184 A190 S191L110-Y187 HydrophobicContact CD1-CD1 3.48Å; L110-Y187 VanDerWaalsContact CD1-CD1 3.48Å; L110-Y187 HydrophobicContact CD1-CE1 3.47Å; L110-Y187 VanDerWaalsContact CD1-CE1 3.47Å; L110-Y187 HydrophobicContact CD1-CG 4.44Å; C184-Y187 HydrophobicContact CB-CD2 4.1Å; C184-Y187 WeakPolarHBondContact O-CA 3.49Å; C184-Y187 WeakPolarHBondContact O-CB 3.14Å; C184-Y187 PolarHBondContact O-N 3.31Å; Y187-A190 CarbonylContact O-C 3.56Å; Y187-A190 PolarHBondContact O-N 2.68Å; Y187-S191 WeakPolarHBondContact O-CB 3.42Å; Y187-S191 PolarHBondContact O-N 2.8Å
188L91.9Very high89Confident0 Ų041.7 Ų41.70%022%0.219CC..Hα-helixtrans-58.3-48170.8177.262.2000110.8I28 A31 P32 V173 L179 C184 W185 A190 S191I28-L188 HydrophobicContact CB-CG 4.5Å; I28-L188 HydrophobicContact CG2-CD1 4.27Å; A31-L188 HydrophobicContact CB-CD2 4.2Å; P32-L188 HydrophobicContact CG-CD2 4.13Å; V173-L188 HydrophobicContact CB-CD1 4.28Å; V173-L188 HydrophobicContact CG1-CD1 3.7Å; L179-L188 HydrophobicContact CB-CB 3.92Å; L179-L188 HydrophobicContact CB-CD1 4.14Å; C184-L188 PolarHBondContact O-N 3.28Å; W185-L188 WeakPolarHBondContact O-CB 3.18Å; W185-L188 PolarHBondContact O-N 2.95Å; L188-A190 PolarHBondContact O-N 3.05Å; L188-S191 WeakPolarHBondContact O-CB 3.34Å; L188-S191 PolarHBondContact O-N 3.28Å; L188-S191 PolarHBondContact O-OG 2.83Å
189L90.4Very high88.9Confident6 Ų637.7 Ų37.73%0.03120%0.198CC..Hα-helixtrans-65.6-38.5176.5-64.4-179.9000112.5I28 M29 I36 A109 I121 W185 Q186 S191I28-L189 HydrophobicContact CD1-CD2 4.17Å; I28-L189 HydrophobicContact CG1-CD2 4.34Å; M29-L189 HydrophobicContact SD-CD2 3.61Å; I36-L189 HydrophobicContact CD1-CD1 4.27Å; A109-L189 HydrophobicContact CB-CB 3.71Å; A109-L189 HydrophobicContact CB-CD1 4.4Å; I121-L189 HydrophobicContact CG2-CD1 4.4Å; W185-L189 HydrophobicContact CE3-CD1 3.86Å; W185-L189 HydrophobicContact CZ3-CD1 3.83Å; W185-L189 PolarHBondContact O-N 3.48Å; Q186-L189 PolarHBondContact O-N 3.42Å; L189-S191 VanDerWaalsContact C-N 3.34Å; L189-S191 PolarHBondContact O-N 2.93Å
190A91.9Very high88.9Confident16 Ų1638.3 Ų38.313%0.13220%0.202CC..Hα-helixtrans-73.8-21.3178.900000113.9L110 Q186 Y187 L188 N192 A193L110-A190 HydrophobicContact CB-CB 4.06Å; L110-A190 HydrophobicContact CD1-CB 4.4Å; Q186-A190 WeakPolarHBondContact O-CB 3.46Å; Q186-A190 PolarHBondContact O-N 2.91Å; Y187-A190 CarbonylContact O-C 3.56Å; Y187-A190 PolarHBondContact O-N 2.68Å; L188-A190 PolarHBondContact O-N 3.05Å; A190-N192 PolarHBondContact O-N 3.28Å; A190-A193 VanDerWaalsContact O-CB 3.28Å; A190-A193 WeakPolarHBondContact O-CB 3.48Å; A190-A193 PolarHBondContact O-N 2.99Å
191S92.6Very high89.2Confident12 Ų1242.5 Ų42.58%0.08422%0.223CC..THydrogen-bonded Turntrans-59.9-21-177.768.20000113.8Y24 Y187 L188 L189 A193 I194 P195Y24-S191 PolarHBondContact OH-OG 3.47Å; Y187-S191 WeakPolarHBondContact O-CB 3.42Å; Y187-S191 PolarHBondContact O-N 2.8Å; L188-S191 WeakPolarHBondContact O-CB 3.34Å; L188-S191 PolarHBondContact O-N 3.28Å; L188-S191 PolarHBondContact O-OG 2.83Å; L189-S191 VanDerWaalsContact C-N 3.34Å; L189-S191 PolarHBondContact O-N 2.93Å; S191-A193 PolarHBondContact O-N 3.45Å; S191-A193 VanDerWaalsContact O-N 3.11Å; S191-I194 WeakPolarHBondContact O-CB 3.37Å; S191-I194 WeakPolarHBondContact O-CG1 3.45Å; S191-I194 PolarHBondContact O-N 3.47Å; S191-P195 WeakPolarHBondContact O-CD 3.29Å
192N87.8Confident89.3Confident0 Ų042.8 Ų42.80%022%0.224CC..THydrogen-bonded Turntrans-60.7-17.3172.6-173.431.2000113.2Y24 N25 L102 A190 I194 P195Y24-N192 HydrophobicContact CD1-CB 3.98Å; Y24-N192 HydrophobicContact CE1-CB 3.96Å; N25-N192 VanDerWaalsContact CG-ND2 3.31Å; N25-N192 VanDerWaalsContact ND2-CG 3.29Å; N25-N192 PolarHBondContact ND2-ND2 2.84Å; N25-N192 PolarHBondContact ND2-OD1 3.43Å; N25-N192 PolarHBondContact OD1-ND2 3.28Å; L102-N192 HydrophobicContact CD1-CB 4.3Å; L102-N192 VanDerWaalsContact CD1-CG 3.47Å; L102-N192 WeakPolarHBondContact CD1-ND2 3.06Å; A190-N192 PolarHBondContact O-N 3.28Å; N192-I194 PolarHBondContact O-N 2.84Å; N192-P195 WeakPolarHBondContact O-CD 3.3Å
193A89.9Confident89.3Confident23 Ų2337.3 Ų37.319%0.1920%0.199CC..Hα-helixtrans-63.7-27.1170.100000113.1M103 A106 A190 S191 G196 F197M103-A193 HydrophobicContact SD-CB 3.85Å; A106-A193 HydrophobicContact CB-CB 3.87Å; A190-A193 VanDerWaalsContact O-CB 3.28Å; A190-A193 WeakPolarHBondContact O-CB 3.48Å; A190-A193 PolarHBondContact O-N 2.99Å; S191-A193 PolarHBondContact O-N 3.45Å; S191-A193 VanDerWaalsContact O-N 3.11Å; A193-G196 PolarHBondContact O-N 2.97Å; A193-F197 WeakPolarHBondContact O-CB 3.27Å; A193-F197 PolarHBondContact O-N 2.98Å
194I91.8Very high89.3Confident107 Ų10736.7 Ų36.755%0.54919%0.193SC..Hα-helixtrans-65.5-54.4-175.9-61.6167.6000111.2S191 N192 G196 F197 I198S191-I194 WeakPolarHBondContact O-CB 3.37Å; S191-I194 WeakPolarHBondContact O-CG1 3.45Å; S191-I194 PolarHBondContact O-N 3.47Å; N192-I194 PolarHBondContact O-N 2.84Å; I194-G196 PolarHBondContact O-N 3.36Å; I194-F197 PolarHBondContact O-N 2.85Å; I194-I198 HydrophobicContact CG2-CD1 4.13Å; I194-I198 WeakPolarHBondContact O-CG1 3.47Å; I194-I198 PolarHBondContact O-N 2.99Å
195P88.8Confident89.2Confident11 Ų1143.1 Ų43.17%0.07121%0.213CC..Hα-helixtrans-55.9-36.8173.1-25.132.2000113.3I16 L20 Q21 S191 N192 I198 Q199I16-P195 HydrophobicContact CG2-CB 3.91Å; I16-P195 WeakPolarHBondContact O-CB 3.36Å; L20-P195 HydrophobicContact CD2-CB 4.33Å; L20-P195 HydrophobicContact CD2-CG 4.24Å; Q21-P195 HydrophobicContact CG-CB 4.03Å; S191-P195 WeakPolarHBondContact O-CD 3.29Å; N192-P195 WeakPolarHBondContact O-CD 3.3Å; P195-I198 PolarHBondContact O-N 3.49Å; P195-Q199 PolarHBondContact O-N 3.23Å
196G87.8Confident88.9Confident0 Ų044.1 Ų44.10%022%0.218CC..Hα-helixtrans-64.8-43177.100000113.7Q21 N99 L102 A193 I194 I198 Q199 L200Q21-G196 VanDerWaalsContact NE2-N 3.12Å; N99-G196 WeakPolarHBondContact OD1-CA 3.37Å; N99-G196 PolarHBondContact OD1-O 3.37Å; L102-G196 VanDerWaalsContact CD2-CA 3.48Å; A193-G196 PolarHBondContact O-N 2.97Å; I194-G196 PolarHBondContact O-N 3.36Å; G196-I198 VanDerWaalsContact C-N 3.34Å; G196-Q199 PolarHBondContact O-N 3.41Å; G196-L200 WeakPolarHBondContact O-CG 3.42Å; G196-L200 PolarHBondContact O-N 2.83Å
197F89.6Confident88.5Confident112 Ų11243.8 Ų43.849%0.49122%0.217SC..Hα-helixtrans-63.9-41.1175.3-169.5-104.8000111.8M103 A193 I194 Q199 L200 L201M103-F197 HydrophobicContact CE-CB 4.01Å; M103-F197 HydrophobicContact CE-CD2 3.93Å; M103-F197 HydrophobicContact CE-CG 4.48Å; A193-F197 WeakPolarHBondContact O-CB 3.27Å; A193-F197 PolarHBondContact O-N 2.98Å; I194-F197 PolarHBondContact O-N 2.85Å; F197-Q199 VanDerWaalsContact C-N 3.31Å; F197-Q199 PolarHBondContact O-N 3.24Å; F197-L200 WeakPolarHBondContact O-CB 3Å; F197-L200 PolarHBondContact O-N 3.03Å; F197-L201 HydrophobicContact CD1-CD1 3.85Å; F197-L201 HydrophobicContact CD1-CG 4.35Å; F197-L201 HydrophobicContact CE1-CD1 3.41Å; F197-L201 VanDerWaalsContact CE1-CD1 3.41Å; F197-L201 HydrophobicContact CE1-CG 4.05Å; F197-L201 HydrophobicContact CZ-CD1 4.01Å; F197-L201 HydrophobicContact CZ-CD2 4.37Å; F197-L201 HydrophobicContact CZ-CG 4.28Å; F197-L201 WeakPolarHBondContact O-CG 3.42Å; F197-L201 PolarHBondContact O-N 3.43Å
198I90.6Very high88Confident67 Ų6738.5 Ų38.534%0.34420%0.197SC..Hα-helixtrans-59.7-44.2174.2-65.9168000110.4I16 I194 P195 G196 L201 T202I16-I198 HydrophobicContact CD1-CG2 4.32Å; I16-I198 HydrophobicContact CG2-CB 4.15Å; I16-I198 HydrophobicContact CG2-CG2 4Å; I194-I198 HydrophobicContact CG2-CD1 4.13Å; I194-I198 WeakPolarHBondContact O-CG1 3.47Å; I194-I198 PolarHBondContact O-N 2.99Å; P195-I198 PolarHBondContact O-N 3.49Å; G196-I198 VanDerWaalsContact C-N 3.34Å; I198-L201 PolarHBondContact O-N 3.44Å; I198-T202 HydrophobicContact CG2-CG2 4.17Å; I198-T202 WeakPolarHBondContact O-CB 3.49Å; I198-T202 VanDerWaalsContact O-CG2 3.29Å; I198-T202 WeakPolarHBondContact O-CG2 3.15Å; I198-T202 PolarHBondContact O-N 2.87Å; I198-T202 PolarHBondContact O-OG1 3.38Å
199Q88.3Confident87.5Confident0 Ų038.5 Ų38.50%020%0.197CC..Hα-helixtrans-64.4-42.2176.7-169.9-170.339.200111.9A14 G17 N99 P195 G196 F197 L201 T202 L203A14-Q199 PolarHBondContact O-NE2 3.12Å; G17-Q199 PolarHBondContact O-OE1 3.43Å; G17-Q199 VanDerWaalsContact O-OE1 3.14Å; N99-Q199 PolarHBondContact ND2-OE1 3.47Å; N99-Q199 PolarHBondContact OD1-OE1 3.35Å; P195-Q199 PolarHBondContact O-N 3.23Å; G196-Q199 PolarHBondContact O-N 3.41Å; F197-Q199 VanDerWaalsContact C-N 3.31Å; F197-Q199 PolarHBondContact O-N 3.24Å; Q199-L201 VanDerWaalsContact C-N 3.27Å; Q199-L201 PolarHBondContact O-N 3.16Å; Q199-T202 PolarHBondContact O-N 3.47Å; Q199-L203 HydrophobicContact CG-CB 4.14Å; Q199-L203 HydrophobicContact CG-CD2 4.17Å; Q199-L203 WeakPolarHBondContact O-CB 3.38Å; Q199-L203 PolarHBondContact O-N 3.25Å
200L88.3Confident87Confident57 Ų5738.2 Ų38.230%0.29820%0.195SC..Hα-helixtrans-58.2-37.9176.4-80168.9000112.5L96 N99 M103 G196 F197 P204L96-L200 HydrophobicContact CD2-CD2 3.91Å; N99-L200 HydrophobicContact CB-CD1 3.94Å; N99-L200 HydrophobicContact CB-CD2 3.94Å; N99-L200 HydrophobicContact CB-CG 3.86Å; M103-L200 HydrophobicContact CE-CD1 3.94Å; G196-L200 WeakPolarHBondContact O-CG 3.42Å; G196-L200 PolarHBondContact O-N 2.83Å; F197-L200 WeakPolarHBondContact O-CB 3Å; F197-L200 PolarHBondContact O-N 3.03Å; L200-P204 WeakPolarHBondContact O-CD 3.39Å; L200-P204 WeakPolarHBondContact O-CG 3.46Å
201L88.4Confident86.4Confident88 Ų8838.8 Ų38.846%0.46119%0.194SC..Hα-helixtrans-77.4-41.8177.4-68.1179.6000112.7F197 I198 Q199 W205F197-L201 HydrophobicContact CD1-CD1 3.85Å; F197-L201 HydrophobicContact CD1-CG 4.35Å; F197-L201 HydrophobicContact CE1-CD1 3.41Å; F197-L201 VanDerWaalsContact CE1-CD1 3.41Å; F197-L201 HydrophobicContact CE1-CG 4.05Å; F197-L201 HydrophobicContact CZ-CD1 4.01Å; F197-L201 HydrophobicContact CZ-CD2 4.37Å; F197-L201 HydrophobicContact CZ-CG 4.28Å; F197-L201 WeakPolarHBondContact O-CG 3.42Å; F197-L201 PolarHBondContact O-N 3.43Å; I198-L201 PolarHBondContact O-N 3.44Å; Q199-L201 VanDerWaalsContact C-N 3.27Å; Q199-L201 PolarHBondContact O-N 3.16Å; L201-W205 VanDerWaalsContact O-CE3 3.31Å; L201-W205 WeakPolarHBondContact O-CZ3 3.27Å
202T87.2Confident85.7Confident35 Ų3539.1 Ų39.122%0.21519%0.193CC..Hα-helixtrans-87.4-39.5-168.155.40000113.7S13 I198 Q199 P204 W205 F206S13-T202 VanDerWaalsContact OG-CB 3.28Å; S13-T202 WeakPolarHBondContact OG-CB 3.49Å; S13-T202 PolarHBondContact OG-OG1 3.24Å; I198-T202 HydrophobicContact CG2-CG2 4.17Å; I198-T202 WeakPolarHBondContact O-CB 3.49Å; I198-T202 VanDerWaalsContact O-CG2 3.29Å; I198-T202 WeakPolarHBondContact O-CG2 3.15Å; I198-T202 PolarHBondContact O-N 2.87Å; I198-T202 PolarHBondContact O-OG1 3.38Å; Q199-T202 PolarHBondContact O-N 3.47Å; T202-P204 VanDerWaalsContact C-CD 3.44Å; T202-W205 HydrophobicContact CG2-CZ3 4.29Å; T202-W205 PolarHBondContact O-N 3.38Å; T202-F206 VanDerWaalsContact O-CD2 3.31Å; T202-F206 WeakPolarHBondContact O-CD2 3.35Å; T202-F206 WeakPolarHBondContact O-CE2 3.48Å
203L84.2Confident85.2Confident0 Ų039.7 Ų39.70%020%0.197CC..G310 helixtrans-63-34.8-174.9-165.267.3000113.6S13 A14 K92 L95 L96 Q199 W205 F206S13-L203 PolarHBondContact OG-N 3.26Å; A14-L203 HydrophobicContact CB-CD1 4.05Å; K92-L203 WeakPolarHBondContact CE-O 3.47Å; K92-L203 HydrophobicContact CG-CD2 4.22Å; K92-L203 HydrophobicContact CG-CG 4.09Å; K92-L203 PolarHBondContact NZ-O 3.49Å; L95-L203 HydrophobicContact CB-CD2 3.75Å; L95-L203 HydrophobicContact CD1-CD2 4.13Å; L96-L203 HydrophobicContact CD2-CB 4.22Å; L96-L203 HydrophobicContact CD2-CD2 4.25Å; L96-L203 HydrophobicContact CG-CD2 4.22Å; Q199-L203 HydrophobicContact CG-CB 4.14Å; Q199-L203 HydrophobicContact CG-CD2 4.17Å; Q199-L203 WeakPolarHBondContact O-CB 3.38Å; Q199-L203 PolarHBondContact O-N 3.25Å; L203-W205 PolarHBondContact O-N 2.91Å; L203-W205 VanDerWaalsContact O-N 3.13Å; L203-F206 PolarHBondContact O-N 3Å; L203-F206 VanDerWaalsContact O-N 3.15Å
204P86.2Confident84.8Confident60 Ų6038.8 Ų38.839%0.3919%0.189SC..G310 helixtrans-54.4-27.3174.2-30.338.8000115.4K92 L96 L200 T202K92-P204 VanDerWaalsContact NZ-C 3.27Å; K92-P204 PolarHBondContact NZ-O 3.32Å; L96-P204 HydrophobicContact CD1-CG 4.37Å; L96-P204 HydrophobicContact CD2-CG 4.26Å; L200-P204 WeakPolarHBondContact O-CD 3.39Å; L200-P204 WeakPolarHBondContact O-CG 3.46Å; T202-P204 VanDerWaalsContact C-CD 3.44Å
205W85.1Confident83.9Confident167 Ų16735.5 Ų35.563%0.63317%0.171SC*.G310 helixtrans-77.4-19.3-179.6-69.1-53.4000114.1L201 T202 L203 R229L201-W205 VanDerWaalsContact O-CE3 3.31Å; L201-W205 WeakPolarHBondContact O-CZ3 3.27Å; T202-W205 HydrophobicContact CG2-CZ3 4.29Å; T202-W205 PolarHBondContact O-N 3.38Å; L203-W205 PolarHBondContact O-N 2.91Å; L203-W205 VanDerWaalsContact O-N 3.13Å; W205-R229 PolarHBondContact O-NH1 3.43Å; W205-R229 PolarHBondContact O-NH2 3.17Å
206F83.8Confident83.1Confident25 Ų2540 Ų4011%0.1120%0.195CC..SBendtrans-88.5150.8-176.3-63.7-74.4000113T6 L9 M10 K92 T202 L203T6-F206 HydrophobicContact CG2-CD1 4.37Å; T6-F206 HydrophobicContact CG2-CE1 4.41Å; L9-F206 HydrophobicContact CB-CE1 3.8Å; L9-F206 HydrophobicContact CB-CZ 3.69Å; M10-F206 HydrophobicContact CB-CB 4.28Å; M10-F206 HydrophobicContact CB-CD1 3.48Å; M10-F206 VanDerWaalsContact CB-CD1 3.48Å; M10-F206 HydrophobicContact CB-CD2 4.44Å; M10-F206 HydrophobicContact CB-CE1 3.89Å; M10-F206 HydrophobicContact CB-CG 3.79Å; M10-F206 HydrophobicContact CG-CB 3.94Å; M10-F206 HydrophobicContact CG-CD1 4.12Å; M10-F206 HydrophobicContact CG-CG 3.96Å; K92-F206 PolarHBondContact NZ-O 3.17Å; T202-F206 VanDerWaalsContact O-CD2 3.31Å; T202-F206 WeakPolarHBondContact O-CD2 3.35Å; T202-F206 WeakPolarHBondContact O-CE2 3.48Å; L203-F206 PolarHBondContact O-N 3Å; L203-F206 VanDerWaalsContact O-N 3.15Å
207P81.4Confident82.4Confident15 Ų1547.8 Ų47.810%0.09723%0.225CC..PPolyproline II helixtrans-69.6161178.130.8-34.8000111.6Y142 A226 R229 L230Y142-P207 PolarHBondContact OH-O 2.89Å; P207-A226 HydrophobicContact CB-CB 4.03Å; P207-R229 HydrophobicContact CG-CB 4.39Å; P207-R229 HydrophobicContact CG-CG 4.45Å; P207-L230 HydrophobicContact CG-CD1 4.32Å; P207-L230 HydrophobicContact CG-CD2 3.68Å; P207-L230 HydrophobicContact CG-CG 3.68Å
208E82.1Confident81.8Confident7 Ų744.8 Ų44.83%0.03323%0.225CC..PPolyproline II helixtrans-70.5165.1173.3-159.257.7-145.500112Q90 R91 K92 P210 Y212 L213Q90-E208 VanDerWaalsContact C-OE1 3.29Å; Q90-E208 WeakPolarHBondContact CA-OE1 3.4Å; Q90-E208 HydrophobicContact CB-CG 4.16Å; Q90-E208 WeakPolarHBondContact CB-OE1 3.26Å; Q90-E208 WeakPolarHBondContact CB-OE2 3.5Å; Q90-E208 HydrophobicContact CG-CG 3.6Å; Q90-E208 VanDerWaalsContact CG-OE2 3.23Å; Q90-E208 WeakPolarHBondContact CG-OE2 3.46Å; Q90-E208 PolarHBondContact NE2-OE2 3.08Å; R91-E208 PolarHBondContact N-OE1 3.42Å; K92-E208 WeakPolarHBondContact CB-OE2 2.97Å; K92-E208 PolarHBondContact N-OE1 3.31Å; E208-P210 VanDerWaalsContact O-CD 3.29Å; E208-P210 WeakPolarHBondContact O-CD 3.34Å; E208-Y212 HydrophobicContact CG-CD1 4Å; E208-L213 HydrophobicContact CB-CD1 4.04Å; E208-L213 HydrophobicContact CB-CD2 4.31Å; E208-L213 HydrophobicContact CB-CG 4.15Å; E208-L213 HydrophobicContact CG-CD2 4.47Å; E208-L213 HydrophobicContact CG-CG 4.45Å
209S82.1Confident81.5Confident0 Ų043.8 Ų43.80%022%0.221CC..PPolyproline II helixtrans-51118.7167.2164.90000110.8E145 R211 Y212 L213E145-S209 WeakPolarHBondContact CB-OG 3.33Å; E145-S209 WeakPolarHBondContact OE2-CB 3.47Å; E145-S209 PolarHBondContact OE2-OG 3.05Å; S209-R211 VanDerWaalsContact C-N 3.28Å; S209-R211 PolarHBondContact O-N 3.23Å; S209-Y212 PolarHBondContact O-N 3.07Å; S209-Y212 PolarHBondContact OG-N 2.68Å; S209-L213 WeakPolarHBondContact O-CG 3.47Å; S209-L213 PolarHBondContact O-N 3.38Å; S209-L213 VanDerWaalsContact O-N 3.14Å
210P80.1Confident81.3Confident0 Ų048.7 Ų48.70%024%0.242CC..Hα-helixtrans-62.8-35.4178.7-21.832.2000112.9E208 L213 L214 C223 A226 L227 L230E208-P210 VanDerWaalsContact O-CD 3.29Å; E208-P210 WeakPolarHBondContact O-CD 3.34Å; P210-L213 PolarHBondContact O-N 2.82Å; P210-L214 PolarHBondContact O-N 3.11Å; P210-C223 PolarHBondContact O-SG 3.24Å; P210-C223 VanDerWaalsContact O-SG 3.38Å; P210-A226 HydrophobicContact CB-CB 4.33Å; P210-A226 HydrophobicContact CG-CB 4.03Å; P210-L227 HydrophobicContact CB-CD2 3.81Å; P210-L227 HydrophobicContact CB-CG 3.78Å; P210-L227 HydrophobicContact CG-CD2 3.78Å; P210-L227 HydrophobicContact CG-CG 4.08Å; P210-L230 HydrophobicContact CG-CD1 3.62Å
211R78.8Confident81.2Confident28 Ų2853.2 Ų53.211%0.10626%0.261CS..Hα-helixtrans-66.2-42.5177.6-72.8-172.7161.3154.7-16.2112.3G144 E145 R152 S209 L213 L214 I215 I243 E246G144-R211 PolarHBondContact O-NH1 3.48Å; G144-R211 VanDerWaalsContact O-NH1 3.14Å; E145-R211 HydrophobicContact CB-CB 4.14Å; E145-R211 HydrophobicContact CB-CG 4.38Å; E145-R211 HydrophobicContact CG-CB 4.15Å; R152-R211 VanDerWaalsContact CZ-NH2 3.27Å; R152-R211 VanDerWaalsContact NH2-NH1 3.2Å; S209-R211 VanDerWaalsContact C-N 3.28Å; S209-R211 PolarHBondContact O-N 3.23Å; R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 PolarHBondContact O-N 3.22Å; R211-L214 PolarHBondContact O-N 2.99Å; R211-I215 HydrophobicContact CB-CD1 4.24Å; R211-I215 VanDerWaalsContact O-CB 3.25Å; R211-I215 WeakPolarHBondContact O-CB 3.32Å; R211-I215 WeakPolarHBondContact O-CG1 3.23Å; R211-I215 PolarHBondContact O-N 2.86Å; R211-I243 HydrophobicContact CG-CD1 4.48Å; R211-I243 HydrophobicContact CG-CG1 4.45Å; R211-I243 HydrophobicContact CG-CG2 4.16Å; R211-E246 IonicContact CZ-OE2 3.02Å; R211-E246 IonicContact NE-OE2 3.2Å; R211-E246 PolarHBondContact NE-OE2 3.39Å; R211-E246 IonicContact NH2-OE2 3.15Å; R211-E246 PolarHBondContact NH2-OE2 2.71Å
212Y76.4Confident81Confident19 Ų1950 Ų508%0.07525%0.248CC..Iπ-helixtrans-59.2-44.7173.1172.4-95.4000111.2Q90 E208 S209 L214 D216 R217Q90-Y212 HydrophobicContact CG-CE1 4.17Å; E208-Y212 HydrophobicContact CG-CD1 4Å; S209-Y212 PolarHBondContact O-N 3.07Å; S209-Y212 PolarHBondContact OG-N 2.68Å; Y212-L214 VanDerWaalsContact C-N 3.32Å; Y212-L214 PolarHBondContact O-N 3.15Å; Y212-D216 HydrophobicContact CD2-CB 3.93Å; Y212-D216 WeakPolarHBondContact CD2-OD2 3.49Å; Y212-D216 HydrophobicContact CE2-CB 4.03Å; Y212-D216 WeakPolarHBondContact O-CB 3.42Å; Y212-D216 PolarHBondContact O-N 3.27Å; Y212-D216 VanDerWaalsContact O-N 3.16Å; Y212-R217 PolarHBondContact O-N 3.41Å
213L78.8Confident80.9Confident13 Ų1348.4 Ų48.47%0.06824%0.238CC..Iπ-helixtrans-61.6-38179.2-68172.2000112.7E208 S209 P210 R211 R217 G218 D219 A222 C223 A226E208-L213 HydrophobicContact CB-CD1 4.04Å; E208-L213 HydrophobicContact CB-CD2 4.31Å; E208-L213 HydrophobicContact CB-CG 4.15Å; E208-L213 HydrophobicContact CG-CD2 4.47Å; E208-L213 HydrophobicContact CG-CG 4.45Å; S209-L213 WeakPolarHBondContact O-CG 3.47Å; S209-L213 PolarHBondContact O-N 3.38Å; S209-L213 VanDerWaalsContact O-N 3.14Å; P210-L213 PolarHBondContact O-N 2.82Å; R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 PolarHBondContact O-N 3.22Å; L213-R217 WeakPolarHBondContact O-CB 3.36Å; L213-G218 PolarHBondContact O-N 3Å; L213-D219 PolarHBondContact O-N 3.17Å; L213-A222 HydrophobicContact CD1-CB 4.02Å; L213-A222 HydrophobicContact CD2-CB 4.21Å; L213-A222 HydrophobicContact CG-CB 4.49Å; L213-C223 HydrophobicContact CB-CB 4.28Å; L213-A226 HydrophobicContact CD1-CB 3.86Å
214L79.9Confident80.9Confident4 Ų450.1 Ų50.12%0.02125%0.247CC..Iπ-helixtrans-86.5-49.4-179.5-166.968.3000113.4P210 R211 Y212 G218 K220 C223 L240 I243 L244 Q247P210-L214 PolarHBondContact O-N 3.11Å; R211-L214 PolarHBondContact O-N 2.99Å; Y212-L214 VanDerWaalsContact C-N 3.32Å; Y212-L214 PolarHBondContact O-N 3.15Å; L214-G218 WeakPolarHBondContact O-CA 3.45Å; L214-G218 PolarHBondContact O-N 3.27Å; L214-G218 VanDerWaalsContact O-N 3.11Å; L214-K220 HydrophobicContact CD1-CB 3.81Å; L214-K220 HydrophobicContact CD1-CG 4.03Å; L214-C223 HydrophobicContact CB-CB 3.94Å; L214-C223 HydrophobicContact CD1-CB 4.31Å; L214-L240 HydrophobicContact CD2-CD1 4.24Å; L214-I243 HydrophobicContact CB-CG2 4.19Å; L214-I243 HydrophobicContact CD2-CB 3.94Å; L214-I243 HydrophobicContact CD2-CG2 3.52Å; L214-I243 HydrophobicContact CG-CG2 4.38Å; L214-L244 HydrophobicContact CD1-CD2 4.4Å; L214-L244 HydrophobicContact CD2-CD2 3.84Å; L214-L244 HydrophobicContact CD2-CG 4.07Å; L214-L244 HydrophobicContact CG-CD2 4.45Å; L214-Q247 PolarHBondContact O-NE2 3.13Å
215I73.9Confident80.9Confident37 Ų3751.8 Ų51.819%0.1925%0.253CS..Iπ-helixtrans-75.5-51.5-170.9-60.8176.4000110.6R211 I243 E246 Q247R211-I215 HydrophobicContact CB-CD1 4.24Å; R211-I215 VanDerWaalsContact O-CB 3.25Å; R211-I215 WeakPolarHBondContact O-CB 3.32Å; R211-I215 WeakPolarHBondContact O-CG1 3.23Å; R211-I215 PolarHBondContact O-N 2.86Å; I215-I243 HydrophobicContact CD1-CG2 4.26Å; I215-I243 HydrophobicContact CG1-CG2 4.17Å; I215-E246 HydrophobicContact CD1-CB 4.46Å; I215-E246 HydrophobicContact CD1-CG 4.08Å; I215-Q247 HydrophobicContact CG1-CB 4.08Å; I215-Q247 HydrophobicContact CG1-CG 4.46Å
216D71.1Confident80.9Confident107 Ų10744.1 Ų44.157%0.57222%0.224SC*.Iπ-helixtrans-85.3-41-174.1-61.4-46.5000112Y212Y212-D216 HydrophobicContact CD2-CB 3.93Å; Y212-D216 WeakPolarHBondContact CD2-OD2 3.49Å; Y212-D216 HydrophobicContact CE2-CB 4.03Å; Y212-D216 WeakPolarHBondContact O-CB 3.42Å; Y212-D216 PolarHBondContact O-N 3.27Å; Y212-D216 VanDerWaalsContact O-N 3.16Å
217R74Confident80.9Confident163 Ų16343 Ų4362%0.61522%0.22SC*.THydrogen-bonded Turntrans-92.4-21.7-177.3-158.6-166.9-176.1-1565.6113.9Y212 L213 D219Y212-R217 PolarHBondContact O-N 3.41Å; L213-R217 WeakPolarHBondContact O-CB 3.36Å; R217-D219 VanDerWaalsContact C-N 3.26Å; R217-D219 HydrophobicContact CB-CB 4.46Å; R217-D219 HydrophobicContact CG-CB 4.35Å; R217-D219 IonicContact CZ-OD2 3.62Å; R217-D219 IonicContact NH1-OD2 2.72Å; R217-D219 PolarHBondContact NH1-OD2 3.08Å; R217-D219 PolarHBondContact O-N 3.22Å
218G77.4Confident81.1Confident49 Ų4947.6 Ų47.651%0.50524%0.235SC..  trans73.212.7-175.300000114.7L213 L214 K220L213-G218 PolarHBondContact O-N 3Å; L214-G218 WeakPolarHBondContact O-CA 3.45Å; L214-G218 PolarHBondContact O-N 3.27Å; L214-G218 VanDerWaalsContact O-N 3.11Å; G218-K220 PolarHBondContact O-N 2.95Å
219D83.7Confident81.2Confident46 Ų4653.7 Ų53.725%0.24626%0.258CS..  trans-94.493.3-173-171.7-16.3000111.3L213 R217 E221 A222 C223L213-D219 PolarHBondContact O-N 3.17Å; R217-D219 VanDerWaalsContact C-N 3.26Å; R217-D219 HydrophobicContact CB-CB 4.46Å; R217-D219 HydrophobicContact CG-CB 4.35Å; R217-D219 IonicContact CZ-OD2 3.62Å; R217-D219 IonicContact NH1-OD2 2.72Å; R217-D219 PolarHBondContact NH1-OD2 3.08Å; R217-D219 PolarHBondContact O-N 3.22Å; D219-E221 PolarHBondContact OD1-N 2.93Å; D219-A222 HydrophobicContact CB-CB 4.14Å; D219-A222 WeakPolarHBondContact OD1-CB 3.43Å; D219-A222 PolarHBondContact OD1-N 3.49Å; D219-A222 VanDerWaalsContact OD2-CB 3.27Å; D219-A222 WeakPolarHBondContact OD2-CB 3.36Å; D219-C223 WeakPolarHBondContact O-CB 3.25Å; D219-C223 PolarHBondContact O-N 3.44Å; D219-C223 VanDerWaalsContact O-N 3.16Å
220K85.2Confident81.2Confident102 Ų10253.8 Ų53.844%0.44326%0.258SS..Hα-helixtrans-67.7-37.2-177.1-170176-179177.30113L214 G218 C223 I224L214-K220 HydrophobicContact CD1-CB 3.81Å; L214-K220 HydrophobicContact CD1-CG 4.03Å; G218-K220 PolarHBondContact O-N 2.95Å; K220-C223 PolarHBondContact O-N 3.05Å; K220-I224 HydrophobicContact CG-CD1 4.11Å; K220-I224 WeakPolarHBondContact O-CG1 3.45Å; K220-I224 PolarHBondContact O-N 2.94Å
221E85.8Confident81.3Confident152 Ų15255.5 Ų55.571%0.7127%0.265SS*.Hα-helixtrans-70.4-43.9-178.2-66-174.7178.400111.4D219 C223 I224 N225D219-E221 PolarHBondContact OD1-N 2.93Å; E221-C223 VanDerWaalsContact C-N 3.31Å; E221-C223 PolarHBondContact O-N 3.35Å; E221-I224 PolarHBondContact O-N 3.29Å; E221-N225 WeakPolarHBondContact O-CB 3.42Å; E221-N225 PolarHBondContact O-N 3.37Å; E221-N225 PolarHBondContact O-ND2 3.18Å
222A84.4Confident81.2Confident22 Ų2255.1 Ų55.118%0.18227%0.27CS..Hα-helixtrans-62.9-38.617500000111.9L213 D219 N225 A226L213-A222 HydrophobicContact CD1-CB 4.02Å; L213-A222 HydrophobicContact CD2-CB 4.21Å; L213-A222 HydrophobicContact CG-CB 4.49Å; D219-A222 HydrophobicContact CB-CB 4.14Å; D219-A222 WeakPolarHBondContact OD1-CB 3.43Å; D219-A222 PolarHBondContact OD1-N 3.49Å; D219-A222 VanDerWaalsContact OD2-CB 3.27Å; D219-A222 WeakPolarHBondContact OD2-CB 3.36Å; A222-N225 PolarHBondContact O-N 3.47Å; A222-A226 WeakPolarHBondContact O-CB 3.49Å; A222-A226 PolarHBondContact O-N 2.84Å
223C84Confident81.3Confident0 Ų057.9 Ų57.90%029%0.291CS..Hα-helixtrans-59.9-49.5174.2177.10000111.9P210 L213 L214 D219 K220 E221 N225 A226 L227P210-C223 PolarHBondContact O-SG 3.24Å; P210-C223 VanDerWaalsContact O-SG 3.38Å; L213-C223 HydrophobicContact CB-CB 4.28Å; L214-C223 HydrophobicContact CB-CB 3.94Å; L214-C223 HydrophobicContact CD1-CB 4.31Å; D219-C223 WeakPolarHBondContact O-CB 3.25Å; D219-C223 PolarHBondContact O-N 3.44Å; D219-C223 VanDerWaalsContact O-N 3.16Å; K220-C223 PolarHBondContact O-N 3.05Å; E221-C223 VanDerWaalsContact C-N 3.31Å; E221-C223 PolarHBondContact O-N 3.35Å; C223-N225 VanDerWaalsContact C-N 3.33Å; C223-N225 PolarHBondContact O-N 2.9Å; C223-A226 PolarHBondContact O-N 3.37Å; C223-L227 WeakPolarHBondContact O-CG 3.36Å; C223-L227 PolarHBondContact O-N 3.47Å
224I85.7Confident81.3Confident37 Ų3764.2 Ų64.219%0.1932%0.32CS..Hα-helixtrans-60.7-43.4178.4-68.4166.4000110.7K220 E221 A226 L227 R228 V235 L240K220-I224 HydrophobicContact CG-CD1 4.11Å; K220-I224 WeakPolarHBondContact O-CG1 3.45Å; K220-I224 PolarHBondContact O-N 2.94Å; E221-I224 PolarHBondContact O-N 3.29Å; I224-A226 PolarHBondContact O-N 2.77Å; I224-L227 PolarHBondContact O-N 3.08Å; I224-R228 HydrophobicContact CG2-CG 4.38Å; I224-R228 WeakPolarHBondContact O-CB 3.4Å; I224-R228 WeakPolarHBondContact O-CG 3.27Å; I224-R228 PolarHBondContact O-N 3.15Å; I224-V235 HydrophobicContact CG2-CG2 4.26Å; I224-L240 HydrophobicContact CD1-CD2 4.13Å; I224-L240 HydrophobicContact CG1-CD1 4.39Å; I224-L240 HydrophobicContact CG1-CD2 4.2Å
225N85.9Confident81.2Confident95 Ų9565.3 Ų65.351%0.50833%0.327SS..Hα-helixtrans-64.7-39.6178.1-72.8-25.9000112.4E221 A222 C223 R229E221-N225 WeakPolarHBondContact O-CB 3.42Å; E221-N225 PolarHBondContact O-N 3.37Å; E221-N225 PolarHBondContact O-ND2 3.18Å; A222-N225 PolarHBondContact O-N 3.47Å; C223-N225 VanDerWaalsContact C-N 3.33Å; C223-N225 PolarHBondContact O-N 2.9Å; N225-R229 WeakPolarHBondContact O-CB 3.39Å; N225-R229 PolarHBondContact O-N 3.13Å; N225-R229 VanDerWaalsContact O-N 3.09Å
226A83.9Confident81.5Confident5 Ų570 Ų704%0.04135%0.348CS..Hα-helixtrans-64.5-45.1174.800000111.7P207 P210 L213 A222 C223 I224 R229 L230P207-A226 HydrophobicContact CB-CB 4.03Å; P210-A226 HydrophobicContact CB-CB 4.33Å; P210-A226 HydrophobicContact CG-CB 4.03Å; L213-A226 HydrophobicContact CD1-CB 3.86Å; A222-A226 WeakPolarHBondContact O-CB 3.49Å; A222-A226 PolarHBondContact O-N 2.84Å; C223-A226 PolarHBondContact O-N 3.37Å; I224-A226 PolarHBondContact O-N 2.77Å; A226-R229 PolarHBondContact O-N 2.76Å; A226-L230 WeakPolarHBondContact O-CB 3.38Å; A226-L230 WeakPolarHBondContact O-CG 3.27Å; A226-L230 PolarHBondContact O-N 2.73Å
227L84.7Confident81.9Confident2 Ų275 Ų751%0.0136%0.359CS..Hα-helixtrans-62.3-47.2176.1-73.2170.6000111.7P210 C223 I224 R229 L230 R231 V235 I243P210-L227 HydrophobicContact CB-CD2 3.81Å; P210-L227 HydrophobicContact CB-CG 3.78Å; P210-L227 HydrophobicContact CG-CD2 3.78Å; P210-L227 HydrophobicContact CG-CG 4.08Å; C223-L227 WeakPolarHBondContact O-CG 3.36Å; C223-L227 PolarHBondContact O-N 3.47Å; I224-L227 PolarHBondContact O-N 3.08Å; L227-R229 PolarHBondContact O-N 2.9Å; L227-L230 PolarHBondContact O-N 2.97Å; L227-L230 VanDerWaalsContact O-N 3.16Å; L227-R231 WeakPolarHBondContact O-CB 3.43Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.3Å; L227-R231 PolarHBondContact O-N 3.46Å; L227-V235 HydrophobicContact CB-CG1 4.13Å; L227-V235 HydrophobicContact CB-CG2 3.53Å; L227-V235 HydrophobicContact CD1-CG1 3.72Å; L227-V235 HydrophobicContact CD1-CG2 4.49Å; L227-I243 HydrophobicContact CD1-CD1 4.06Å
228R85.2Confident82.1Confident111 Ų11170.2 Ų70.242%0.41935%0.35SS..Hα-helixtrans-54.2-42.6175.4-76.9-178.1175.4154-6.8111.7I224 G232 E234 V235I224-R228 HydrophobicContact CG2-CG 4.38Å; I224-R228 WeakPolarHBondContact O-CB 3.4Å; I224-R228 WeakPolarHBondContact O-CG 3.27Å; I224-R228 PolarHBondContact O-N 3.15Å; R228-G232 VanDerWaalsContact O-CA 3.31Å; R228-G232 WeakPolarHBondContact O-CA 3.47Å; R228-G232 PolarHBondContact O-N 2.92Å; R228-E234 IonicContact NH2-OE1 3.58Å; R228-V235 HydrophobicContact CG-CG2 3.67Å
229R83.6Confident82.2Confident136 Ų13669.3 Ų69.351%0.51333%0.333SS..Hα-helixtrans-71.6-36.9-179.5-165.7171.7-174.7-158.3-5.3113T6 W205 P207 N225 A226 L227T6-R229 WeakPolarHBondContact CG2-O 3.26Å; W205-R229 PolarHBondContact O-NH1 3.43Å; W205-R229 PolarHBondContact O-NH2 3.17Å; P207-R229 HydrophobicContact CG-CB 4.39Å; P207-R229 HydrophobicContact CG-CG 4.45Å; N225-R229 WeakPolarHBondContact O-CB 3.39Å; N225-R229 PolarHBondContact O-N 3.13Å; N225-R229 VanDerWaalsContact O-N 3.09Å; A226-R229 PolarHBondContact O-N 2.76Å; L227-R229 PolarHBondContact O-N 2.9Å
230L82.3Confident82.2Confident1 Ų168.2 Ų68.21%0.00533%0.327CS..Hα-helixtrans-75.7-37.6178.9-72.8172.2000113L7 M10 P207 P210 A226 L227L7-L230 HydrophobicContact CD1-CD2 4.39Å; M10-L230 HydrophobicContact CE-CD2 3.59Å; P207-L230 HydrophobicContact CG-CD1 4.32Å; P207-L230 HydrophobicContact CG-CD2 3.68Å; P207-L230 HydrophobicContact CG-CG 3.68Å; P210-L230 HydrophobicContact CG-CD1 3.62Å; A226-L230 WeakPolarHBondContact O-CB 3.38Å; A226-L230 WeakPolarHBondContact O-CG 3.27Å; A226-L230 PolarHBondContact O-N 2.73Å; L227-L230 PolarHBondContact O-N 2.97Å; L227-L230 VanDerWaalsContact O-N 3.16Å
231R82.4Confident82.1Confident37 Ų3767.8 Ų67.814%0.1433%0.33CS..Hα-helixtrans-85.6-29.9-178.6-58.1-68.2173.2-97.9-2111.9S146 L227 C233 E239S146-R231 PolarHBondContact O-NH1 3.42Å; S146-R231 PolarHBondContact O-NH2 3.39Å; S146-R231 VanDerWaalsContact O-NH2 3.09Å; L227-R231 WeakPolarHBondContact O-CB 3.43Å; L227-R231 VanDerWaalsContact O-CG 3.24Å; L227-R231 WeakPolarHBondContact O-CG 3.3Å; L227-R231 PolarHBondContact O-N 3.46Å; R231-C233 PolarHBondContact O-N 2.91Å; R231-E239 IonicContact CZ-OE1 3.33Å; R231-E239 IonicContact NE-OE1 3.73Å; R231-E239 PolarHBondContact NE-OE1 3.32Å; R231-E239 VanDerWaalsContact NE-OE1 3.15Å; R231-E239 IonicContact NE-OE2 3.95Å; R231-E239 PolarHBondContact NE-OE2 3.08Å; R231-E239 IonicContact NH2-OE1 2.69Å; R231-E239 PolarHBondContact NH2-OE1 2.9Å
232G77.8Confident81.8Confident20 Ų2063.9 Ų63.921%0.20631%0.311CS..SBendtrans73.37.1-176.700000114.5G2 R228G2-G232 WeakPolarHBondContact CA-O 3.28Å; G2-G232 PolarHBondContact N-O 2.94Å; G2-G232 CarbonylContact O-C 3.58Å; G2-G232 WeakPolarHBondContact O-CA 3.37Å; R228-G232 VanDerWaalsContact O-CA 3.31Å; R228-G232 WeakPolarHBondContact O-CA 3.47Å; R228-G232 PolarHBondContact O-N 2.92Å
233C78.1Confident81.5Confident77 Ų7763.3 Ų63.352%0.5231%0.305SS..SBendtrans-132.7175.2177.257.10000110.4R231R231-C233 PolarHBondContact O-N 2.91Å
234E78.9Confident81.5Confident146 Ų14665.7 Ų65.768%0.68232%0.318SS*.PPolyproline II helixtrans-59.8140168.2-72.6-117.2116.400110.1R228 E236R228-E234 IonicContact NH2-OE1 3.58Å; E234-E236 PolarHBondContact O-N 3.27Å
235V77.5Confident81.2Confident27 Ų2769.4 Ų69.416%0.16433%0.334CS..PPolyproline II helixtrans-70125.4-178.8-175.30000108.7I224 L227 R228 R237 L240I224-V235 HydrophobicContact CG2-CG2 4.26Å; L227-V235 HydrophobicContact CB-CG1 4.13Å; L227-V235 HydrophobicContact CB-CG2 3.53Å; L227-V235 HydrophobicContact CD1-CG1 3.72Å; L227-V235 HydrophobicContact CD1-CG2 4.49Å; R228-V235 HydrophobicContact CG-CG2 3.67Å; V235-R237 PolarHBondContact O-N 2.91Å; V235-L240 HydrophobicContact CG1-CB 4.49Å
236E79.3Confident80.7Confident135 Ų13566.5 Ų66.563%0.63132%0.317SS*.PPolyproline II helixtrans-62.8133.5172.2-65.3-173.9172.800109.9E234 S238 E239 L240E234-E236 PolarHBondContact O-N 3.27Å; E236-S238 WeakPolarHBondContact CB-OG 3.2Å; E236-S238 PolarHBondContact O-N 3.01Å; E236-S238 PolarHBondContact OE2-OG 2.92Å; E236-E239 PolarHBondContact O-N 3.27Å; E236-E239 VanDerWaalsContact O-N 3.09Å; E236-L240 PolarHBondContact O-N 3.36Å
237R79.4Confident80.4Confident212 Ų21267.8 Ų67.880%0.832%0.323SS*.Hα-helixtrans-58.6-36.6178.5-69.9-175.3-179.2-1790.5111.8V235 E239 L240 D241V235-R237 PolarHBondContact O-N 2.91Å; R237-E239 VanDerWaalsContact C-N 3.34Å; R237-E239 PolarHBondContact O-N 3.5Å; R237-L240 PolarHBondContact O-N 3.06Å; R237-D241 WeakPolarHBondContact O-CB 3.45Å; R237-D241 PolarHBondContact O-N 3.44Å
238S79.6Confident80Confident63 Ų6370.8 Ų70.844%0.44135%0.347SS..Hα-helixtrans-54-45.5173.646.30000112.7E236 D241 E242E236-S238 WeakPolarHBondContact CB-OG 3.2Å; E236-S238 PolarHBondContact O-N 3.01Å; E236-S238 PolarHBondContact OE2-OG 2.92Å; S238-D241 PolarHBondContact O-N 3.4Å; S238-E242 WeakPolarHBondContact O-CB 3.43Å; S238-E242 VanDerWaalsContact O-CG 3.31Å; S238-E242 WeakPolarHBondContact O-CG 3.46Å; S238-E242 PolarHBondContact O-N 3.45Å
239E79.3Confident79.4Confident30 Ų3070.4 Ų70.414%0.1435%0.35CS..Hα-helixtrans-67.1-39.1179.7-175171-150.600111.5R231 E236 R237 I243R231-E239 IonicContact CZ-OE1 3.33Å; R231-E239 IonicContact NE-OE1 3.73Å; R231-E239 PolarHBondContact NE-OE1 3.32Å; R231-E239 VanDerWaalsContact NE-OE1 3.15Å; R231-E239 IonicContact NE-OE2 3.95Å; R231-E239 PolarHBondContact NE-OE2 3.08Å; R231-E239 IonicContact NH2-OE1 2.69Å; R231-E239 PolarHBondContact NH2-OE1 2.9Å; E236-E239 PolarHBondContact O-N 3.27Å; E236-E239 VanDerWaalsContact O-N 3.09Å; R237-E239 VanDerWaalsContact C-N 3.34Å; R237-E239 PolarHBondContact O-N 3.5Å; E239-I243 WeakPolarHBondContact O-CG1 3.32Å; E239-I243 PolarHBondContact O-N 2.95Å
240L82.6Confident78.5Confident22 Ų2266.2 Ų66.212%0.11534%0.34CS..Hα-helixtrans-69.5-42.5177.1-175.961.4000112.1L214 I224 V235 E236 R237 E242 I243 L244L214-L240 HydrophobicContact CD2-CD1 4.24Å; I224-L240 HydrophobicContact CD1-CD2 4.13Å; I224-L240 HydrophobicContact CG1-CD1 4.39Å; I224-L240 HydrophobicContact CG1-CD2 4.2Å; V235-L240 HydrophobicContact CG1-CB 4.49Å; E236-L240 PolarHBondContact O-N 3.36Å; R237-L240 PolarHBondContact O-N 3.06Å; L240-E242 VanDerWaalsContact C-N 3.3Å; L240-E242 PolarHBondContact O-N 3.37Å; L240-I243 PolarHBondContact O-N 3.42Å; L240-L244 HydrophobicContact CG-CD1 4.2Å; L240-L244 WeakPolarHBondContact O-CG 3.37Å; L240-L244 PolarHBondContact O-N 2.98Å
241D83.3Confident77.7Confident94 Ų9473.8 Ų73.850%0.50337%0.373SS..Hα-helixtrans-63.7-36.7177.8-69.4-23.2000111.1R237 S238 L244 Q245R237-D241 WeakPolarHBondContact O-CB 3.45Å; R237-D241 PolarHBondContact O-N 3.44Å; S238-D241 PolarHBondContact O-N 3.4Å; D241-L244 PolarHBondContact O-N 3.26Å; D241-Q245 WeakPolarHBondContact O-CB 3.4Å; D241-Q245 PolarHBondContact O-N 3.03Å
242E80.3Confident76.6Confident70 Ų7076.2 Ų76.233%0.32741%0.409SS..Hα-helixtrans-61.3-44.6172.6-79.2-174.9176.400112.5K149 S238 L240 L244 Q245 E246K149-E242 IonicContact NZ-OE1 2.74Å; K149-E242 PolarHBondContact NZ-OE1 3.29Å; K149-E242 IonicContact NZ-OE2 3.15Å; S238-E242 WeakPolarHBondContact O-CB 3.43Å; S238-E242 VanDerWaalsContact O-CG 3.31Å; S238-E242 WeakPolarHBondContact O-CG 3.46Å; S238-E242 PolarHBondContact O-N 3.45Å; L240-E242 VanDerWaalsContact C-N 3.3Å; L240-E242 PolarHBondContact O-N 3.37Å; E242-L244 VanDerWaalsContact C-N 3.33Å; E242-Q245 PolarHBondContact O-N 3.02Å; E242-E246 WeakPolarHBondContact O-CB 3.2Å; E242-E246 PolarHBondContact O-N 3.43Å
243I78.5Confident76Confident9 Ų980.1 Ų80.15%0.04642%0.424CS..Hα-helixtrans-69.9-35.4179.2-55.8166.9000110.3R211 L214 I215 L227 E239 L240 Q245 E246 Q247R211-I243 HydrophobicContact CG-CD1 4.48Å; R211-I243 HydrophobicContact CG-CG1 4.45Å; R211-I243 HydrophobicContact CG-CG2 4.16Å; L214-I243 HydrophobicContact CB-CG2 4.19Å; L214-I243 HydrophobicContact CD2-CB 3.94Å; L214-I243 HydrophobicContact CD2-CG2 3.52Å; L214-I243 HydrophobicContact CG-CG2 4.38Å; I215-I243 HydrophobicContact CD1-CG2 4.26Å; I215-I243 HydrophobicContact CG1-CG2 4.17Å; L227-I243 HydrophobicContact CD1-CD1 4.06Å; E239-I243 WeakPolarHBondContact O-CG1 3.32Å; E239-I243 PolarHBondContact O-N 2.95Å; L240-I243 PolarHBondContact O-N 3.42Å; I243-Q245 VanDerWaalsContact C-N 3.35Å; I243-E246 PolarHBondContact O-N 2.89Å; I243-Q247 WeakPolarHBondContact O-CB 3.33Å; I243-Q247 PolarHBondContact O-N 2.7Å
244L82.5Confident75.6Confident51 Ų5183.7 Ų83.727%0.26743%0.426SS..Hα-helixtrans-65.5-38.5173.4-73.1169.5000111.9L214 L240 D241 E242 Q247 A248L214-L244 HydrophobicContact CD1-CD2 4.4Å; L214-L244 HydrophobicContact CD2-CD2 3.84Å; L214-L244 HydrophobicContact CD2-CG 4.07Å; L214-L244 HydrophobicContact CG-CD2 4.45Å; L240-L244 HydrophobicContact CG-CD1 4.2Å; L240-L244 WeakPolarHBondContact O-CG 3.37Å; L240-L244 PolarHBondContact O-N 2.98Å; D241-L244 PolarHBondContact O-N 3.26Å; E242-L244 VanDerWaalsContact C-N 3.33Å; L244-Q247 WeakPolarHBondContact O-CB 3.44Å; L244-Q247 PolarHBondContact O-N 3.1Å; L244-A248 WeakPolarHBondContact O-CB 3.2Å; L244-A248 PolarHBondContact O-N 3.1Å
245Q80.2Confident75.1Confident114 Ų11480.9 Ų80.953%0.53342%0.421SS..Hα-helixtrans-65.7-44.8173.2-173.9177.7-11.300110.9D241 E242 I243 Q247 A248 E249D241-Q245 WeakPolarHBondContact O-CB 3.4Å; D241-Q245 PolarHBondContact O-N 3.03Å; E242-Q245 PolarHBondContact O-N 3.02Å; I243-Q245 VanDerWaalsContact C-N 3.35Å; Q245-Q247 VanDerWaalsContact C-N 3.27Å; Q245-Q247 PolarHBondContact O-N 2.93Å; Q245-A248 PolarHBondContact O-N 2.77Å; Q245-A248 VanDerWaalsContact O-N 3.08Å; Q245-E249 HydrophobicContact CG-CG 4.47Å; Q245-E249 WeakPolarHBondContact CG-OE1 3.48Å; Q245-E249 PolarHBondContact NE2-OE1 2.88Å; Q245-E249 WeakPolarHBondContact O-CG 3.42Å; Q245-E249 PolarHBondContact O-N 3.44Å
246E74.4Confident75.1Confident34 Ų3483.5 Ų83.516%0.15943%0.427CS..Hα-helixtrans-59.6-39.1174.8-171.9172.4-176.600111.3R211 I215 E242 I243 T250 Q399R211-E246 IonicContact CZ-OE2 3.02Å; R211-E246 IonicContact NE-OE2 3.2Å; R211-E246 PolarHBondContact NE-OE2 3.39Å; R211-E246 IonicContact NH2-OE2 3.15Å; R211-E246 PolarHBondContact NH2-OE2 2.71Å; I215-E246 HydrophobicContact CD1-CB 4.46Å; I215-E246 HydrophobicContact CD1-CG 4.08Å; E242-E246 WeakPolarHBondContact O-CB 3.2Å; E242-E246 PolarHBondContact O-N 3.43Å; I243-E246 PolarHBondContact O-N 2.89Å; E246-T250 VanDerWaalsContact O-CB 3.26Å; E246-T250 WeakPolarHBondContact O-CB 3.26Å; E246-T250 PolarHBondContact O-N 3.11Å; E246-T250 PolarHBondContact O-OG1 3.32Å; E246-Q399 PolarHBondContact OE1-NE2 3.14Å; E246-Q399 VanDerWaalsContact OE1-NE2 3.16Å
247Q77.6Confident75.2Confident33 Ų3382.7 Ų82.715%0.15442%0.419CS..Hα-helixtrans-63.9-43.4173.1-171.8-179.225.800111.9L214 I215 I243 L244 Q245 T250 K251L214-Q247 PolarHBondContact O-NE2 3.13Å; I215-Q247 HydrophobicContact CG1-CB 4.08Å; I215-Q247 HydrophobicContact CG1-CG 4.46Å; I243-Q247 WeakPolarHBondContact O-CB 3.33Å; I243-Q247 PolarHBondContact O-N 2.7Å; L244-Q247 WeakPolarHBondContact O-CB 3.44Å; L244-Q247 PolarHBondContact O-N 3.1Å; Q245-Q247 VanDerWaalsContact C-N 3.27Å; Q245-Q247 PolarHBondContact O-N 2.93Å; Q247-T250 PolarHBondContact O-N 2.78Å; Q247-K251 VanDerWaalsContact O-CB 3.31Å; Q247-K251 WeakPolarHBondContact O-CB 3.49Å; Q247-K251 PolarHBondContact O-N 3.36Å
248A77.9Confident75.2Confident64 Ų6474 Ų7453%0.52939%0.39SS..Hα-helixtrans-66.6-40.4179.500000112L244 Q245 K251L244-A248 WeakPolarHBondContact O-CB 3.2Å; L244-A248 PolarHBondContact O-N 3.1Å; Q245-A248 PolarHBondContact O-N 2.77Å; Q245-A248 VanDerWaalsContact O-N 3.08Å; A248-K251 PolarHBondContact O-N 3.41Å
249E71Confident75.4Confident103 Ų10378 Ų7848%0.48140%0.395SS..Hα-helixtrans-67.7-38.4175.1-71174.7-170.600111.3Q245 M253Q245-E249 HydrophobicContact CG-CG 4.47Å; Q245-E249 WeakPolarHBondContact CG-OE1 3.48Å; Q245-E249 PolarHBondContact NE2-OE1 2.88Å; Q245-E249 WeakPolarHBondContact O-CG 3.42Å; Q245-E249 PolarHBondContact O-N 3.44Å; E249-M253 HydrophobicContact CB-CE 4.43Å; E249-M253 WeakPolarHBondContact O-CE 3.42Å; E249-M253 WeakPolarHBondContact O-CG 3.45Å
250T66.3Low75.6Confident48 Ų4879 Ų7929%0.29440%0.4SS..Hα-helixtrans-75.5-27178.2-52.40000112E246 Q247 G252 M253E246-T250 VanDerWaalsContact O-CB 3.26Å; E246-T250 WeakPolarHBondContact O-CB 3.26Å; E246-T250 PolarHBondContact O-N 3.11Å; E246-T250 PolarHBondContact O-OG1 3.32Å; Q247-T250 PolarHBondContact O-N 2.78Å; T250-G252 PolarHBondContact O-N 3.17Å; T250-G252 VanDerWaalsContact O-N 3.08Å; T250-M253 PolarHBondContact O-N 3.39Å; T250-M253 VanDerWaalsContact O-N 3.08Å
251K64.8Low75.7Confident160 Ų16078 Ų7870%0.69640%0.395SS*.THydrogen-bonded Turntrans-61.6110.7176.5-111.5179174176.30110.4Q247 A248Q247-K251 VanDerWaalsContact O-CB 3.31Å; Q247-K251 WeakPolarHBondContact O-CB 3.49Å; Q247-K251 PolarHBondContact O-N 3.36Å; A248-K251 PolarHBondContact O-N 3.41Å
252G59.4Low75.8Confident88 Ų8879.6 Ų79.691%0.90740%0.397SS*.THydrogen-bonded Turntrans96.7-7.1179.100000114.6T250T250-G252 PolarHBondContact O-N 3.17Å; T250-G252 VanDerWaalsContact O-N 3.08Å
253M65.1Low76.1Confident103 Ų10381.9 Ų81.951%0.50742%0.417SS..PPolyproline II helixtrans-84.5118.9168.7-66.6-157.5-143.500110.3E249 T250 A400E249-M253 HydrophobicContact CB-CE 4.43Å; E249-M253 WeakPolarHBondContact O-CE 3.42Å; E249-M253 WeakPolarHBondContact O-CG 3.45Å; T250-M253 PolarHBondContact O-N 3.39Å; T250-M253 VanDerWaalsContact O-N 3.08Å; M253-A400 HydrophobicContact SD-CB 4.4Å
254R69.7Low76.4Confident151 Ų15183.4 Ų83.457%0.5743%0.425SS*.PPolyproline II helixtrans-73.9128170173.9174.9155.6-178.8-12.7109.3R256 E260R254-R256 PolarHBondContact O-N 3.08Å; R254-E260 IonicContact CZ-OE1 3.76Å; R254-E260 IonicContact NH2-OE1 2.7Å; R254-E260 PolarHBondContact NH2-OE1 3.33Å
255P68.6Low76.4Confident88 Ų8887 Ų8757%0.57144%0.435SS*.PPolyproline II helixtrans-60.5128.5171.523.2-30.8000109.2
256R76.5Confident76.5Confident81 Ų8183.3 Ų83.331%0.30642%0.422SS..PPolyproline II helixtrans-71142.7-178.8-72.5-171.9172.2-169.1-7.9110.1R254 E260 L261 D264 A400R254-R256 PolarHBondContact O-N 3.08Å; R256-E260 VanDerWaalsContact CA-OE2 3.23Å; R256-E260 WeakPolarHBondContact CA-OE2 3.38Å; R256-L261 HydrophobicContact CB-CD1 3.72Å; R256-D264 IonicContact CZ-OD2 3.33Å; R256-D264 VanDerWaalsContact CZ-OD2 3.28Å; R256-D264 IonicContact NH1-OD2 3.68Å; R256-D264 PolarHBondContact NH1-OD2 3.36Å; R256-D264 IonicContact NH2-OD2 2.64Å; R256-D264 PolarHBondContact NH2-OD2 3.41Å; R256-D264 VanDerWaalsContact NH2-OD2 3.1Å; R256-A400 PolarHBondContact N-O 2.94Å
257R81.3Confident77.1Confident119 Ų11982.1 Ų82.145%0.44942%0.417SS..PPolyproline II helixtrans-83.4149.5175.7-54.9-170.8179.4178.8-9109.2W259 E260 L261R257-W259 VanDerWaalsContact C-N 3.26Å; R257-W259 HydrophobicContact CB-CD2 3.65Å; R257-W259 VanDerWaalsContact CB-CE2 3.45Å; R257-W259 HydrophobicContact CB-CE3 3.91Å; R257-W259 HydrophobicContact CB-CG 4.39Å; R257-W259 HydrophobicContact CB-CH2 3.92Å; R257-W259 HydrophobicContact CB-CZ2 3.71Å; R257-W259 HydrophobicContact CB-CZ3 3.98Å; R257-W259 VanDerWaalsContact CD-CE2 3.47Å; R257-W259 HydrophobicContact CG-CH2 4.2Å; R257-W259 HydrophobicContact CG-CZ2 3.95Å; R257-W259 PolarHBondContact O-N 3.21Å; R257-W259 VanDerWaalsContact O-N 3.16Å; R257-E260 HydrophobicContact CB-CG 4.12Å; R257-E260 PolarHBondContact N-OE2 3.13Å; R257-E260 VanDerWaalsContact O-CB 3.3Å; R257-E260 WeakPolarHBondContact O-CB 3.37Å; R257-E260 PolarHBondContact O-N 3.18Å; R257-L261 WeakPolarHBondContact O-CD1 3.39Å
258P80Confident77.6Confident30 Ų3088.1 Ų88.120%0.19544%0.438CS..Hα-helixtrans-55.8-35.6-176.322.2-35.6000114.1E260 L261 F262 A404 M407 I408P258-E260 VanDerWaalsContact C-N 3.31Å; P258-E260 PolarHBondContact O-N 3.16Å; P258-L261 WeakPolarHBondContact O-CB 3.28Å; P258-L261 PolarHBondContact O-N 3.47Å; P258-F262 WeakPolarHBondContact O-CD2 3.35Å; P258-F262 PolarHBondContact O-N 3.1Å; P258-A404 HydrophobicContact CB-CB 4.37Å; P258-M407 HydrophobicContact CB-CE 3.79Å; P258-M407 HydrophobicContact CG-CE 3.31Å; P258-I408 HydrophobicContact CB-CD1 3.94Å; P258-I408 HydrophobicContact CB-CG1 4.02Å
259W83.3Confident78.1Confident146 Ų14688.6 Ų88.655%0.55343%0.426SS*.Hα-helixtrans-67.7-27.8175.555.291.6000114.2R257 L261 F262 T263R257-W259 VanDerWaalsContact C-N 3.26Å; R257-W259 HydrophobicContact CB-CD2 3.65Å; R257-W259 VanDerWaalsContact CB-CE2 3.45Å; R257-W259 HydrophobicContact CB-CE3 3.91Å; R257-W259 HydrophobicContact CB-CG 4.39Å; R257-W259 HydrophobicContact CB-CH2 3.92Å; R257-W259 HydrophobicContact CB-CZ2 3.71Å; R257-W259 HydrophobicContact CB-CZ3 3.98Å; R257-W259 VanDerWaalsContact CD-CE2 3.47Å; R257-W259 HydrophobicContact CG-CH2 4.2Å; R257-W259 HydrophobicContact CG-CZ2 3.95Å; R257-W259 PolarHBondContact O-N 3.21Å; R257-W259 VanDerWaalsContact O-N 3.16Å; W259-L261 VanDerWaalsContact C-N 3.26Å; W259-L261 PolarHBondContact O-N 3.05Å; W259-F262 PolarHBondContact O-N 3.27Å; W259-T263 PolarHBondContact O-N 3.49Å; W259-T263 PolarHBondContact O-OG1 3.27Å
260E84.6Confident79Confident52 Ų5283.9 Ų83.924%0.24340%0.404CS..Hα-helixtrans-66.3-32.7174.7-60.9168.6-176.700110.1R254 R256 R257 P258 T263 D264R254-E260 IonicContact CZ-OE1 3.76Å; R254-E260 IonicContact NH2-OE1 2.7Å; R254-E260 PolarHBondContact NH2-OE1 3.33Å; R256-E260 VanDerWaalsContact CA-OE2 3.23Å; R256-E260 WeakPolarHBondContact CA-OE2 3.38Å; R257-E260 HydrophobicContact CB-CG 4.12Å; R257-E260 PolarHBondContact N-OE2 3.13Å; R257-E260 VanDerWaalsContact O-CB 3.3Å; R257-E260 WeakPolarHBondContact O-CB 3.37Å; R257-E260 PolarHBondContact O-N 3.18Å; P258-E260 VanDerWaalsContact C-N 3.31Å; P258-E260 PolarHBondContact O-N 3.16Å; E260-T263 PolarHBondContact O-N 2.97Å; E260-D264 WeakPolarHBondContact O-CB 3.41Å; E260-D264 PolarHBondContact O-N 3.45Å
261L84.2Confident80.2Confident1 Ų181.9 Ų81.91%0.00539%0.392CS..Hα-helixtrans-68.8-37.4174.9-81.268.6000112.4R256 R257 P258 W259 T263 L271 F397 A401 A404 A405 I408R256-L261 HydrophobicContact CB-CD1 3.72Å; R257-L261 WeakPolarHBondContact O-CD1 3.39Å; P258-L261 WeakPolarHBondContact O-CB 3.28Å; P258-L261 PolarHBondContact O-N 3.47Å; W259-L261 VanDerWaalsContact C-N 3.26Å; W259-L261 PolarHBondContact O-N 3.05Å; L261-T263 PolarHBondContact O-N 2.89Å; L261-L271 HydrophobicContact CB-CD2 4.26Å; L261-F397 HydrophobicContact CD2-CD1 4.44Å; L261-F397 HydrophobicContact CD2-CE1 4Å; L261-A401 HydrophobicContact CD1-CB 4.26Å; L261-A401 HydrophobicContact CD2-CB 4.26Å; L261-A401 HydrophobicContact CG-CB 4.34Å; L261-A404 HydrophobicContact CD1-CB 3.57Å; L261-A404 HydrophobicContact CD2-CB 3.86Å; L261-A404 HydrophobicContact CG-CB 4.36Å; L261-A405 HydrophobicContact CD2-CB 4.26Å; L261-I408 HydrophobicContact CD2-CD1 4.45Å
262F86.4Confident81.5Confident126 Ų12676.9 Ų76.955%0.55337%0.372SS*.Hα-helixtrans-67.8-25.7176.2-73.7-74.9000112.8P258 W259 L271 I275 I408P258-F262 WeakPolarHBondContact O-CD2 3.35Å; P258-F262 PolarHBondContact O-N 3.1Å; W259-F262 PolarHBondContact O-N 3.27Å; F262-L271 HydrophobicContact CD1-CD2 3.61Å; F262-L271 HydrophobicContact CE1-CD2 3.83Å; F262-L271 HydrophobicContact CG-CD2 4.04Å; F262-L271 HydrophobicContact CZ-CD2 4.44Å; F262-I275 HydrophobicContact CE1-CD1 3.98Å; F262-I275 HydrophobicContact CZ-CD1 4.36Å; F262-I408 HydrophobicContact CD2-CD1 4.29Å; F262-I408 HydrophobicContact CE2-CD1 3.54Å; F262-I408 HydrophobicContact CE2-CG1 4.08Å; F262-I408 HydrophobicContact CZ-CD1 3.89Å; F262-I408 HydrophobicContact CZ-CG1 4.31Å; F262-I408 HydrophobicContact CZ-CG2 4.12Å
263T85.4Confident83Confident119 Ų11972.7 Ų72.773%0.7333%0.329SS*.Hα-helixtrans-90.5-29.2-177.9-49.10000111.7W259 E260 L261 R265W259-T263 PolarHBondContact O-N 3.49Å; W259-T263 PolarHBondContact O-OG1 3.27Å; E260-T263 PolarHBondContact O-N 2.97Å; L261-T263 PolarHBondContact O-N 2.89Å; T263-R265 PolarHBondContact O-N 3.36Å
264D84.5Confident84.2Confident40 Ų4067.9 Ų67.921%0.21431%0.305CS..  trans-78.8111.3-176.1-170.5-11.5000112.5R256 E260 S266 V267R256-D264 IonicContact CZ-OD2 3.33Å; R256-D264 VanDerWaalsContact CZ-OD2 3.28Å; R256-D264 IonicContact NH1-OD2 3.68Å; R256-D264 PolarHBondContact NH1-OD2 3.36Å; R256-D264 IonicContact NH2-OD2 2.64Å; R256-D264 PolarHBondContact NH2-OD2 3.41Å; R256-D264 VanDerWaalsContact NH2-OD2 3.1Å; E260-D264 WeakPolarHBondContact O-CB 3.41Å; E260-D264 PolarHBondContact O-N 3.45Å; D264-S266 PolarHBondContact O-N 2.96Å; D264-S266 VanDerWaalsContact OD1-CB 3.31Å; D264-S266 WeakPolarHBondContact OD1-CB 3.38Å; D264-S266 PolarHBondContact OD1-N 3.48Å; D264-S266 PolarHBondContact OD1-OG 2.87Å; D264-S266 PolarHBondContact OD2-OG 3Å; D264-S266 VanDerWaalsContact OD2-OG 3.06Å; D264-V267 HydrophobicContact CB-CG2 4.01Å; D264-V267 WeakPolarHBondContact O-CG2 3.48Å; D264-V267 PolarHBondContact O-N 2.88Å
265R83.9Confident85.2Confident126 Ų12662.7 Ų62.748%0.47529%0.288SS..G310 helixtrans-63-27.1178.1-172.5174.9177.8174.81.7113.3T263 V267 R268 N473 F474T263-R265 PolarHBondContact O-N 3.36Å; R265-V267 PolarHBondContact O-N 3.07Å; R265-R268 PolarHBondContact O-N 3.27Å; R265-N473 VanDerWaalsContact O-CG 3.28Å; R265-N473 PolarHBondContact O-OD1 2.79Å; R265-F474 HydrophobicContact CG-CE1 4.25Å; R265-F474 HydrophobicContact CG-CZ 4.4Å
266S81.8Confident86.4Confident38 Ų3861.2 Ų61.227%0.26628%0.275SS..G310 helixtrans-70.5-16.6-176.669.40000114D264 N473D264-S266 PolarHBondContact O-N 2.96Å; D264-S266 VanDerWaalsContact OD1-CB 3.31Å; D264-S266 WeakPolarHBondContact OD1-CB 3.38Å; D264-S266 PolarHBondContact OD1-N 3.48Å; D264-S266 PolarHBondContact OD1-OG 2.87Å; D264-S266 PolarHBondContact OD2-OG 3Å; D264-S266 VanDerWaalsContact OD2-OG 3.06Å; S266-N473 VanDerWaalsContact C-ND2 3.28Å; S266-N473 PolarHBondContact O-ND2 2.79Å
267V86.1Confident87.1Confident9 Ų957.5 Ų57.56%0.05526%0.261CS..G310 helixtrans-119.910.1-179.9-57.20000112.4D264 R265 W269 Q270 L271 F397D264-V267 HydrophobicContact CB-CG2 4.01Å; D264-V267 WeakPolarHBondContact O-CG2 3.48Å; D264-V267 PolarHBondContact O-N 2.88Å; R265-V267 PolarHBondContact O-N 3.07Å; V267-W269 PolarHBondContact O-N 3.38Å; V267-Q270 VanDerWaalsContact CG1-OE1 3.31Å; V267-Q270 WeakPolarHBondContact O-CB 3.42Å; V267-Q270 PolarHBondContact O-N 3.41Å; V267-L271 WeakPolarHBondContact O-CB 3.09Å; V267-L271 PolarHBondContact O-N 2.87Å; V267-F397 HydrophobicContact CB-CE1 4.16Å
268R88.2Confident87.5Confident159 Ų15952.3 Ų52.360%0.624%0.243SC*.Hα-helixtrans-61.1-50-171.3-176.4175.5175.7171.9-0.8112.8R265 Q270 L271 I272R265-R268 PolarHBondContact O-N 3.27Å; R268-Q270 VanDerWaalsContact C-N 3.29Å; R268-Q270 PolarHBondContact O-N 3.17Å; R268-L271 PolarHBondContact O-N 2.94Å; R268-I272 HydrophobicContact CG-CD1 3.86Å; R268-I272 VanDerWaalsContact O-CG1 3.26Å; R268-I272 WeakPolarHBondContact O-CG1 3.33Å; R268-I272 PolarHBondContact O-N 3.37Å
269W88.8Confident88.1Confident73 Ų7351.6 Ų51.628%0.27724%0.239SC..Hα-helixtrans-66.4-31177.1-81.2110000113.2V267 S273 F453 F469 M472 N473V267-W269 PolarHBondContact O-N 3.38Å; W269-S273 WeakPolarHBondContact O-CB 3.28Å; W269-S273 PolarHBondContact O-N 3.21Å; W269-S273 PolarHBondContact O-OG 2.95Å; W269-F453 HydrophobicContact CE3-CD1 4.35Å; W269-F453 AromaticContact CH2-CD1 3.89Å; W269-F453 HydrophobicContact CH2-CD1 3.89Å; W269-F453 AromaticContact CH2-CE1 3.75Å; W269-F453 HydrophobicContact CH2-CE1 3.75Å; W269-F453 HydrophobicContact CH2-CZ 4.49Å; W269-F453 AromaticContact CZ3-CD1 3.63Å; W269-F453 HydrophobicContact CZ3-CD1 3.63Å; W269-F453 AromaticContact CZ3-CE1 3.96Å; W269-F453 HydrophobicContact CZ3-CE1 3.96Å; W269-F453 HydrophobicContact CZ3-CG 4.14Å; W269-F469 HydrophobicContact CB-CD1 3.87Å; W269-F469 HydrophobicContact CB-CE1 4.42Å; W269-M472 HydrophobicContact CB-CB 4.41Å; W269-M472 HydrophobicContact CD2-CB 4.43Å; W269-M472 HydrophobicContact CG-CB 3.92Å; W269-M472 PolarHBondContact NE1-O 3.35Å; W269-N473 WeakPolarHBondContact CB-OD1 3.49Å; W269-N473 PolarHBondContact N-OD1 2.91Å
270Q90.9Very high88.6Confident4 Ų444.9 Ų44.92%0.01921%0.214CC..Hα-helixtrans-63.8-46.2173.5-64.1177.3-32.600110.5V267 R268 S273 V274 I396 F397 F469V267-Q270 VanDerWaalsContact CG1-OE1 3.31Å; V267-Q270 WeakPolarHBondContact O-CB 3.42Å; V267-Q270 PolarHBondContact O-N 3.41Å; R268-Q270 VanDerWaalsContact C-N 3.29Å; R268-Q270 PolarHBondContact O-N 3.17Å; Q270-S273 PolarHBondContact O-N 3.17Å; Q270-V274 PolarHBondContact O-N 3.16Å; Q270-V274 VanDerWaalsContact O-N 3.08Å; Q270-I396 HydrophobicContact CB-CG2 3.49Å; Q270-I396 VanDerWaalsContact CB-CG2 3.49Å; Q270-I396 HydrophobicContact CG-CG2 3.49Å; Q270-I396 VanDerWaalsContact CG-CG2 3.49Å; Q270-I396 PolarHBondContact NE2-O 3.48Å; Q270-I396 VanDerWaalsContact NE2-O 3.14Å; Q270-F397 HydrophobicContact CB-CE1 3.94Å; Q270-F397 HydrophobicContact CB-CE2 4.15Å; Q270-F397 HydrophobicContact CB-CZ 3.68Å; Q270-F469 HydrophobicContact CB-CD1 4.45Å; Q270-F469 HydrophobicContact CG-CB 3.67Å; Q270-F469 HydrophobicContact CG-CD1 3.62Å; Q270-F469 HydrophobicContact CG-CD2 3.61Å; Q270-F469 HydrophobicContact CG-CE1 4.13Å; Q270-F469 HydrophobicContact CG-CE2 4.09Å; Q270-F469 HydrophobicContact CG-CG 3.35Å; Q270-F469 HydrophobicContact CG-CZ 4.33Å
271L90.7Very high88.9Confident7 Ų744 Ų444%0.03721%0.211CC..Hα-helixtrans-65.7-45.9178.6-177.162.9000112.1L261 F262 V267 R268 S273 V274 I275 F397 I408L261-L271 HydrophobicContact CB-CD2 4.26Å; F262-L271 HydrophobicContact CD1-CD2 3.61Å; F262-L271 HydrophobicContact CE1-CD2 3.83Å; F262-L271 HydrophobicContact CG-CD2 4.04Å; F262-L271 HydrophobicContact CZ-CD2 4.44Å; V267-L271 WeakPolarHBondContact O-CB 3.09Å; V267-L271 PolarHBondContact O-N 2.87Å; R268-L271 PolarHBondContact O-N 2.94Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 3.48Å; L271-V274 PolarHBondContact O-N 3.43Å; L271-I275 HydrophobicContact CD1-CD1 4.03Å; L271-I275 HydrophobicContact CD1-CG1 4.36Å; L271-I275 HydrophobicContact CG-CD1 3.87Å; L271-I275 WeakPolarHBondContact O-CG1 3.15Å; L271-I275 PolarHBondContact O-N 3.37Å; L271-F397 HydrophobicContact CB-CZ 4.25Å; L271-I408 HydrophobicContact CD1-CD1 3.79Å; L271-I408 HydrophobicContact CD1-CG2 4.26Å
272I91.6Very high89.2Confident54 Ų5444.1 Ų44.128%0.27721%0.211SC..Hα-helixtrans-58.8-44.6176-68167.7000110.2R268 V274 I275 I276R268-I272 HydrophobicContact CG-CD1 3.86Å; R268-I272 VanDerWaalsContact O-CG1 3.26Å; R268-I272 WeakPolarHBondContact O-CG1 3.33Å; R268-I272 PolarHBondContact O-N 3.37Å; I272-V274 PolarHBondContact O-N 3.29Å; I272-I275 PolarHBondContact O-N 2.94Å; I272-I276 HydrophobicContact CG2-CD1 3.56Å; I272-I276 HydrophobicContact CG2-CG1 4.3Å; I272-I276 WeakPolarHBondContact O-CB 3.38Å; I272-I276 WeakPolarHBondContact O-CG1 3.49Å; I272-I276 PolarHBondContact O-N 3.26Å
273S91.5Very high89.5Confident0 Ų040.1 Ų40.10%020%0.196CC..Hα-helixtrans-61.2-45.5179.9-59.40000111.8W269 Q270 L271 I276 I277 Y449W269-S273 WeakPolarHBondContact O-CB 3.28Å; W269-S273 PolarHBondContact O-N 3.21Å; W269-S273 PolarHBondContact O-OG 2.95Å; Q270-S273 PolarHBondContact O-N 3.17Å; L271-S273 VanDerWaalsContact C-N 3.3Å; L271-S273 PolarHBondContact O-N 3.48Å; S273-I276 PolarHBondContact O-N 2.56Å; S273-I277 WeakPolarHBondContact O-CB 3.36Å; S273-I277 WeakPolarHBondContact O-CD1 3.46Å; S273-I277 WeakPolarHBondContact O-CG1 3.35Å; S273-I277 PolarHBondContact O-N 3.26Å; S273-Y449 WeakPolarHBondContact CA-OH 3.31Å; S273-Y449 PolarHBondContact OG-OH 3.34Å
274V89.9Confident89.9Confident3 Ų334.5 Ų34.52%0.01816%0.161CC..Hα-helixtrans-66-43.4178.21660000111.8Q270 L271 I272 I276 S278 P393 I396 F397 A409Q270-V274 PolarHBondContact O-N 3.16Å; Q270-V274 VanDerWaalsContact O-N 3.08Å; L271-V274 PolarHBondContact O-N 3.43Å; I272-V274 PolarHBondContact O-N 3.29Å; V274-I276 PolarHBondContact O-N 3.33Å; V274-S278 VanDerWaalsContact O-CB 3.23Å; V274-S278 WeakPolarHBondContact O-CB 3.44Å; V274-S278 PolarHBondContact O-N 3.42Å; V274-S278 PolarHBondContact O-OG 3Å; V274-S278 VanDerWaalsContact O-OG 3.06Å; V274-P393 HydrophobicContact CG1-CG 4.22Å; V274-P393 HydrophobicContact CG2-CG 4.39Å; V274-I396 HydrophobicContact CG2-CD1 4.26Å; V274-F397 HydrophobicContact CB-CE2 4.29Å; V274-F397 HydrophobicContact CG2-CD2 4.41Å; V274-F397 HydrophobicContact CG2-CE2 3.7Å; V274-A409 HydrophobicContact CG1-CB 3.61Å
275I91.4Very high90.1Very high41 Ų4132.6 Ų32.621%0.2115%0.151CC..Hα-helixtrans-60.3-47.4177.3-70.4169.2000110.9F262 L271 I272 S279 I408 M412F262-I275 HydrophobicContact CE1-CD1 3.98Å; F262-I275 HydrophobicContact CZ-CD1 4.36Å; L271-I275 HydrophobicContact CD1-CD1 4.03Å; L271-I275 HydrophobicContact CD1-CG1 4.36Å; L271-I275 HydrophobicContact CG-CD1 3.87Å; L271-I275 WeakPolarHBondContact O-CG1 3.15Å; L271-I275 PolarHBondContact O-N 3.37Å; I272-I275 PolarHBondContact O-N 2.94Å; I275-S279 WeakPolarHBondContact O-CB 3.32Å; I275-S279 PolarHBondContact O-N 3.48Å; I275-S279 PolarHBondContact O-OG 3.12Å; I275-I408 HydrophobicContact CD1-CG2 4.06Å; I275-I408 HydrophobicContact CG1-CG2 3.8Å; I275-M412 HydrophobicContact CG2-CG 4.33Å
276I93Very high90.4Very high58 Ų5826.6 Ų26.630%0.29713%0.128SC..Hα-helixtrans-65.3-48.7-178.2-70.5173.6000110.7I272 S273 V274 S279 A280 Y449I272-I276 HydrophobicContact CG2-CD1 3.56Å; I272-I276 HydrophobicContact CG2-CG1 4.3Å; I272-I276 WeakPolarHBondContact O-CB 3.38Å; I272-I276 WeakPolarHBondContact O-CG1 3.49Å; I272-I276 PolarHBondContact O-N 3.26Å; S273-I276 PolarHBondContact O-N 2.56Å; V274-I276 PolarHBondContact O-N 3.33Å; I276-S279 PolarHBondContact O-N 3.46Å; I276-A280 VanDerWaalsContact O-CB 3.25Å; I276-A280 WeakPolarHBondContact O-CB 3.31Å; I276-A280 PolarHBondContact O-N 2.62Å; I276-Y449 HydrophobicContact CB-CD1 4.43Å; I276-Y449 HydrophobicContact CB-CE1 4.22Å; I276-Y449 HydrophobicContact CD1-CD2 3.94Å; I276-Y449 HydrophobicContact CD1-CE1 4.14Å; I276-Y449 HydrophobicContact CD1-CE2 3.48Å; I276-Y449 VanDerWaalsContact CD1-CE2 3.48Å; I276-Y449 HydrophobicContact CD1-CG 4.45Å; I276-Y449 HydrophobicContact CG2-CD1 3.8Å; I276-Y449 HydrophobicContact CG2-CE1 4.09Å; I276-Y449 HydrophobicContact CG2-CG 4.05Å
277I91.9Very high90.8Very high2 Ų225.2 Ų25.21%0.0112%0.118CC..Hα-helixtrans-69-41.8-175.8-62.2167.4000111S273 S279 A280 M281 L338 T389 L392 I450 L454S273-I277 WeakPolarHBondContact O-CB 3.36Å; S273-I277 WeakPolarHBondContact O-CD1 3.46Å; S273-I277 WeakPolarHBondContact O-CG1 3.35Å; S273-I277 PolarHBondContact O-N 3.26Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 2.89Å; I277-A280 PolarHBondContact O-N 3.44Å; I277-M281 PolarHBondContact O-N 2.75Å; I277-L338 HydrophobicContact CG2-CD1 4.48Å; I277-T389 HydrophobicContact CG2-CG2 3.84Å; I277-L392 HydrophobicContact CB-CD1 4.42Å; I277-L392 HydrophobicContact CD1-CD1 3.72Å; I277-L392 HydrophobicContact CG2-CD1 3.87Å; I277-I450 HydrophobicContact CD1-CG1 4.28Å; I277-I450 HydrophobicContact CG1-CG1 4.21Å; I277-L454 HydrophobicContact CD1-CD1 3.77Å; I277-L454 HydrophobicContact CD1-CD2 3.82Å; I277-L454 HydrophobicContact CD1-CG 4.31Å
278S90.4Very high90.9Very high10 Ų1024.8 Ų24.87%0.0712%0.115CC..Hα-helixtrans-65.3-35.2174.8-63.10000112.3V274 A409V274-S278 VanDerWaalsContact O-CB 3.23Å; V274-S278 WeakPolarHBondContact O-CB 3.44Å; V274-S278 PolarHBondContact O-N 3.42Å; V274-S278 PolarHBondContact O-OG 3Å; V274-S278 VanDerWaalsContact O-OG 3.06Å; S278-A409 WeakPolarHBondContact OG-CB 3.45Å
279S92.6Very high91.1Very high16 Ų1617.2 Ų17.211%0.1129%0.087CC..Hα-helixtrans-69.8-45.4174.4-580000111.6I275 I276 I277 M281 Q282 L283 N416I275-S279 WeakPolarHBondContact O-CB 3.32Å; I275-S279 PolarHBondContact O-N 3.48Å; I275-S279 PolarHBondContact O-OG 3.12Å; I276-S279 PolarHBondContact O-N 3.46Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 2.89Å; S279-M281 VanDerWaalsContact C-N 3.3Å; S279-M281 PolarHBondContact O-N 2.96Å; S279-Q282 PolarHBondContact O-N 3.27Å; S279-L283 VanDerWaalsContact O-CB 3.26Å; S279-L283 WeakPolarHBondContact O-CB 3.32Å; S279-L283 VanDerWaalsContact O-CG 3.24Å; S279-L283 WeakPolarHBondContact O-CG 3.25Å; S279-L283 PolarHBondContact O-N 3.04Å; S279-N416 VanDerWaalsContact CA-ND2 3.31Å; S279-N416 WeakPolarHBondContact CA-ND2 3.39Å; S279-N416 WeakPolarHBondContact CB-ND2 3.22Å; S279-N416 PolarHBondContact OG-ND2 2.7Å
280A93.2Very high91.2Very high4 Ų413.8 Ų13.83%0.0337%0.074CC..Hα-helixtrans-58.6-40.2177.800000112.7I276 I277 Q282 L283 C284 F342 S446I276-A280 VanDerWaalsContact O-CB 3.25Å; I276-A280 WeakPolarHBondContact O-CB 3.31Å; I276-A280 PolarHBondContact O-N 2.62Å; I277-A280 PolarHBondContact O-N 3.44Å; A280-Q282 PolarHBondContact O-N 3.48Å; A280-L283 PolarHBondContact O-N 3.34Å; A280-C284 WeakPolarHBondContact O-CB 3.38Å; A280-C284 PolarHBondContact O-N 2.86Å; A280-F342 HydrophobicContact CB-CE1 4.23Å; A280-F342 HydrophobicContact CB-CE2 4.44Å; A280-F342 HydrophobicContact CB-CZ 3.73Å; A280-S446 WeakPolarHBondContact CB-OG 3.32Å
281M90.8Very high91Very high35 Ų3513.6 Ų13.617%0.1727%0.073CC..Hα-helixtrans-55.5-37.3175.8179.9177.3170.300111.6I277 S279 C284 F380 P384 T389I277-M281 PolarHBondContact O-N 2.75Å; S279-M281 VanDerWaalsContact C-N 3.3Å; S279-M281 PolarHBondContact O-N 2.96Å; M281-C284 PolarHBondContact O-SG 3.26Å; M281-F380 HydrophobicContact CE-CZ 4.34Å; M281-F380 HydrophobicContact CG-CE2 4.16Å; M281-F380 HydrophobicContact CG-CZ 4.3Å; M281-P384 HydrophobicContact CG-CB 4.3Å; M281-T389 HydrophobicContact CB-CG2 4.32Å; M281-T389 HydrophobicContact SD-CG2 3.76Å
282Q91.3Very high90.9Very high2 Ų213.3 Ų13.31%0.0097%0.071CC..Hα-helixtrans-90.9-40-179.2-162.66369.700113.6S279 A280 C284 G285 D287 M413 N416 L417S279-Q282 PolarHBondContact O-N 3.27Å; A280-Q282 PolarHBondContact O-N 3.48Å; Q282-C284 PolarHBondContact O-N 3.28Å; Q282-G285 PolarHBondContact O-N 3.44Å; Q282-G285 VanDerWaalsContact O-N 3.16Å; Q282-D287 PolarHBondContact NE2-OD2 2.81Å; Q282-D287 PolarHBondContact OE1-OD2 3.43Å; Q282-M413 WeakPolarHBondContact CG-O 3.2Å; Q282-N416 HydrophobicContact CB-CB 3.82Å; Q282-N416 HydrophobicContact CG-CB 3.9Å; Q282-L417 VanDerWaalsContact CD-CB 3.49Å; Q282-L417 VanDerWaalsContact CG-CA 3.41Å; Q282-L417 HydrophobicContact CG-CB 3.63Å; Q282-L417 HydrophobicContact CG-CD1 4.35Å
283L92.6Very high90.8Very high43 Ų4310.7 Ų10.723%0.2256%0.058CC..Hα-helixtrans-70.8-12.2-178.6-69.8176.1000113.2S279 A280 G285 N416 V420 F439 I442S279-L283 VanDerWaalsContact O-CB 3.26Å; S279-L283 WeakPolarHBondContact O-CB 3.32Å; S279-L283 VanDerWaalsContact O-CG 3.24Å; S279-L283 WeakPolarHBondContact O-CG 3.25Å; S279-L283 PolarHBondContact O-N 3.04Å; A280-L283 PolarHBondContact O-N 3.34Å; L283-G285 PolarHBondContact O-N 3.29Å; L283-N416 HydrophobicContact CD2-CB 4Å; L283-N416 HydrophobicContact CG-CB 4.09Å; L283-V420 HydrophobicContact CD2-CG2 3.69Å; L283-F439 VanDerWaalsContact O-CD1 3.31Å; L283-F439 WeakPolarHBondContact O-CD1 3.3Å; L283-I442 HydrophobicContact CB-CD1 4.07Å; L283-I442 HydrophobicContact CB-CG2 3.88Å
284C92.2Very high90.6Very high0 Ų012 Ų120%07%0.067CC..THydrogen-bonded Turntrans-69.8-6.9169.574.90000113.5A280 M281 Q282 N286 F342 M345 Y376 F380A280-C284 WeakPolarHBondContact O-CB 3.38Å; A280-C284 PolarHBondContact O-N 2.86Å; M281-C284 PolarHBondContact O-SG 3.26Å; Q282-C284 PolarHBondContact O-N 3.28Å; C284-N286 VanDerWaalsContact C-N 3.33Å; C284-N286 PolarHBondContact O-N 3.38Å; C284-F342 HydrophobicContact CB-CE1 4.37Å; C284-M345 HydrophobicContact CB-CE 3.73Å; C284-Y376 PolarHBondContact O-OH 2.66Å; C284-F380 VanDerWaalsContact SG-CE2 3.59Å
285G89.4Confident90.4Very high0 Ų013.7 Ų13.70%07%0.073CC..  trans79.84.4170.100000115.9Q282 L283 D287 S288 I289Q282-G285 PolarHBondContact O-N 3.44Å; Q282-G285 VanDerWaalsContact O-N 3.16Å; L283-G285 PolarHBondContact O-N 3.29Å; G285-D287 PolarHBondContact O-N 2.96Å; G285-S288 WeakPolarHBondContact O-CB 3.41Å; G285-S288 PolarHBondContact O-N 3.48Å; G285-S288 VanDerWaalsContact O-N 3.14Å; G285-I289 WeakPolarHBondContact O-CG1 3.41Å; G285-I289 PolarHBondContact O-N 3.48Å
286N90.4Very high90.3Very high1 Ų112 Ų121%0.0057%0.065CC..Hα-helixtrans-56.9-49.5-177.6-169.183.2000113C284 S288 I289 Y290 I377 F380C284-N286 VanDerWaalsContact C-N 3.33Å; C284-N286 PolarHBondContact O-N 3.38Å; N286-S288 PolarHBondContact O-N 3.21Å; N286-I289 VanDerWaalsContact O-CB 3.3Å; N286-I289 WeakPolarHBondContact O-CB 3.37Å; N286-I289 PolarHBondContact O-N 3.34Å; N286-Y290 WeakPolarHBondContact ND2-CE2 3.4Å; N286-Y290 PolarHBondContact O-N 3.37Å; N286-I377 WeakPolarHBondContact OD1-CG1 3.37Å; N286-F380 HydrophobicContact CB-CD1 3.77Å; N286-F380 HydrophobicContact CB-CD2 3.9Å; N286-F380 HydrophobicContact CB-CE1 3.8Å; N286-F380 HydrophobicContact CB-CE2 3.94Å; N286-F380 HydrophobicContact CB-CG 3.81Å; N286-F380 HydrophobicContact CB-CZ 3.89Å; N286-F380 VanDerWaalsContact CG-CE1 3.48Å; N286-F380 WeakPolarHBondContact ND2-CD1 3.45Å; N286-F380 WeakPolarHBondContact ND2-CE1 3.41Å; N286-F380 WeakPolarHBondContact OD1-CD1 3.33Å
287D90.3Very high90.1Very high9 Ų99.2 Ų9.25%0.0485%0.051CC..Hα-helixtrans-65.9-29.2179.8-62.7-14.8000112.8Y22 L26 Q282 G285 I289 Y290 F291 L417Y22-D287 PolarHBondContact OH-OD2 2.72Å; L26-D287 HydrophobicContact CD2-CB 4.47Å; Q282-D287 PolarHBondContact NE2-OD2 2.81Å; Q282-D287 PolarHBondContact OE1-OD2 3.43Å; G285-D287 PolarHBondContact O-N 2.96Å; D287-I289 VanDerWaalsContact C-N 3.33Å; D287-Y290 WeakPolarHBondContact O-CB 3.26Å; D287-Y290 PolarHBondContact O-N 2.94Å; D287-Y290 VanDerWaalsContact O-N 3.13Å; D287-F291 PolarHBondContact O-N 2.8Å; D287-F291 VanDerWaalsContact O-N 3.09Å; D287-L417 HydrophobicContact CB-CD1 3.57Å
288S88.6Confident89.8Confident0 Ų014.5 Ų14.50%07%0.073CC..Hα-helixtrans-71.5-29.9175.4-56.70000112G285 N286 Y290 F291 Y292 V420G285-S288 WeakPolarHBondContact O-CB 3.41Å; G285-S288 PolarHBondContact O-N 3.48Å; G285-S288 VanDerWaalsContact O-N 3.14Å; N286-S288 PolarHBondContact O-N 3.21Å; S288-Y290 PolarHBondContact O-N 3.13Å; S288-F291 PolarHBondContact O-N 3.11Å; S288-Y292 WeakPolarHBondContact O-CB 3.31Å; S288-Y292 WeakPolarHBondContact O-CD2 3.31Å; S288-Y292 PolarHBondContact O-N 2.88Å; S288-V420 WeakPolarHBondContact OG-CG1 3.44Å
289I91.1Very high89.5Confident0 Ų018 Ų180%09%0.088CC..Hα-helixtrans-60.6-37.4168-59.8166.9000109.9G285 N286 D287 Y292 A293 I373 Y376 I377 F424 F436G285-I289 WeakPolarHBondContact O-CG1 3.41Å; G285-I289 PolarHBondContact O-N 3.48Å; N286-I289 VanDerWaalsContact O-CB 3.3Å; N286-I289 WeakPolarHBondContact O-CB 3.37Å; N286-I289 PolarHBondContact O-N 3.34Å; D287-I289 VanDerWaalsContact C-N 3.33Å; I289-Y292 CarbonylContact O-C 3.59Å; I289-A293 WeakPolarHBondContact O-CA 3.34Å; I289-A293 WeakPolarHBondContact O-CB 3.22Å; I289-A293 PolarHBondContact O-N 3.14Å; I289-I373 HydrophobicContact CG2-CG2 4.2Å; I289-Y376 HydrophobicContact CD1-CD1 3.89Å; I289-Y376 HydrophobicContact CD1-CE1 3.87Å; I289-I377 HydrophobicContact CG2-CD1 4.2Å; I289-F424 HydrophobicContact CG1-CE2 4.36Å; I289-F424 HydrophobicContact CG1-CZ 4.1Å; I289-F436 HydrophobicContact CD1-CE1 3.68Å; I289-F436 HydrophobicContact CD1-CZ 3.75Å; I289-F436 HydrophobicContact CG1-CE1 4.3Å; I289-F436 HydrophobicContact CG1-CZ 3.92Å
290Y90.9Very high89Confident1 Ų117.2 Ų17.20%0.0048%0.083CC..Hα-helixtrans-69.7-41.9175.4-64-51.6000113.2N30 V167 N286 D287 S288 Y292 E318 I377N30-Y290 VanDerWaalsContact CB-O 3.32Å; N30-Y290 WeakPolarHBondContact CB-O 3.32Å; V167-Y290 HydrophobicContact CG1-CD1 3.87Å; V167-Y290 HydrophobicContact CG1-CE1 3.74Å; V167-Y290 HydrophobicContact CG1-CE2 4.42Å; V167-Y290 HydrophobicContact CG1-CG 4.31Å; N286-Y290 WeakPolarHBondContact ND2-CE2 3.4Å; N286-Y290 PolarHBondContact O-N 3.37Å; D287-Y290 WeakPolarHBondContact O-CB 3.26Å; D287-Y290 PolarHBondContact O-N 2.94Å; D287-Y290 VanDerWaalsContact O-N 3.13Å; S288-Y290 PolarHBondContact O-N 3.13Å; Y290-Y292 VanDerWaalsContact C-N 3.31Å; Y290-Y292 PolarHBondContact O-N 3.19Å; Y290-E318 WeakPolarHBondContact CE2-OE2 3.38Å; Y290-E318 WeakPolarHBondContact OH-CB 3.37Å; Y290-E318 PolarHBondContact OH-OE2 3.12Å; Y290-I377 HydrophobicContact CE1-CD1 4.27Å; Y290-I377 WeakPolarHBondContact OH-CG2 3.43Å
291F87.8Confident88.6Confident0 Ų019 Ų190%010%0.102CC..Hα-helixtrans-64.4-37.1178-72.3-39.9000113.2L26 V65 F68 D287 S288 L417L26-F291 HydrophobicContact CB-CE1 4.41Å; L26-F291 HydrophobicContact CD2-CE1 3.65Å; L26-F291 HydrophobicContact CD2-CE2 4.13Å; L26-F291 HydrophobicContact CD2-CZ 3.35Å; L26-F291 VanDerWaalsContact O-CD1 3.26Å; L26-F291 WeakPolarHBondContact O-CD1 3.29Å; V65-F291 HydrophobicContact CG1-CB 3.82Å; V65-F291 HydrophobicContact CG1-CD1 3.79Å; V65-F291 HydrophobicContact CG1-CD2 3.88Å; V65-F291 HydrophobicContact CG1-CE1 4.27Å; V65-F291 HydrophobicContact CG1-CE2 4.34Å; V65-F291 HydrophobicContact CG1-CG 3.59Å; F68-F291 HydrophobicContact CD1-CZ 4.02Å; F68-F291 HydrophobicContact CE1-CZ 4.38Å; D287-F291 PolarHBondContact O-N 2.8Å; D287-F291 VanDerWaalsContact O-N 3.09Å; S288-F291 PolarHBondContact O-N 3.11Å; F291-L417 HydrophobicContact CE2-CD1 3.94Å; F291-L417 HydrophobicContact CE2-CG 4.42Å
292Y88.6Confident88.4Confident0 Ų018 Ų180%010%0.097CC..THydrogen-bonded Turntrans-121.228.2-170.6-57.2-67.3000112.4W61 V65 S288 I289 Y290 S294 Y295 V296 G421 F424 P425W61-Y292 AromaticContact NE1-CE1 3.59Å; V65-Y292 WeakPolarHBondContact CB-OH 3.49Å; V65-Y292 HydrophobicContact CG1-CE1 4.4Å; V65-Y292 HydrophobicContact CG1-CE2 4.41Å; V65-Y292 WeakPolarHBondContact CG1-OH 3.45Å; V65-Y292 HydrophobicContact CG2-CE1 4.35Å; S288-Y292 WeakPolarHBondContact O-CB 3.31Å; S288-Y292 WeakPolarHBondContact O-CD2 3.31Å; S288-Y292 PolarHBondContact O-N 2.88Å; I289-Y292 CarbonylContact O-C 3.59Å; Y290-Y292 VanDerWaalsContact C-N 3.31Å; Y290-Y292 PolarHBondContact O-N 3.19Å; Y292-S294 PolarHBondContact O-N 3.29Å; Y292-S294 VanDerWaalsContact O-N 3.14Å; Y292-Y295 AromaticContact CD1-CD2 3.8Å; Y292-Y295 HydrophobicContact CD1-CD2 3.8Å; Y292-Y295 AromaticContact CD1-CE2 3.88Å; Y292-Y295 HydrophobicContact CD1-CE2 3.88Å; Y292-Y295 HydrophobicContact CG-CD2 4.32Å; Y292-Y295 WeakPolarHBondContact O-CB 3.17Å; Y292-Y295 PolarHBondContact O-N 3.46Å; Y292-V296 PolarHBondContact O-N 3.06Å; Y292-V296 VanDerWaalsContact O-N 3.12Å; Y292-G421 WeakPolarHBondContact CE2-O 3.42Å; Y292-G421 PolarHBondContact OH-O 3.14Å; Y292-G421 VanDerWaalsContact OH-O 3.04Å; Y292-F424 HydrophobicContact CD2-CB 4.19Å; Y292-F424 AromaticContact CD2-CD1 3.56Å; Y292-F424 HydrophobicContact CD2-CD1 3.56Å; Y292-F424 HydrophobicContact CD2-CE1 4.3Å; Y292-F424 HydrophobicContact CD2-CG 4.15Å; Y292-F424 HydrophobicContact CE2-CB 4.33Å; Y292-F424 HydrophobicContact CE2-CD1 4.48Å; Y292-F424 HydrophobicContact CG-CD1 4.03Å; Y292-P425 HydrophobicContact CD1-CG 3.62Å; Y292-P425 HydrophobicContact CD2-CG 3.84Å; Y292-P425 HydrophobicContact CE1-CG 3.37Å; Y292-P425 HydrophobicContact CE2-CG 3.6Å; Y292-P425 HydrophobicContact CG-CG 3.85Å
293A89.1Confident88.2Confident0 Ų020.7 Ų20.70%012%0.116CC..Hα-helixtrans-55.6-36.8-177.800000111.3N30 I289 Y295 V296 F297 T311N30-A293 PolarHBondContact OD1-N 3.18Å; N30-A293 VanDerWaalsContact OD1-N 3.15Å; I289-A293 WeakPolarHBondContact O-CA 3.34Å; I289-A293 WeakPolarHBondContact O-CB 3.22Å; I289-A293 PolarHBondContact O-N 3.14Å; A293-Y295 VanDerWaalsContact C-N 3.32Å; A293-Y295 PolarHBondContact O-N 2.91Å; A293-V296 PolarHBondContact O-N 2.87Å; A293-F297 HydrophobicContact CB-CD2 4.12Å; A293-F297 HydrophobicContact CB-CE2 4.12Å; A293-F297 WeakPolarHBondContact O-CB 3.48Å; A293-F297 WeakPolarHBondContact O-CD2 3.47Å; A293-F297 PolarHBondContact O-N 3.35Å; A293-T311 HydrophobicContact CB-CG2 3.94Å
294S86.9Confident87.7Confident27 Ų2724.3 Ų24.319%0.18913%0.132CC..Hα-helixtrans-60.8-37.8176-57.50000112.9N30 Y292 K298N30-S294 PolarHBondContact ND2-OG 3.49Å; N30-S294 WeakPolarHBondContact OD1-CB 3.45Å; N30-S294 PolarHBondContact OD1-N 3.28Å; N30-S294 PolarHBondContact OD1-OG 2.96Å; Y292-S294 PolarHBondContact O-N 3.29Å; Y292-S294 VanDerWaalsContact O-N 3.14Å; S294-K298 WeakPolarHBondContact O-CB 3.38Å; S294-K298 PolarHBondContact O-N 3.49Å; S294-K298 VanDerWaalsContact O-N 3.09Å
295Y86.7Confident87.3Confident39 Ų3931.6 Ų31.615%0.15317%0.166CC..Hα-helixtrans-68.6-47.2174.8-72.9-88.3000111.3T33 Q37 Y292 A293 F297 K298 E299T33-Y295 HydrophobicContact CG2-CE2 3.79Å; Q37-Y295 PolarHBondContact NE2-OH 3.01Å; Y292-Y295 AromaticContact CD1-CD2 3.8Å; Y292-Y295 HydrophobicContact CD1-CD2 3.8Å; Y292-Y295 AromaticContact CD1-CE2 3.88Å; Y292-Y295 HydrophobicContact CD1-CE2 3.88Å; Y292-Y295 HydrophobicContact CG-CD2 4.32Å; Y292-Y295 WeakPolarHBondContact O-CB 3.17Å; Y292-Y295 PolarHBondContact O-N 3.46Å; A293-Y295 VanDerWaalsContact C-N 3.32Å; A293-Y295 PolarHBondContact O-N 2.91Å; Y295-F297 PolarHBondContact O-N 3.05Å; Y295-K298 PolarHBondContact O-N 3.29Å; Y295-E299 WeakPolarHBondContact O-CB 3.3Å; Y295-E299 WeakPolarHBondContact O-CG 3.5Å; Y295-E299 PolarHBondContact O-N 2.9Å
296V88.8Confident87.2Confident5 Ų536.4 Ų36.43%0.0319%0.188CC..Hα-helixtrans-62.9-46.3-177.5179.60000111.2Y292 A293 A300 F352 I373 F424 F436Y292-V296 PolarHBondContact O-N 3.06Å; Y292-V296 VanDerWaalsContact O-N 3.12Å; A293-V296 PolarHBondContact O-N 2.87Å; V296-A300 WeakPolarHBondContact O-CB 3.48Å; V296-A300 PolarHBondContact O-N 2.84Å; V296-F352 HydrophobicContact CG1-CZ 4.25Å; V296-I373 HydrophobicContact CG1-CD1 3.52Å; V296-I373 HydrophobicContact CG1-CG1 4.34Å; V296-F424 HydrophobicContact CG2-CE1 3.67Å; V296-F424 HydrophobicContact CG2-CZ 3.72Å; V296-F436 HydrophobicContact CG1-CE2 4.16Å; V296-F436 HydrophobicContact CG1-CZ 4.35Å
297F88.9Confident87.1Confident0 Ų036.7 Ų36.70%019%0.19CC..Hα-helixtrans-74.6-29.9-178.8-71.9-55.3000113.2A293 Y295 A300 G301 I302 I307 V310 T314 M370 I373 F374A293-F297 HydrophobicContact CB-CD2 4.12Å; A293-F297 HydrophobicContact CB-CE2 4.12Å; A293-F297 WeakPolarHBondContact O-CB 3.48Å; A293-F297 WeakPolarHBondContact O-CD2 3.47Å; A293-F297 PolarHBondContact O-N 3.35Å; Y295-F297 PolarHBondContact O-N 3.05Å; F297-A300 PolarHBondContact O-N 3.47Å; F297-G301 PolarHBondContact O-N 3.43Å; F297-I302 HydrophobicContact CB-CB 4.28Å; F297-I302 HydrophobicContact CB-CD1 4.1Å; F297-I302 HydrophobicContact CB-CG1 4.46Å; F297-I302 HydrophobicContact CD1-CD1 3.44Å; F297-I302 VanDerWaalsContact CD1-CD1 3.44Å; F297-I302 HydrophobicContact CD1-CG1 4.48Å; F297-I302 HydrophobicContact CE1-CD1 4.18Å; F297-I302 HydrophobicContact CG-CD1 4.07Å; F297-I302 WeakPolarHBondContact O-CB 3.47Å; F297-I302 PolarHBondContact O-N 2.68Å; F297-I307 HydrophobicContact CB-CD1 4.33Å; F297-I307 HydrophobicContact CB-CG1 3.97Å; F297-I307 HydrophobicContact CB-CG2 4.43Å; F297-V310 HydrophobicContact CD1-CG1 3.83Å; F297-V310 HydrophobicContact CD2-CG1 4.15Å; F297-V310 HydrophobicContact CE1-CG1 3.48Å; F297-V310 VanDerWaalsContact CE1-CG1 3.48Å; F297-V310 HydrophobicContact CE2-CG1 3.86Å; F297-V310 HydrophobicContact CG-CG1 4.16Å; F297-V310 HydrophobicContact CZ-CG1 3.51Å; F297-T314 HydrophobicContact CE2-CG2 3.81Å; F297-T314 HydrophobicContact CZ-CG2 3.55Å; F297-M370 HydrophobicContact CE1-CG 4.49Å; F297-I373 HydrophobicContact CD1-CD1 3.82Å; F297-I373 HydrophobicContact CE1-CB 4.28Å; F297-I373 HydrophobicContact CE1-CD1 3.42Å; F297-I373 VanDerWaalsContact CE1-CD1 3.42Å; F297-I373 HydrophobicContact CE1-CG1 4.46Å; F297-I373 HydrophobicContact CE1-CG2 4.18Å; F297-I373 HydrophobicContact CZ-CB 4.46Å; F297-I373 HydrophobicContact CZ-CD1 4.14Å; F297-I373 HydrophobicContact CZ-CG2 3.89Å; F297-F374 HydrophobicContact CZ-CE1 4.28Å
298K86.5Confident87Confident113 Ų11337.9 Ų37.949%0.49120%0.195SC..Hα-helixtrans-67.1-43.2172.4-177.3169.1178163.60111.6S294 Y295 A300 G301 E304 I307S294-K298 WeakPolarHBondContact O-CB 3.38Å; S294-K298 PolarHBondContact O-N 3.49Å; S294-K298 VanDerWaalsContact O-N 3.09Å; Y295-K298 PolarHBondContact O-N 3.29Å; K298-A300 PolarHBondContact O-N 3.3Å; K298-G301 PolarHBondContact O-N 3.49Å; K298-G301 VanDerWaalsContact O-N 3.12Å; K298-E304 WeakPolarHBondContact CE-OE1 3.33Å; K298-E304 IonicContact NZ-OE1 3.62Å; K298-E304 PolarHBondContact NZ-OE1 2.86Å; K298-I307 HydrophobicContact CB-CD1 4.04Å
299E83.2Confident87.1Confident82 Ų8243.8 Ų43.838%0.38322%0.218SC..Hα-helixtrans-65.3-28.7173.4-73.6-61.1142.300112.6Y295 G301 V428Y295-E299 WeakPolarHBondContact O-CB 3.3Å; Y295-E299 WeakPolarHBondContact O-CG 3.5Å; Y295-E299 PolarHBondContact O-N 2.9Å; E299-G301 PolarHBondContact O-N 3.49Å; E299-V428 HydrophobicContact CB-CG1 4.47Å; E299-V428 HydrophobicContact CG-CG1 3.7Å
300A82.9Confident87.1Confident0 Ų044.5 Ų44.50%022%0.223CC..THydrogen-bonded Turntrans-79.65.8173.600000114.3V296 F297 K298 L356 S366V296-A300 WeakPolarHBondContact O-CB 3.48Å; V296-A300 PolarHBondContact O-N 2.84Å; F297-A300 PolarHBondContact O-N 3.47Å; K298-A300 PolarHBondContact O-N 3.3Å; A300-L356 HydrophobicContact CB-CD2 4.22Å; A300-S366 WeakPolarHBondContact O-CA 3.37Å; A300-S366 WeakPolarHBondContact O-CB 3.3Å; A300-S366 PolarHBondContact O-OG 3.5Å
301G83.7Confident87.1Confident41 Ų4144.7 Ų44.742%0.42322%0.224SC..THydrogen-bonded Turntrans80.213.817600000115.6F297 K298 E299 E359F297-G301 PolarHBondContact O-N 3.43Å; K298-G301 PolarHBondContact O-N 3.49Å; K298-G301 VanDerWaalsContact O-N 3.12Å; E299-G301 PolarHBondContact O-N 3.49Å; G301-E359 WeakPolarHBondContact CA-OE1 3.42Å; G301-E359 PolarHBondContact N-OE1 3Å; G301-E359 VanDerWaalsContact N-OE1 3.13Å
302I87.8Confident87.4Confident16 Ų1646.2 Ų46.28%0.08223%0.232CC..  trans-78.4135.8176.4-54.7-172.3000109.7F297 Q306 I307 V310 M370F297-I302 HydrophobicContact CB-CB 4.28Å; F297-I302 HydrophobicContact CB-CD1 4.1Å; F297-I302 HydrophobicContact CB-CG1 4.46Å; F297-I302 HydrophobicContact CD1-CD1 3.44Å; F297-I302 VanDerWaalsContact CD1-CD1 3.44Å; F297-I302 HydrophobicContact CD1-CG1 4.48Å; F297-I302 HydrophobicContact CE1-CD1 4.18Å; F297-I302 HydrophobicContact CG-CD1 4.07Å; F297-I302 WeakPolarHBondContact O-CB 3.47Å; F297-I302 PolarHBondContact O-N 2.68Å; I302-Q306 HydrophobicContact CG2-CB 3.95Å; I302-I307 HydrophobicContact CB-CG1 4.43Å; I302-I307 HydrophobicContact CG2-CG1 4.18Å; I302-V310 HydrophobicContact CD1-CG1 3.98Å; I302-V310 HydrophobicContact CD1-CG2 4.31Å; I302-V310 HydrophobicContact CG2-CG2 4.26Å; I302-M370 HydrophobicContact CD1-CB 4.14Å; I302-M370 HydrophobicContact CD1-CG 4.35Å; I302-M370 HydrophobicContact CD1-SD 4.26Å
303S86.8Confident87.5Confident58 Ų5847.1 Ų47.141%0.40624%0.241SC..  trans-64.5141.8178.665.70000111.8E305 Q306 I307S303-E305 PolarHBondContact O-N 3.06Å; S303-E305 VanDerWaalsContact O-N 3.11Å; S303-Q306 PolarHBondContact O-N 2.64Å; S303-Q306 VanDerWaalsContact OG-CG 3.31Å; S303-Q306 WeakPolarHBondContact OG-CG 3.19Å; S303-Q306 PolarHBondContact OG-OE1 3.39Å; S303-I307 WeakPolarHBondContact O-CG1 3.42Å; S303-I307 PolarHBondContact O-N 3.05Å
304E81.8Confident87.7Confident118 Ų11847.1 Ų47.155%0.55124%0.241SC*.Hα-helixtrans-58-30.9-175.1-63.5-172.5172.100113.3K298 Q306 I307K298-E304 WeakPolarHBondContact CE-OE1 3.33Å; K298-E304 IonicContact NZ-OE1 3.62Å; K298-E304 PolarHBondContact NZ-OE1 2.86Å; E304-Q306 VanDerWaalsContact C-N 3.29Å; E304-Q306 PolarHBondContact O-N 3.28Å; E304-I307 HydrophobicContact CG-CD1 4.47Å
305E82.7Confident87.9Confident153 Ų15345.9 Ų45.972%0.71523%0.232SC*.Hα-helixtrans-68.2-27.5176.3-59.5-170.2161.400113S303S303-E305 PolarHBondContact O-N 3.06Å; S303-E305 VanDerWaalsContact O-N 3.11Å
306Q87.1Confident88.2Confident102 Ų10246.9 Ų46.948%0.47724%0.243SC..Hα-helixtrans-93-20.7-179-68.2178.5-19.500113I302 S303 E304 Q308 Y309 V310I302-Q306 HydrophobicContact CG2-CB 3.95Å; S303-Q306 PolarHBondContact O-N 2.64Å; S303-Q306 VanDerWaalsContact OG-CG 3.31Å; S303-Q306 WeakPolarHBondContact OG-CG 3.19Å; S303-Q306 PolarHBondContact OG-OE1 3.39Å; E304-Q306 VanDerWaalsContact C-N 3.29Å; E304-Q306 PolarHBondContact O-N 3.28Å; Q306-Q308 VanDerWaalsContact C-N 3.29Å; Q306-Q308 PolarHBondContact O-N 3.1Å; Q306-Y309 PolarHBondContact O-N 2.64Å; Q306-Y309 VanDerWaalsContact O-N 3.08Å; Q306-V310 WeakPolarHBondContact O-CG2 3.42Å; Q306-V310 PolarHBondContact O-N 3.46Å
307I89.4Confident88.5Confident6 Ų647.8 Ų47.83%0.03125%0.249CC..Hα-helixtrans-53.2-44.2-175.7-73.2179.5000112F297 K298 I302 S303 E304 Y309 V310 T311F297-I307 HydrophobicContact CB-CD1 4.33Å; F297-I307 HydrophobicContact CB-CG1 3.97Å; F297-I307 HydrophobicContact CB-CG2 4.43Å; K298-I307 HydrophobicContact CB-CD1 4.04Å; I302-I307 HydrophobicContact CB-CG1 4.43Å; I302-I307 HydrophobicContact CG2-CG1 4.18Å; S303-I307 WeakPolarHBondContact O-CG1 3.42Å; S303-I307 PolarHBondContact O-N 3.05Å; E304-I307 HydrophobicContact CG-CD1 4.47Å; I307-Y309 PolarHBondContact O-N 2.67Å; I307-V310 PolarHBondContact O-N 3.28Å; I307-T311 VanDerWaalsContact O-CB 3.29Å; I307-T311 WeakPolarHBondContact O-CB 3.49Å; I307-T311 PolarHBondContact O-N 2.87Å; I307-T311 PolarHBondContact O-OG1 3.37Å
308Q87.1Confident88.6Confident35 Ų3548.2 Ų48.216%0.16425%0.251CS..Hα-helixtrans-63.8-40.8-178.7-65.7-174.5-15.300112L175 Q306 T311 I312L175-Q308 HydrophobicContact CD2-CB 4.16Å; Q306-Q308 VanDerWaalsContact C-N 3.29Å; Q306-Q308 PolarHBondContact O-N 3.1Å; Q308-T311 WeakPolarHBondContact O-CB 3.28Å; Q308-T311 PolarHBondContact O-N 2.96Å; Q308-I312 PolarHBondContact O-N 3.05Å
309Y90.6Very high88.9Confident123 Ų12345.7 Ų45.748%0.48224%0.24SC..Hα-helixtrans-67.9-43.7177-67.2-79.2000112.4L175 E177 Q306 I307 T311 I312L175-Y309 HydrophobicContact CD2-CD1 4.19Å; L175-Y309 HydrophobicContact CD2-CE1 4.09Å; E177-Y309 PolarHBondContact OE1-OH 3.36Å; E177-Y309 PolarHBondContact OE2-OH 2.87Å; Q306-Y309 PolarHBondContact O-N 2.64Å; Q306-Y309 VanDerWaalsContact O-N 3.08Å; I307-Y309 PolarHBondContact O-N 2.67Å; Y309-T311 VanDerWaalsContact C-N 3.26Å; Y309-T311 PolarHBondContact O-N 3.31Å; Y309-I312 PolarHBondContact O-N 2.94Å
310V91.8Very high89.4Confident16 Ų1644.8 Ų44.810%0.09724%0.24CC..Hα-helixtrans-62.6-37.6175.5170.90000110.8F297 I302 Q306 I307 I312 G313 T314 M370 F374F297-V310 HydrophobicContact CD1-CG1 3.83Å; F297-V310 HydrophobicContact CD2-CG1 4.15Å; F297-V310 HydrophobicContact CE1-CG1 3.48Å; F297-V310 VanDerWaalsContact CE1-CG1 3.48Å; F297-V310 HydrophobicContact CE2-CG1 3.86Å; F297-V310 HydrophobicContact CG-CG1 4.16Å; F297-V310 HydrophobicContact CZ-CG1 3.51Å; I302-V310 HydrophobicContact CD1-CG1 3.98Å; I302-V310 HydrophobicContact CD1-CG2 4.31Å; I302-V310 HydrophobicContact CG2-CG2 4.26Å; Q306-V310 WeakPolarHBondContact O-CG2 3.42Å; Q306-V310 PolarHBondContact O-N 3.46Å; I307-V310 PolarHBondContact O-N 3.28Å; V310-I312 VanDerWaalsContact C-N 3.33Å; V310-I312 PolarHBondContact O-N 3.43Å; V310-G313 WeakPolarHBondContact O-CA 3.43Å; V310-G313 PolarHBondContact O-N 3.45Å; V310-T314 PolarHBondContact O-N 3.49Å; V310-M370 HydrophobicContact CB-CE 4.23Å; V310-M370 HydrophobicContact CB-SD 4.5Å; V310-M370 HydrophobicContact CG1-CE 3.83Å; V310-M370 HydrophobicContact CG1-CG 3.86Å; V310-M370 HydrophobicContact CG1-SD 3.84Å; V310-M370 HydrophobicContact CG2-CE 3.75Å; V310-M370 HydrophobicContact CG2-SD 3.86Å; V310-F374 HydrophobicContact CG1-CE1 4.15Å; V310-F374 HydrophobicContact CG1-CZ 4.07Å; V310-F374 WeakPolarHBondContact O-CE1 3.39Å; V310-F374 WeakPolarHBondContact O-CZ 3.23Å
311T91.1Very high89.8Confident5 Ų544.9 Ų44.93%0.03124%0.241CC..Hα-helixtrans-61.5-39.4177.6-59.70000111.3Q171 A293 I307 Q308 Y309 G313 T314 G315Q171-T311 HydrophobicContact CG-CG2 3.93Å; Q171-T311 PolarHBondContact NE2-O 3.25Å; Q171-T311 PolarHBondContact OE1-O 3.2Å; A293-T311 HydrophobicContact CB-CG2 3.94Å; I307-T311 VanDerWaalsContact O-CB 3.29Å; I307-T311 WeakPolarHBondContact O-CB 3.49Å; I307-T311 PolarHBondContact O-N 2.87Å; I307-T311 PolarHBondContact O-OG1 3.37Å; Q308-T311 WeakPolarHBondContact O-CB 3.28Å; Q308-T311 PolarHBondContact O-N 2.96Å; Y309-T311 VanDerWaalsContact C-N 3.26Å; Y309-T311 PolarHBondContact O-N 3.31Å; T311-G313 PolarHBondContact O-N 2.93Å; T311-T314 WeakPolarHBondContact O-CB 3.42Å; T311-T314 PolarHBondContact O-N 2.96Å; T311-T314 PolarHBondContact O-OG1 3.21Å; T311-G315 PolarHBondContact O-N 3Å
312I93.3Very high90.1Very high31 Ų3143 Ų4316%0.15922%0.222CC..Hα-helixtrans-58.3-34.8173.8-64.5167.6000112Q171 V172 L175 Q308 Y309 V310 T314 G315 T316Q171-I312 HydrophobicContact CB-CG1 3.82Å; V172-I312 HydrophobicContact CG2-CD1 4.32Å; V172-I312 HydrophobicContact CG2-CG1 4.49Å; V172-I312 HydrophobicContact CG2-CG2 4.37Å; L175-I312 HydrophobicContact CD1-CD1 3.79Å; L175-I312 HydrophobicContact CD2-CD1 3.64Å; L175-I312 HydrophobicContact CG-CD1 3.79Å; Q308-I312 PolarHBondContact O-N 3.05Å; Y309-I312 PolarHBondContact O-N 2.94Å; V310-I312 VanDerWaalsContact C-N 3.33Å; V310-I312 PolarHBondContact O-N 3.43Å; I312-T314 VanDerWaalsContact C-N 3.26Å; I312-T314 PolarHBondContact O-N 3.28Å; I312-G315 PolarHBondContact O-N 3.24Å; I312-T316 WeakPolarHBondContact O-CB 3.21Å; I312-T316 PolarHBondContact O-N 3.27Å; I312-T316 PolarHBondContact O-OG1 3.44Å
313G92.1Very high90.1Very high20 Ų2045.2 Ų45.221%0.20623%0.233CC..Hα-helixtrans-58.4-38.517400000112.4V310 T311 T316 C317V310-G313 WeakPolarHBondContact O-CA 3.43Å; V310-G313 PolarHBondContact O-N 3.45Å; T311-G313 PolarHBondContact O-N 2.93Å; G313-T316 PolarHBondContact O-N 3.49Å; G313-C317 PolarHBondContact O-N 3.44Å; G313-C317 PolarHBondContact O-SG 3.11Å
314T92.3Very high90.2Very high0 Ų046.9 Ų46.90%024%0.235CC..Hα-helixtrans-62.9-47.3177.969.90000112.7Q171 F297 V310 T311 I312 T316 C317 E318 I373 F374 I377Q171-T314 PolarHBondContact NE2-OG1 3.1Å; F297-T314 HydrophobicContact CE2-CG2 3.81Å; F297-T314 HydrophobicContact CZ-CG2 3.55Å; V310-T314 PolarHBondContact O-N 3.49Å; T311-T314 WeakPolarHBondContact O-CB 3.42Å; T311-T314 PolarHBondContact O-N 2.96Å; T311-T314 PolarHBondContact O-OG1 3.21Å; I312-T314 VanDerWaalsContact C-N 3.26Å; I312-T314 PolarHBondContact O-N 3.28Å; T314-T316 VanDerWaalsContact C-N 3.32Å; T314-T316 PolarHBondContact O-N 3.03Å; T314-C317 PolarHBondContact O-N 3.37Å; T314-E318 PolarHBondContact O-N 3.38Å; T314-E318 VanDerWaalsContact O-N 3.16Å; T314-I373 HydrophobicContact CG2-CG2 4.24Å; T314-F374 HydrophobicContact CG2-CD1 3.89Å; T314-F374 HydrophobicContact CG2-CE1 3.6Å; T314-I377 HydrophobicContact CG2-CD1 3.83Å
315G91.6Very high90.3Very high0 Ų041.3 Ų41.30%021%0.209CC..Hα-helixtrans-66.7-36.5177.600000111.6V168 Q171 T311 I312 C317 E318 F319V168-G315 VanDerWaalsContact CG2-O 3.26Å; V168-G315 WeakPolarHBondContact CG2-O 3.18Å; Q171-G315 VanDerWaalsContact OE1-CA 3.26Å; Q171-G315 VanDerWaalsContact OE1-N 3.14Å; T311-G315 PolarHBondContact O-N 3Å; I312-G315 PolarHBondContact O-N 3.24Å; G315-C317 VanDerWaalsContact C-N 3.33Å; G315-C317 PolarHBondContact O-N 3.14Å; G315-E318 PolarHBondContact O-N 3.36Å; G315-F319 WeakPolarHBondContact O-CB 3.49Å; G315-F319 PolarHBondContact O-N 3.31Å
316T93.9Very high90.3Very high61 Ų6135.8 Ų35.837%0.37419%0.185SC..Hα-helixtrans-65.1-38.7177.8-54.20000111.4I312 G313 T314 F319 T320I312-T316 WeakPolarHBondContact O-CB 3.21Å; I312-T316 PolarHBondContact O-N 3.27Å; I312-T316 PolarHBondContact O-OG1 3.44Å; G313-T316 PolarHBondContact O-N 3.49Å; T314-T316 VanDerWaalsContact C-N 3.32Å; T314-T316 PolarHBondContact O-N 3.03Å; T316-F319 PolarHBondContact O-N 3Å; T316-T320 WeakPolarHBondContact O-CB 3.46Å; T316-T320 WeakPolarHBondContact O-CG2 3.39Å; T316-T320 PolarHBondContact O-N 3.4Å; T316-T320 PolarHBondContact O-OG1 3.32Å
317C93.6Very high90.1Very high23 Ų2336.1 Ų36.116%0.15519%0.189CC..Hα-helixtrans-61.7-44.2173.4-69.10000111.5G313 T314 G315 T320 A321 I377 L378G313-C317 PolarHBondContact O-N 3.44Å; G313-C317 PolarHBondContact O-SG 3.11Å; T314-C317 PolarHBondContact O-N 3.37Å; G315-C317 VanDerWaalsContact C-N 3.33Å; G315-C317 PolarHBondContact O-N 3.14Å; C317-T320 PolarHBondContact O-OG1 3.44Å; C317-A321 WeakPolarHBondContact O-CB 3.45Å; C317-A321 PolarHBondContact O-N 3.45Å; C317-I377 HydrophobicContact CB-CG2 4.45Å; C317-L378 HydrophobicContact CB-CB 4.48Å
318E92Very high89.9Confident10 Ų1038.3 Ų38.35%0.04720%0.201CC..Hα-helixtrans-65.3-44.9176.7-168.8-178.9-154.800111.9A164 Y290 T314 G315 T320 A321 C322 I377A164-E318 HydrophobicContact CB-CB 4.36Å; A164-E318 HydrophobicContact CB-CG 3.93Å; Y290-E318 WeakPolarHBondContact CE2-OE2 3.38Å; Y290-E318 WeakPolarHBondContact OH-CB 3.37Å; Y290-E318 PolarHBondContact OH-OE2 3.12Å; T314-E318 PolarHBondContact O-N 3.38Å; T314-E318 VanDerWaalsContact O-N 3.16Å; G315-E318 PolarHBondContact O-N 3.36Å; E318-T320 PolarHBondContact O-N 3.35Å; E318-A321 PolarHBondContact O-N 3.19Å; E318-C322 WeakPolarHBondContact O-CB 3.1Å; E318-C322 PolarHBondContact O-N 3.42Å; E318-C322 PolarHBondContact O-SG 3.45Å; E318-C322 VanDerWaalsContact O-SG 3.41Å; E318-I377 HydrophobicContact CB-CG2 3.76Å; E318-I377 HydrophobicContact CG-CG2 4.46Å
319F92.4Very high89.7Confident60 Ų6036.7 Ų36.726%0.26319%0.193SC..Hα-helixtrans-60.2-46.5-179.8-179.6-112.7000111.9V161 A164 F165 V168 G315 T316 C322 I323V161-F319 HydrophobicContact CG1-CD2 4.2Å; V161-F319 HydrophobicContact CG1-CE2 3.63Å; V161-F319 HydrophobicContact CG1-CZ 4.48Å; A164-F319 HydrophobicContact CB-CB 4.11Å; A164-F319 HydrophobicContact CB-CD2 4.25Å; F165-F319 HydrophobicContact CB-CD2 3.95Å; F165-F319 HydrophobicContact CB-CE2 3.76Å; F165-F319 HydrophobicContact CD2-CE2 4.21Å; F165-F319 HydrophobicContact CD2-CZ 4.37Å; F165-F319 HydrophobicContact CG-CE2 4.37Å; V168-F319 HydrophobicContact CG2-CB 4.12Å; G315-F319 WeakPolarHBondContact O-CB 3.49Å; G315-F319 PolarHBondContact O-N 3.31Å; T316-F319 PolarHBondContact O-N 3Å; F319-C322 PolarHBondContact O-N 3.34Å; F319-I323 HydrophobicContact CD1-CD1 4.06Å; F319-I323 HydrophobicContact CD2-CD1 4.49Å; F319-I323 HydrophobicContact CE1-CD1 3.62Å; F319-I323 HydrophobicContact CE2-CD1 4.09Å; F319-I323 HydrophobicContact CG-CD1 4.49Å; F319-I323 HydrophobicContact CZ-CD1 3.64Å; F319-I323 WeakPolarHBondContact O-CG1 3.36Å; F319-I323 PolarHBondContact O-N 2.57Å; F319-I323 VanDerWaalsContact O-N 3.16Å
320T92.8Very high89.2Confident62 Ų6235.5 Ų35.538%0.3819%0.192SC..Hα-helixtrans-65.3-41.7176.151.70000111.9T316 C317 E318 I323 M324T316-T320 WeakPolarHBondContact O-CB 3.46Å; T316-T320 WeakPolarHBondContact O-CG2 3.39Å; T316-T320 PolarHBondContact O-N 3.4Å; T316-T320 PolarHBondContact O-OG1 3.32Å; C317-T320 PolarHBondContact O-OG1 3.44Å; E318-T320 PolarHBondContact O-N 3.35Å; T320-I323 PolarHBondContact O-N 3.24Å; T320-M324 WeakPolarHBondContact O-CG 3.2Å; T320-M324 PolarHBondContact O-N 3.33Å
321A91.8Very high88.8Confident2 Ų244 Ų442%0.01722%0.222CC..Hα-helixtrans-61.7-43.3176.500000112.8C317 E318 I323 M324 C325 L378 M382C317-A321 WeakPolarHBondContact O-CB 3.45Å; C317-A321 PolarHBondContact O-N 3.45Å; E318-A321 PolarHBondContact O-N 3.19Å; A321-I323 PolarHBondContact O-N 2.9Å; A321-M324 PolarHBondContact O-N 3.17Å; A321-C325 WeakPolarHBondContact O-CB 3.46Å; A321-C325 PolarHBondContact O-N 3.39Å; A321-L378 HydrophobicContact CB-CG 4.16Å; A321-L378 WeakPolarHBondContact CB-O 3.48Å; A321-M382 HydrophobicContact CB-CG 4.02Å
322C89.4Confident88.5Confident3 Ų349.7 Ų49.72%0.0225%0.247CC..Hα-helixtrans-62.8-41.4177.2-78.60000112.1V161 A164 E318 F319 C325 N326V161-C322 HydrophobicContact CG2-CB 4.2Å; A164-C322 HydrophobicContact CB-CB 4.46Å; E318-C322 WeakPolarHBondContact O-CB 3.1Å; E318-C322 PolarHBondContact O-N 3.42Å; E318-C322 PolarHBondContact O-SG 3.45Å; E318-C322 VanDerWaalsContact O-SG 3.41Å; F319-C322 PolarHBondContact O-N 3.34Å; C322-C325 PolarHBondContact O-N 2.77Å; C322-N326 PolarHBondContact O-N 3.47Å; C322-N326 VanDerWaalsContact O-N 3.08Å
323I88.7Confident88.1Confident61 Ų6148.2 Ų48.231%0.31324%0.24SC..Hα-helixtrans-63.6-47.1174.7-66.8169.1000110.4V161 F319 T320 A321 C325 N326 L327V161-I323 HydrophobicContact CG1-CG1 3.98Å; V161-I323 HydrophobicContact CG2-CG1 4.44Å; F319-I323 HydrophobicContact CD1-CD1 4.06Å; F319-I323 HydrophobicContact CD2-CD1 4.49Å; F319-I323 HydrophobicContact CE1-CD1 3.62Å; F319-I323 HydrophobicContact CE2-CD1 4.09Å; F319-I323 HydrophobicContact CG-CD1 4.49Å; F319-I323 HydrophobicContact CZ-CD1 3.64Å; F319-I323 WeakPolarHBondContact O-CG1 3.36Å; F319-I323 PolarHBondContact O-N 2.57Å; F319-I323 VanDerWaalsContact O-N 3.16Å; T320-I323 PolarHBondContact O-N 3.24Å; A321-I323 PolarHBondContact O-N 2.9Å; I323-C325 VanDerWaalsContact C-N 3.33Å; I323-C325 PolarHBondContact O-N 3.34Å; I323-N326 PolarHBondContact O-N 3.34Å; I323-L327 PolarHBondContact O-N 2.96Å
324M88Confident87.9Confident94 Ų9448.8 Ų48.846%0.46324%0.236SC..Hα-helixtrans-61.6-41.5178.7-72.2-62.5111.600112T320 A321 L327 L328T320-M324 WeakPolarHBondContact O-CG 3.2Å; T320-M324 PolarHBondContact O-N 3.33Å; A321-M324 PolarHBondContact O-N 3.17Å; M324-L327 HydrophobicContact CE-CD1 4.2Å; M324-L327 PolarHBondContact O-N 3.37Å; M324-L328 WeakPolarHBondContact O-CB 3.46Å; M324-L328 VanDerWaalsContact O-CG 3.3Å; M324-L328 WeakPolarHBondContact O-CG 3.34Å; M324-L328 PolarHBondContact O-N 3.22Å; M324-L328 VanDerWaalsContact O-N 3.1Å
325C85.3Confident87.8Confident0 Ų052.8 Ų52.80%025%0.251CS..Hα-helixtrans-65-42.1178.9-171.80000112.1A321 C322 I323 L327 L328 V329 M382 A386A321-C325 WeakPolarHBondContact O-CB 3.46Å; A321-C325 PolarHBondContact O-N 3.39Å; C322-C325 PolarHBondContact O-N 2.77Å; I323-C325 VanDerWaalsContact C-N 3.33Å; I323-C325 PolarHBondContact O-N 3.34Å; C325-L327 PolarHBondContact O-N 3.04Å; C325-L327 VanDerWaalsContact O-N 3.17Å; C325-L328 CarbonylContact O-C 3.58Å; C325-L328 PolarHBondContact O-N 3.43Å; C325-V329 WeakPolarHBondContact O-CB 3.41Å; C325-V329 PolarHBondContact O-N 2.99Å; C325-M382 PolarHBondContact SG-O 3.22Å; C325-A386 HydrophobicContact CB-CB 3.25Å; C325-A386 WeakPolarHBondContact SG-CB 3.38Å
326N82.2Confident87.7Confident37 Ų3758 Ų5820%0.19827%0.274CS..Hα-helixtrans-56.8-35.7177.6-164.17.9000111.6Q157 C322 I323Q157-N326 PolarHBondContact NE2-OD1 3.35Å; Q157-N326 PolarHBondContact OE1-OD1 3.44Å; C322-N326 PolarHBondContact O-N 3.47Å; C322-N326 VanDerWaalsContact O-N 3.08Å; I323-N326 PolarHBondContact O-N 3.34Å
327L83.4Confident87.6Confident109 Ų10956.1 Ų56.157%0.57126%0.26SS*.Hα-helixtrans-75.3-29.4175.1-60.4175.7000113.7I323 M324 C325I323-L327 PolarHBondContact O-N 2.96Å; M324-L327 HydrophobicContact CE-CD1 4.2Å; M324-L327 PolarHBondContact O-N 3.37Å; C325-L327 PolarHBondContact O-N 3.04Å; C325-L327 VanDerWaalsContact O-N 3.17Å
328L84.9Confident87.5Confident52 Ų5255 Ų5527%0.27225%0.253SS..Hα-helixtrans-96-29.6-172.5-70.6175.1000114M324 C325 E330 R331 K332 M337 M382M324-L328 WeakPolarHBondContact O-CB 3.46Å; M324-L328 VanDerWaalsContact O-CG 3.3Å; M324-L328 WeakPolarHBondContact O-CG 3.34Å; M324-L328 PolarHBondContact O-N 3.22Å; M324-L328 VanDerWaalsContact O-N 3.1Å; C325-L328 CarbonylContact O-C 3.58Å; C325-L328 PolarHBondContact O-N 3.43Å; L328-E330 VanDerWaalsContact C-N 3.29Å; L328-E330 PolarHBondContact O-N 3.41Å; L328-R331 CarbonylContact O-C 3.59Å; L328-R331 WeakPolarHBondContact O-CA 3.02Å; L328-R331 WeakPolarHBondContact O-CB 3.24Å; L328-R331 PolarHBondContact O-N 3.32Å; L328-K332 PolarHBondContact O-N 3.37Å; L328-M337 HydrophobicContact CB-SD 4.13Å; L328-M382 HydrophobicContact CD1-CE 4.14Å
329V82.6Confident87.5Confident2 Ų257.1 Ų57.11%0.01226%0.264CS..Hα-helixtrans-61.4-38.3-172.571.20000112.1C325 R331 G333 R334 V388C325-V329 WeakPolarHBondContact O-CB 3.41Å; C325-V329 PolarHBondContact O-N 2.99Å; V329-R331 VanDerWaalsContact C-N 3.26Å; V329-R331 PolarHBondContact O-N 2.95Å; V329-G333 PolarHBondContact O-N 2.89Å; V329-R334 HydrophobicContact CG2-CG 4.2Å; V329-R334 PolarHBondContact O-NH1 3.1Å; V329-V388 HydrophobicContact CG2-CG2 3.92Å
330E80.4Confident87.6Confident98 Ų9855.4 Ų55.446%0.45826%0.262SS..Hα-helixtrans-70.6-27.2177.5-63.1-166165.600111.3L328 K458L328-E330 VanDerWaalsContact C-N 3.29Å; L328-E330 PolarHBondContact O-N 3.41Å; E330-K458 WeakPolarHBondContact O-CE 3.14Å; E330-K458 PolarHBondContact O-NZ 2.73Å
331R83.3Confident87.6Confident194 Ų19452.6 Ų52.673%0.73225%0.246SC*.Hα-helixtrans-86.3-40.9179.8-63.8-176179.8-176.71113.5L328 V329 K458L328-R331 CarbonylContact O-C 3.59Å; L328-R331 WeakPolarHBondContact O-CA 3.02Å; L328-R331 WeakPolarHBondContact O-CB 3.24Å; L328-R331 PolarHBondContact O-N 3.32Å; V329-R331 VanDerWaalsContact C-N 3.26Å; V329-R331 PolarHBondContact O-N 2.95Å; R331-K458 PolarHBondContact O-NZ 2.98Å
332K84.8Confident87.8Confident124 Ų12452.5 Ų52.554%0.53925%0.246SC..Hα-helixtrans-100.4-18.2-172.2-67.3-69.6-174.5175.20114.4L328 F336 M337L328-K332 PolarHBondContact O-N 3.37Å; K332-F336 HydrophobicContact CB-CD1 4.04Å; K332-M337 HydrophobicContact CB-CE 3.93Å; K332-M337 HydrophobicContact CB-CG 4.33Å; K332-M337 HydrophobicContact CB-SD 4.38Å; K332-M337 HydrophobicContact CG-CE 4.19Å
333G84.8Confident88.1Confident1 Ų155.7 Ų55.71%0.0126%0.262CS..  trans91.7162.5-177.600000112.8V329 M337V329-G333 PolarHBondContact O-N 2.89Å; G333-M337 WeakPolarHBondContact O-CG 3Å
334R86.8Confident88.4Confident32 Ų3256.6 Ų56.612%0.12127%0.267CS..Hα-helixtrans-80.5-43.9-169.8-72.672.5171.6141.75110.7V329 F336 M337 L338 V388 E395 E456 T457V329-R334 HydrophobicContact CG2-CG 4.2Å; V329-R334 PolarHBondContact O-NH1 3.1Å; R334-F336 PolarHBondContact O-N 3.39Å; R334-M337 PolarHBondContact O-N 3.49Å; R334-L338 WeakPolarHBondContact O-CG 3.05Å; R334-L338 PolarHBondContact O-N 3.41Å; R334-V388 HydrophobicContact CB-CG1 3.69Å; R334-V388 HydrophobicContact CG-CG1 3.82Å; R334-E395 IonicContact CZ-OE1 2.71Å; R334-E395 IonicContact NE-OE1 2.7Å; R334-E395 PolarHBondContact NE-OE1 3.19Å; R334-E395 VanDerWaalsContact NE-OE1 3.13Å; R334-E395 IonicContact NE-OE2 2.68Å; R334-E395 IonicContact NH2-OE1 3.07Å; R334-E395 PolarHBondContact NH2-OE1 3.07Å; R334-E456 PolarHBondContact N-OE1 3.36Å; R334-E456 PolarHBondContact N-OE2 3.24Å; R334-T457 WeakPolarHBondContact CD-OG1 3.43Å
335R90.1Very high88.7Confident84 Ų8452.1 Ų52.132%0.31725%0.245SC..Hα-helixtrans-63-44.7-178.3-176.2-171.3-179.7-175.3-3.2111.3L338 M339 I450 G451 L454 E456R335-L338 PolarHBondContact O-N 3.37Å; R335-M339 VanDerWaalsContact O-CB 3.27Å; R335-M339 WeakPolarHBondContact O-CB 3.37Å; R335-M339 PolarHBondContact O-N 2.79Å; R335-I450 HydrophobicContact CG-CG2 3.86Å; R335-I450 PolarHBondContact NE-O 2.92Å; R335-G451 PolarHBondContact NH2-O 3.28Å; R335-L454 WeakPolarHBondContact CD-O 3.12Å; R335-L454 PolarHBondContact NE-O 2.82Å; R335-L454 VanDerWaalsContact NE-O 3.1Å; R335-E456 WeakPolarHBondContact CB-OE2 3.33Å; R335-E456 PolarHBondContact N-OE2 2.87Å
336F91.1Very high89.3Confident110 Ų11052.6 Ų52.648%0.48225%0.248SC..Hα-helixtrans-62.6-44.1179.3-178.8-93.3000112.1K332 R334 G340K332-F336 HydrophobicContact CB-CD1 4.04Å; R334-F336 PolarHBondContact O-N 3.39Å; F336-G340 PolarHBondContact O-N 2.56Å
337M91Very high90Very high20 Ų2054.6 Ų54.610%0.09926%0.261CS..Hα-helixtrans-66.1-44.2178.6-67.5-8192.800112.2L328 K332 G333 R334 G341 G383L328-M337 HydrophobicContact CB-SD 4.13Å; K332-M337 HydrophobicContact CB-CE 3.93Å; K332-M337 HydrophobicContact CB-CG 4.33Å; K332-M337 HydrophobicContact CB-SD 4.38Å; K332-M337 HydrophobicContact CG-CE 4.19Å; G333-M337 WeakPolarHBondContact O-CG 3Å; R334-M337 PolarHBondContact O-N 3.49Å; M337-G341 PolarHBondContact O-N 3.07Å; M337-G383 WeakPolarHBondContact O-CA 3.38Å
338L91.2Very high90.5Very high0 Ų053.1 Ų53.10%025%0.248CC..Hα-helixtrans-63-48.9177.1-73.8173.5000112.3I277 R334 R335 G341 F342 V388 L392 I450 L454I277-L338 HydrophobicContact CG2-CD1 4.48Å; R334-L338 WeakPolarHBondContact O-CG 3.05Å; R334-L338 PolarHBondContact O-N 3.41Å; R335-L338 PolarHBondContact O-N 3.37Å; L338-G341 PolarHBondContact O-N 3.21Å; L338-F342 VanDerWaalsContact O-CD2 3.29Å; L338-F342 WeakPolarHBondContact O-CD2 3.25Å; L338-F342 PolarHBondContact O-N 3.1Å; L338-F342 VanDerWaalsContact O-N 3.1Å; L338-V388 HydrophobicContact CD1-CG1 3.79Å; L338-V388 HydrophobicContact CD2-CB 3.97Å; L338-V388 HydrophobicContact CD2-CG1 3.91Å; L338-V388 HydrophobicContact CG-CB 4.21Å; L338-V388 HydrophobicContact CG-CG1 3.58Å; L338-L392 HydrophobicContact CD1-CD1 3.88Å; L338-I450 HydrophobicContact CB-CD1 3.88Å; L338-I450 HydrophobicContact CB-CG2 4.27Å; L338-L454 HydrophobicContact CD1-CD2 3.99Å
339M93.5Very high91Very high55 Ų5550.8 Ų50.827%0.27124%0.236SC..Hα-helixtrans-63.5-45.5179.8-172.8-177.771.400111.1R335 L343 A447 I450R335-M339 VanDerWaalsContact O-CB 3.27Å; R335-M339 WeakPolarHBondContact O-CB 3.37Å; R335-M339 PolarHBondContact O-N 2.79Å; M339-L343 HydrophobicContact CG-CD1 4.02Å; M339-L343 WeakPolarHBondContact O-CB 3.33Å; M339-L343 VanDerWaalsContact O-CG 3.28Å; M339-L343 WeakPolarHBondContact O-CG 3.33Å; M339-L343 PolarHBondContact O-N 2.6Å; M339-A447 HydrophobicContact CG-CB 4.49Å; M339-I450 HydrophobicContact CB-CG2 4.05Å
340G92.8Very high91.6Very high23 Ų2355.3 Ų55.324%0.23726%0.259CS..Hα-helixtrans-60.7-44.6177.200000112.6F336 L343 L344F336-G340 PolarHBondContact O-N 2.56Å; G340-L343 PolarHBondContact O-N 3.29Å; G340-L344 WeakPolarHBondContact O-CB 3.47Å; G340-L344 VanDerWaalsContact O-CG 3.27Å; G340-L344 WeakPolarHBondContact O-CG 3.39Å; G340-L344 PolarHBondContact O-N 3.11Å
341G93.6Very high92.2Very high4 Ų452.8 Ų52.84%0.04125%0.25CS..Hα-helixtrans-59.2-52.8177.200000112.5M337 L338 L343 L344 M345M337-G341 PolarHBondContact O-N 3.07Å; L338-G341 PolarHBondContact O-N 3.21Å; G341-L343 PolarHBondContact O-N 3.25Å; G341-L344 PolarHBondContact O-N 2.7Å; G341-M345 WeakPolarHBondContact O-CG 3.14Å; G341-M345 PolarHBondContact O-N 2.8Å
342F95.3Very high92.6Very high0 Ų043.8 Ų43.80%022%0.217CC..Hα-helixtrans-64.6-36.2178.9-78.2-57.9000113.6A280 C284 L338 M345 T346 P384 C443 A447 I450A280-F342 HydrophobicContact CB-CE1 4.23Å; A280-F342 HydrophobicContact CB-CE2 4.44Å; A280-F342 HydrophobicContact CB-CZ 3.73Å; C284-F342 HydrophobicContact CB-CE1 4.37Å; L338-F342 VanDerWaalsContact O-CD2 3.29Å; L338-F342 WeakPolarHBondContact O-CD2 3.25Å; L338-F342 PolarHBondContact O-N 3.1Å; L338-F342 VanDerWaalsContact O-N 3.1Å; F342-M345 HydrophobicContact CD1-SD 4.27Å; F342-M345 PolarHBondContact O-N 3.01Å; F342-T346 PolarHBondContact O-N 3.06Å; F342-T346 PolarHBondContact O-OG1 3.5Å; F342-P384 HydrophobicContact CD1-CG 3.94Å; F342-P384 HydrophobicContact CD2-CG 4.04Å; F342-P384 HydrophobicContact CE1-CB 4.34Å; F342-P384 HydrophobicContact CE1-CG 3.56Å; F342-P384 HydrophobicContact CE2-CB 4.34Å; F342-P384 HydrophobicContact CE2-CG 3.67Å; F342-P384 HydrophobicContact CG-CG 4.16Å; F342-P384 HydrophobicContact CZ-CB 3.92Å; F342-P384 HydrophobicContact CZ-CG 3.42Å; F342-P384 VanDerWaalsContact CZ-CG 3.42Å; F342-C443 HydrophobicContact CB-CB 4.49Å; F342-C443 WeakPolarHBondContact CB-O 3.31Å; F342-C443 HydrophobicContact CD1-CB 4.07Å; F342-A447 HydrophobicContact CB-CB 3.88Å; F342-I450 HydrophobicContact CD2-CD1 3.54Å; F342-I450 HydrophobicContact CE2-CD1 3.6Å
343L96Very high93Very high70 Ų7038.7 Ų38.737%0.36620%0.196SC..Hα-helixtrans-64.6-46.2174.6-75.8172.8000111.5M339 G340 G341 M345 T346 V347 L444 A447M339-L343 HydrophobicContact CG-CD1 4.02Å; M339-L343 WeakPolarHBondContact O-CB 3.33Å; M339-L343 VanDerWaalsContact O-CG 3.28Å; M339-L343 WeakPolarHBondContact O-CG 3.33Å; M339-L343 PolarHBondContact O-N 2.6Å; G340-L343 PolarHBondContact O-N 3.29Å; G341-L343 PolarHBondContact O-N 3.25Å; L343-M345 VanDerWaalsContact C-N 3.35Å; L343-M345 PolarHBondContact O-N 3.44Å; L343-T346 WeakPolarHBondContact O-CB 3.41Å; L343-T346 PolarHBondContact O-N 2.9Å; L343-T346 VanDerWaalsContact O-N 3.16Å; L343-V347 WeakPolarHBondContact O-CG2 3.42Å; L343-V347 PolarHBondContact O-N 3.38Å; L343-L444 HydrophobicContact CD2-CD1 4.34Å; L343-A447 HydrophobicContact CD2-CB 3.75Å; L343-A447 HydrophobicContact CG-CB 3.73Å
344L95.5Very high93.3Very high80 Ų8042.9 Ų42.942%0.41922%0.217SC..Hα-helixtrans-62.4-43.2177.2-72169.9000111.2G340 G341 T346 V347 W348 S379G340-L344 WeakPolarHBondContact O-CB 3.47Å; G340-L344 VanDerWaalsContact O-CG 3.27Å; G340-L344 WeakPolarHBondContact O-CG 3.39Å; G340-L344 PolarHBondContact O-N 3.11Å; G341-L344 PolarHBondContact O-N 2.7Å; L344-T346 VanDerWaalsContact C-N 3.27Å; L344-T346 PolarHBondContact O-N 3.32Å; L344-V347 PolarHBondContact O-N 2.81Å; L344-V347 VanDerWaalsContact O-N 3.16Å; L344-W348 PolarHBondContact O-N 3Å; L344-S379 WeakPolarHBondContact CB-OG 3.46Å
345M95.2Very high93.5Very high0 Ų041.4 Ų41.40%021%0.212CC..Hα-helixtrans-57.3-40.4173.6-70.2172.876.500112.1C284 G341 F342 L343 W348 A349 Y376 F380 P384 C443C284-M345 HydrophobicContact CB-CE 3.73Å; G341-M345 WeakPolarHBondContact O-CG 3.14Å; G341-M345 PolarHBondContact O-N 2.8Å; F342-M345 HydrophobicContact CD1-SD 4.27Å; F342-M345 PolarHBondContact O-N 3.01Å; L343-M345 VanDerWaalsContact C-N 3.35Å; L343-M345 PolarHBondContact O-N 3.44Å; M345-W348 PolarHBondContact O-N 2.98Å; M345-A349 VanDerWaalsContact O-CB 3.31Å; M345-A349 WeakPolarHBondContact O-CB 3.29Å; M345-A349 PolarHBondContact O-N 2.96Å; M345-Y376 HydrophobicContact CB-CD2 3.99Å; M345-Y376 HydrophobicContact CB-CE2 3.68Å; M345-Y376 HydrophobicContact CE-CD1 4.12Å; M345-Y376 HydrophobicContact CE-CE1 3.41Å; M345-Y376 VanDerWaalsContact CE-CE1 3.41Å; M345-Y376 HydrophobicContact CE-CE2 3.97Å; M345-Y376 WeakPolarHBondContact CE-OH 3.43Å; M345-Y376 HydrophobicContact CG-CD2 4.29Å; M345-Y376 HydrophobicContact CG-CE2 4.21Å; M345-Y376 WeakPolarHBondContact O-CD2 3.16Å; M345-Y376 WeakPolarHBondContact O-CE2 3.48Å; M345-F380 HydrophobicContact CE-CB 3.86Å; M345-F380 HydrophobicContact CE-CD2 3.91Å; M345-F380 HydrophobicContact CE-CG 4.31Å; M345-F380 HydrophobicContact SD-CB 3.81Å; M345-F380 HydrophobicContact SD-CD2 4.12Å; M345-F380 HydrophobicContact SD-CG 4.49Å; M345-P384 HydrophobicContact SD-CG 4.36Å; M345-C443 HydrophobicContact CB-CB 4.31Å
346T96.5Very high93.3Very high10 Ų1038 Ų386%0.06120%0.199CC..Hα-helixtrans-62.4-47.1175.7-540000111.4F342 L343 L344 W348 A349 I350 C443 L444F342-T346 PolarHBondContact O-N 3.06Å; F342-T346 PolarHBondContact O-OG1 3.5Å; L343-T346 WeakPolarHBondContact O-CB 3.41Å; L343-T346 PolarHBondContact O-N 2.9Å; L343-T346 VanDerWaalsContact O-N 3.16Å; L344-T346 VanDerWaalsContact C-N 3.27Å; L344-T346 PolarHBondContact O-N 3.32Å; T346-W348 PolarHBondContact O-N 2.92Å; T346-A349 PolarHBondContact O-N 3.2Å; T346-I350 HydrophobicContact CG2-CD1 4.2Å; T346-I350 WeakPolarHBondContact O-CG1 3.46Å; T346-I350 PolarHBondContact O-N 3.1Å; T346-C443 WeakPolarHBondContact OG1-CB 3.35Å; T346-L444 HydrophobicContact CG2-CB 3.83Å; T346-L444 HydrophobicContact CG2-CD1 4.36Å; T346-L444 HydrophobicContact CG2-CG 4.46Å; T346-L444 PolarHBondContact OG1-N 2.7Å; T346-L444 VanDerWaalsContact OG1-N 3.12Å
347V96.8Very high93.3Very high78 Ų7834.1 Ų34.147%0.47319%0.186SC..Hα-helixtrans-60-48.2178.5172.60000110.3L343 L344 A349 I350 V351L343-V347 WeakPolarHBondContact O-CG2 3.42Å; L343-V347 PolarHBondContact O-N 3.38Å; L344-V347 PolarHBondContact O-N 2.81Å; L344-V347 VanDerWaalsContact O-N 3.16Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 3.48Å; V347-I350 PolarHBondContact O-N 3.3Å; V347-V351 HydrophobicContact CG1-CG2 4.45Å; V347-V351 WeakPolarHBondContact O-CG2 3.32Å; V347-V351 PolarHBondContact O-N 3.24Å
348W95.1Very high93.1Very high79 Ų7938.3 Ų38.330%0.29920%0.204SC..Hα-helixtrans-67.8-32.3-180-66.1121.9000113.1L344 M345 T346 V351 F352 T375 Y376L344-W348 PolarHBondContact O-N 3Å; M345-W348 PolarHBondContact O-N 2.98Å; T346-W348 PolarHBondContact O-N 2.92Å; W348-V351 HydrophobicContact CE3-CB 4.34Å; W348-V351 PolarHBondContact O-N 3.39Å; W348-F352 WeakPolarHBondContact O-CB 3.48Å; W348-F352 PolarHBondContact O-N 2.8Å; W348-T375 HydrophobicContact CH2-CG2 4.36Å; W348-T375 HydrophobicContact CZ2-CG2 4.05Å; W348-Y376 HydrophobicContact CB-CD2 4.41Å
349A94.1Very high92.8Very high2 Ų240.4 Ų40.42%0.01721%0.214CC..Hα-helixtrans-63.3-41.3171.600000111.8M345 T346 V347 F352 T353 Y376 F436M345-A349 VanDerWaalsContact O-CB 3.31Å; M345-A349 WeakPolarHBondContact O-CB 3.29Å; M345-A349 PolarHBondContact O-N 2.96Å; T346-A349 PolarHBondContact O-N 3.2Å; V347-A349 VanDerWaalsContact C-N 3.34Å; V347-A349 PolarHBondContact O-N 3.48Å; A349-F352 PolarHBondContact O-N 3.49Å; A349-T353 PolarHBondContact O-N 3.34Å; A349-T353 PolarHBondContact O-OG1 3.4Å; A349-Y376 HydrophobicContact CB-CE2 4.21Å; A349-F436 HydrophobicContact CB-CB 4.37Å
350I94.9Very high92.2Very high98 Ų9848.4 Ų48.450%0.50324%0.241SC..Hα-helixtrans-64.5-47.3175.8-66164.5000110.5T346 V347 F352 T353 I354T346-I350 HydrophobicContact CG2-CD1 4.2Å; T346-I350 WeakPolarHBondContact O-CG1 3.46Å; T346-I350 PolarHBondContact O-N 3.1Å; V347-I350 PolarHBondContact O-N 3.3Å; I350-F352 VanDerWaalsContact C-N 3.29Å; I350-F352 PolarHBondContact O-N 3.14Å; I350-T353 PolarHBondContact O-N 2.98Å; I350-I354 HydrophobicContact CG2-CD1 3.96Å; I350-I354 WeakPolarHBondContact O-CG1 3.47Å; I350-I354 PolarHBondContact O-N 3.35Å
351V94.5Very high91.8Very high45 Ų4556.3 Ų56.327%0.27327%0.265SS..Hα-helixtrans-63.1-38.7178.5-179.50000110.8V347 W348 I354 A355 C372V347-V351 HydrophobicContact CG1-CG2 4.45Å; V347-V351 WeakPolarHBondContact O-CG2 3.32Å; V347-V351 PolarHBondContact O-N 3.24Å; W348-V351 HydrophobicContact CE3-CB 4.34Å; W348-V351 PolarHBondContact O-N 3.39Å; V351-I354 PolarHBondContact O-N 3.29Å; V351-A355 WeakPolarHBondContact O-CB 3.45Å; V351-A355 PolarHBondContact O-N 3.05Å; V351-C372 VanDerWaalsContact CG1-SG 3.57Å
352F92Very high91.4Very high5 Ų558.1 Ų58.12%0.02228%0.276CS..Hα-helixtrans-62.7-46.4175.9-174.3-112.3000112.2V296 W348 A349 I350 I354 A355 L356 S369 C372 I373 F436V296-F352 HydrophobicContact CG1-CZ 4.25Å; W348-F352 WeakPolarHBondContact O-CB 3.48Å; W348-F352 PolarHBondContact O-N 2.8Å; A349-F352 PolarHBondContact O-N 3.49Å; I350-F352 VanDerWaalsContact C-N 3.29Å; I350-F352 PolarHBondContact O-N 3.14Å; F352-I354 VanDerWaalsContact C-N 3.32Å; F352-I354 PolarHBondContact O-N 3.11Å; F352-A355 WeakPolarHBondContact O-CB 3.45Å; F352-A355 PolarHBondContact O-N 3.46Å; F352-A355 VanDerWaalsContact O-N 3.14Å; F352-L356 HydrophobicContact CD1-CD1 4Å; F352-L356 HydrophobicContact CE1-CD1 3.47Å; F352-L356 VanDerWaalsContact CE1-CD1 3.47Å; F352-L356 HydrophobicContact CE1-CG 4.16Å; F352-L356 HydrophobicContact CE2-CG 4.44Å; F352-L356 HydrophobicContact CZ-CD1 3.81Å; F352-L356 HydrophobicContact CZ-CD2 4.23Å; F352-L356 HydrophobicContact CZ-CG 4.13Å; F352-L356 PolarHBondContact O-N 3.01Å; F352-S369 WeakPolarHBondContact CE2-O 3.3Å; F352-C372 HydrophobicContact CB-CB 3.86Å; F352-C372 HydrophobicContact CD2-CB 3.79Å; F352-C372 HydrophobicContact CG-CB 4.28Å; F352-I373 HydrophobicContact CD2-CG1 4.14Å; F352-I373 HydrophobicContact CE2-CD1 3.6Å; F352-I373 HydrophobicContact CE2-CG1 3.62Å; F352-I373 HydrophobicContact CZ-CD1 3.83Å; F352-I373 HydrophobicContact CZ-CG1 4.03Å; F352-F436 HydrophobicContact CD1-CB 3.96Å; F352-F436 HydrophobicContact CD1-CD1 4.3Å; F352-F436 AromaticContact CD1-CD2 3.53Å; F352-F436 HydrophobicContact CD1-CD2 3.53Å; F352-F436 HydrophobicContact CD1-CE2 4.03Å; F352-F436 AromaticContact CD1-CG 3.67Å; F352-F436 HydrophobicContact CD1-CG 3.67Å; F352-F436 AromaticContact CE1-CD2 3.29Å; F352-F436 HydrophobicContact CE1-CD2 3.29Å; F352-F436 AromaticContact CE1-CE2 3.46Å; F352-F436 HydrophobicContact CE1-CE2 3.46Å; F352-F436 VanDerWaalsContact CE1-CE2 3.46Å; F352-F436 AromaticContact CE1-CG 3.95Å; F352-F436 HydrophobicContact CE1-CG 3.95Å; F352-F436 HydrophobicContact CE1-CZ 4.23Å; F352-F436 HydrophobicContact CZ-CD2 4.43Å; F352-F436 HydrophobicContact CZ-CE2 4.23Å
353T92.1Very high90.7Very high16 Ų1663.8 Ų63.810%0.09832%0.315CS..Hα-helixtrans-59.1-43.1174.7-690000111.6A349 I350 A355 L356 S357 E433 Y434 V437A349-T353 PolarHBondContact O-N 3.34Å; A349-T353 PolarHBondContact O-OG1 3.4Å; I350-T353 PolarHBondContact O-N 2.98Å; T353-A355 PolarHBondContact O-N 3.19Å; T353-L356 PolarHBondContact O-N 2.93Å; T353-S357 PolarHBondContact O-N 3.37Å; T353-S357 VanDerWaalsContact O-N 3.07Å; T353-S357 PolarHBondContact O-OG 2.86Å; T353-E433 WeakPolarHBondContact CG2-O 3.01Å; T353-E433 PolarHBondContact OG1-O 3.19Å; T353-Y434 HydrophobicContact CG2-CD1 4Å; T353-Y434 HydrophobicContact CG2-CE1 4.41Å; T353-V437 HydrophobicContact CG2-CG2 4.06Å
354I91.3Very high90.2Very high90 Ų9067.3 Ų67.346%0.46232%0.324SS..Hα-helixtrans-62.4-44175-65.1165.8000110.6I350 V351 F352 L356 S357 F358I350-I354 HydrophobicContact CG2-CD1 3.96Å; I350-I354 WeakPolarHBondContact O-CG1 3.47Å; I350-I354 PolarHBondContact O-N 3.35Å; V351-I354 PolarHBondContact O-N 3.29Å; F352-I354 VanDerWaalsContact C-N 3.32Å; F352-I354 PolarHBondContact O-N 3.11Å; I354-L356 PolarHBondContact O-N 3.3Å; I354-S357 PolarHBondContact O-N 2.93Å; I354-F358 HydrophobicContact CG2-CD2 3.91Å; I354-F358 HydrophobicContact CG2-CE2 4.06Å; I354-F358 VanDerWaalsContact O-CD2 3.29Å; I354-F358 WeakPolarHBondContact O-CD2 3.41Å; I354-F358 PolarHBondContact O-N 3.31Å
355A90.6Very high89.9Confident1 Ų164.5 Ų64.51%0.00831%0.308CS..Hα-helixtrans-60.4-43.6179.900000112.1V351 F352 T353 F358 E359 M365 L368 S369V351-A355 WeakPolarHBondContact O-CB 3.45Å; V351-A355 PolarHBondContact O-N 3.05Å; F352-A355 WeakPolarHBondContact O-CB 3.45Å; F352-A355 PolarHBondContact O-N 3.46Å; F352-A355 VanDerWaalsContact O-N 3.14Å; T353-A355 PolarHBondContact O-N 3.19Å; A355-F358 PolarHBondContact O-N 2.64Å; A355-E359 PolarHBondContact O-N 2.85Å; A355-E359 VanDerWaalsContact O-N 3.13Å; A355-M365 HydrophobicContact CB-SD 4.44Å; A355-L368 HydrophobicContact CB-CB 4.4Å; A355-L368 HydrophobicContact CB-CD2 3.87Å; A355-L368 HydrophobicContact CB-CG 4.04Å; A355-S369 WeakPolarHBondContact CB-OG 3.48Å
356L87.5Confident89.5Confident11 Ų1165.7 Ų65.76%0.05832%0.316CS..Hα-helixtrans-63.8-42.3175.5-69.4179.7000112.2A300 F352 T353 I354 F358 E359 E433A300-L356 HydrophobicContact CB-CD2 4.22Å; F352-L356 HydrophobicContact CD1-CD1 4Å; F352-L356 HydrophobicContact CE1-CD1 3.47Å; F352-L356 VanDerWaalsContact CE1-CD1 3.47Å; F352-L356 HydrophobicContact CE1-CG 4.16Å; F352-L356 HydrophobicContact CE2-CG 4.44Å; F352-L356 HydrophobicContact CZ-CD1 3.81Å; F352-L356 HydrophobicContact CZ-CD2 4.23Å; F352-L356 HydrophobicContact CZ-CG 4.13Å; F352-L356 PolarHBondContact O-N 3.01Å; T353-L356 PolarHBondContact O-N 2.93Å; I354-L356 PolarHBondContact O-N 3.3Å; L356-F358 PolarHBondContact O-N 3.37Å; L356-E359 WeakPolarHBondContact CD2-OE2 3.19Å; L356-E359 VanDerWaalsContact O-CB 3.27Å; L356-E359 WeakPolarHBondContact O-CB 3.43Å; L356-E359 PolarHBondContact O-N 3.02Å; L356-E359 VanDerWaalsContact O-N 3.1Å; L356-E433 HydrophobicContact CB-CB 4.21Å; L356-E433 HydrophobicContact CB-CG 4.32Å
357S89.1Confident89.1Confident30 Ų3073 Ų7321%0.2134%0.344CS..Hα-helixtrans-62.5-25.9177.5-67.40000114.1T353 I354 E433T353-S357 PolarHBondContact O-N 3.37Å; T353-S357 VanDerWaalsContact O-N 3.07Å; T353-S357 PolarHBondContact O-OG 2.86Å; I354-S357 PolarHBondContact O-N 2.93Å; S357-E433 VanDerWaalsContact CA-OE2 3.22Å; S357-E433 WeakPolarHBondContact CA-OE2 3.39Å; S357-E433 VanDerWaalsContact CB-OE2 3.26Å; S357-E433 WeakPolarHBondContact CB-OE2 3.24Å; S357-E433 PolarHBondContact OG-OE2 2.86Å
358F88.6Confident88.8Confident107 Ų10771.7 Ų71.747%0.46933%0.334SS..THydrogen-bonded Turntrans-99.42.1176.9-73.1-75.1000114.2I354 A355 L356 R360 Y361 V362 M365I354-F358 HydrophobicContact CG2-CD2 3.91Å; I354-F358 HydrophobicContact CG2-CE2 4.06Å; I354-F358 VanDerWaalsContact O-CD2 3.29Å; I354-F358 WeakPolarHBondContact O-CD2 3.41Å; I354-F358 PolarHBondContact O-N 3.31Å; A355-F358 PolarHBondContact O-N 2.64Å; L356-F358 PolarHBondContact O-N 3.37Å; F358-R360 VanDerWaalsContact C-N 3.35Å; F358-R360 PolarHBondContact O-N 3.48Å; F358-Y361 HydrophobicContact CD1-CD2 4.3Å; F358-Y361 PolarHBondContact O-N 3.33Å; F358-V362 PolarHBondContact O-N 3.05Å; F358-V362 VanDerWaalsContact O-N 3.11Å; F358-M365 HydrophobicContact CB-CE 4.33Å; F358-M365 HydrophobicContact CB-CG 4.22Å; F358-M365 HydrophobicContact CB-SD 4.27Å
359E83.8Confident88.6Confident44 Ų4467.9 Ų67.921%0.20632%0.32CS..THydrogen-bonded Turntrans-59.5-43.7-173.8-170.7-175.4152.500112.7G301 A355 L356 Y361 V362 M365G301-E359 WeakPolarHBondContact CA-OE1 3.42Å; G301-E359 PolarHBondContact N-OE1 3Å; G301-E359 VanDerWaalsContact N-OE1 3.13Å; A355-E359 PolarHBondContact O-N 2.85Å; A355-E359 VanDerWaalsContact O-N 3.13Å; L356-E359 WeakPolarHBondContact CD2-OE2 3.19Å; L356-E359 VanDerWaalsContact O-CB 3.27Å; L356-E359 WeakPolarHBondContact O-CB 3.43Å; L356-E359 PolarHBondContact O-N 3.02Å; L356-E359 VanDerWaalsContact O-N 3.1Å; E359-Y361 PolarHBondContact O-N 3.44Å; E359-V362 PolarHBondContact O-N 3.43Å; E359-M365 HydrophobicContact CB-CB 4.42Å
360R80.5Confident88.4Confident224 Ų22469.9 Ų69.985%0.84533%0.329SS*.THydrogen-bonded Turntrans-68.4-18.3179.6-65.1-174-179.4177.52.6113.9F358F358-R360 VanDerWaalsContact C-N 3.35Å; F358-R360 PolarHBondContact O-N 3.48Å
361Y84.6Confident88.3Confident188 Ų18867.3 Ų67.374%0.73732%0.323SS*.THydrogen-bonded Turntrans-97.9-26.3-176.2-60-81.4000112.5F358 E359F358-Y361 HydrophobicContact CD1-CD2 4.3Å; F358-Y361 PolarHBondContact O-N 3.33Å; E359-Y361 PolarHBondContact O-N 3.44Å
362V86.7Confident88.3Confident43 Ų4365.2 Ų65.226%0.26131%0.31SS..  trans-138.1112.7-169.2179.80000110.5F358 E359 W364 M365F358-V362 PolarHBondContact O-N 3.05Å; F358-V362 VanDerWaalsContact O-N 3.11Å; E359-V362 PolarHBondContact O-N 3.43Å; V362-W364 HydrophobicContact CG1-CD2 4.12Å; V362-W364 HydrophobicContact CG1-CG 3.87Å; V362-W364 HydrophobicContact CG1-CZ2 4.39Å; V362-W364 PolarHBondContact O-N 3.42Å; V362-W364 VanDerWaalsContact O-N 3.11Å; V362-M365 HydrophobicContact CB-CE 4.08Å; V362-M365 HydrophobicContact CB-CG 3.7Å; V362-M365 HydrophobicContact CG1-CE 3.91Å; V362-M365 HydrophobicContact CG1-CG 3.98Å; V362-M365 HydrophobicContact CG2-CE 4.39Å; V362-M365 WeakPolarHBondContact O-CB 3.23Å; V362-M365 WeakPolarHBondContact O-CG 3.4Å; V362-M365 PolarHBondContact O-N 3.37Å; V362-M365 VanDerWaalsContact O-N 3.09Å
363S79.9Confident88.3Confident118 Ų11865 Ų6583%0.82531%0.309SS*.THydrogen-bonded Turntrans-63.8-18.7-172.555.70000115.9
364W86.2Confident88.5Confident145 Ų14566.1 Ų66.155%0.54931%0.313SS..THydrogen-bonded Turntrans-88.6-5.3177.567.4-98.3000113.9V362 S366 Y367 L368V362-W364 HydrophobicContact CG1-CD2 4.12Å; V362-W364 HydrophobicContact CG1-CG 3.87Å; V362-W364 HydrophobicContact CG1-CZ2 4.39Å; V362-W364 PolarHBondContact O-N 3.42Å; V362-W364 VanDerWaalsContact O-N 3.11Å; W364-S366 VanDerWaalsContact C-N 3.29Å; W364-S366 PolarHBondContact O-N 3.49Å; W364-Y367 WeakPolarHBondContact O-CB 3.35Å; W364-Y367 PolarHBondContact O-N 3.26Å; W364-Y367 VanDerWaalsContact O-N 3.12Å; W364-L368 HydrophobicContact CE3-CB 4.24Å; W364-L368 HydrophobicContact CH2-CD2 4.24Å; W364-L368 HydrophobicContact CZ3-CB 3.86Å; W364-L368 HydrophobicContact CZ3-CD2 3.9Å; W364-L368 HydrophobicContact CZ3-CG 4.32Å; W364-L368 PolarHBondContact O-N 2.85Å
365M87.9Confident88.6Confident21 Ų2163.7 Ų63.710%0.10330%0.302CS..Hα-helixtrans-63.3-31.1-177.1-74.1-67.1159.200113.2A355 F358 E359 V362 Y367 L368 S369A355-M365 HydrophobicContact CB-SD 4.44Å; F358-M365 HydrophobicContact CB-CE 4.33Å; F358-M365 HydrophobicContact CB-CG 4.22Å; F358-M365 HydrophobicContact CB-SD 4.27Å; E359-M365 HydrophobicContact CB-CB 4.42Å; V362-M365 HydrophobicContact CB-CE 4.08Å; V362-M365 HydrophobicContact CB-CG 3.7Å; V362-M365 HydrophobicContact CG1-CE 3.91Å; V362-M365 HydrophobicContact CG1-CG 3.98Å; V362-M365 HydrophobicContact CG2-CE 4.39Å; V362-M365 WeakPolarHBondContact O-CB 3.23Å; V362-M365 WeakPolarHBondContact O-CG 3.4Å; V362-M365 PolarHBondContact O-N 3.37Å; V362-M365 VanDerWaalsContact O-N 3.09Å; M365-Y367 PolarHBondContact O-N 3.33Å; M365-L368 CarbonylContact O-C 3.57Å; M365-L368 WeakPolarHBondContact O-CA 3.39Å; M365-L368 WeakPolarHBondContact O-CB 3.07Å; M365-L368 PolarHBondContact O-N 3.46Å; M365-L368 HydrophobicContact SD-CD2 3.85Å; M365-S369 PolarHBondContact O-N 3.13Å; M365-S369 PolarHBondContact O-OG 3.07Å
366S86.2Confident88.8Confident24 Ų2463.8 Ų63.817%0.16830%0.302CS..Hα-helixtrans-58.5-35.3174.6-53.10000112.6A300 W364 S369 M370A300-S366 WeakPolarHBondContact O-CA 3.37Å; A300-S366 WeakPolarHBondContact O-CB 3.3Å; A300-S366 PolarHBondContact O-OG 3.5Å; W364-S366 VanDerWaalsContact C-N 3.29Å; W364-S366 PolarHBondContact O-N 3.49Å; S366-S369 PolarHBondContact O-N 2.96Å; S366-M370 WeakPolarHBondContact O-CB 3.38Å; S366-M370 PolarHBondContact O-N 3.26Å
367Y88.8Confident89.1Confident165 Ų16563.2 Ų63.265%0.64730%0.299SS*.Hα-helixtrans-71.4-34.6173.9-65.1-73.1000112.4W364 M365 M370 A371W364-Y367 WeakPolarHBondContact O-CB 3.35Å; W364-Y367 PolarHBondContact O-N 3.26Å; W364-Y367 VanDerWaalsContact O-N 3.12Å; M365-Y367 PolarHBondContact O-N 3.33Å; Y367-M370 PolarHBondContact O-N 3.45Å; Y367-A371 WeakPolarHBondContact O-CB 3.26Å; Y367-A371 PolarHBondContact O-N 2.89Å
368L91.1Very high89.4Confident49 Ų4964.8 Ų64.826%0.25731%0.305SS..Hα-helixtrans-66.6-43.6173.1-177.362.1000110.8A355 W364 M365 M370 A371 C372A355-L368 HydrophobicContact CB-CB 4.4Å; A355-L368 HydrophobicContact CB-CD2 3.87Å; A355-L368 HydrophobicContact CB-CG 4.04Å; W364-L368 HydrophobicContact CE3-CB 4.24Å; W364-L368 HydrophobicContact CH2-CD2 4.24Å; W364-L368 HydrophobicContact CZ3-CB 3.86Å; W364-L368 HydrophobicContact CZ3-CD2 3.9Å; W364-L368 HydrophobicContact CZ3-CG 4.32Å; W364-L368 PolarHBondContact O-N 2.85Å; M365-L368 CarbonylContact O-C 3.57Å; M365-L368 WeakPolarHBondContact O-CA 3.39Å; M365-L368 WeakPolarHBondContact O-CB 3.07Å; M365-L368 PolarHBondContact O-N 3.46Å; M365-L368 HydrophobicContact SD-CD2 3.85Å; L368-M370 VanDerWaalsContact C-N 3.33Å; L368-M370 PolarHBondContact O-N 3.33Å; L368-A371 PolarHBondContact O-N 3.25Å; L368-C372 WeakPolarHBondContact O-CB 3.47Å; L368-C372 PolarHBondContact O-N 2.89Å; L368-C372 PolarHBondContact O-SG 2.83Å
369S90.3Very high89.6Confident0 Ų059.8 Ų59.80%028%0.283CS..Hα-helixtrans-57.3-46174.4-68.90000111.2F352 A355 M365 S366 C372 I373F352-S369 WeakPolarHBondContact CE2-O 3.3Å; A355-S369 WeakPolarHBondContact CB-OG 3.48Å; M365-S369 PolarHBondContact O-N 3.13Å; M365-S369 PolarHBondContact O-OG 3.07Å; S366-S369 PolarHBondContact O-N 2.96Å; S369-C372 PolarHBondContact O-N 3.04Å; S369-I373 WeakPolarHBondContact O-CG1 3.43Å; S369-I373 PolarHBondContact O-N 3.25Å
370M90.3Very high90Very high44 Ų4457.9 Ų57.922%0.21727%0.274CS..Hα-helixtrans-59.5-47.2173.1-178.7179.1164.400112.4F297 I302 V310 S366 Y367 L368 C372 I373 F374F297-M370 HydrophobicContact CE1-CG 4.49Å; I302-M370 HydrophobicContact CD1-CB 4.14Å; I302-M370 HydrophobicContact CD1-CG 4.35Å; I302-M370 HydrophobicContact CD1-SD 4.26Å; V310-M370 HydrophobicContact CB-CE 4.23Å; V310-M370 HydrophobicContact CB-SD 4.5Å; V310-M370 HydrophobicContact CG1-CE 3.83Å; V310-M370 HydrophobicContact CG1-CG 3.86Å; V310-M370 HydrophobicContact CG1-SD 3.84Å; V310-M370 HydrophobicContact CG2-CE 3.75Å; V310-M370 HydrophobicContact CG2-SD 3.86Å; S366-M370 WeakPolarHBondContact O-CB 3.38Å; S366-M370 PolarHBondContact O-N 3.26Å; Y367-M370 PolarHBondContact O-N 3.45Å; L368-M370 VanDerWaalsContact C-N 3.33Å; L368-M370 PolarHBondContact O-N 3.33Å; M370-C372 VanDerWaalsContact C-N 3.32Å; M370-C372 PolarHBondContact O-N 3.38Å; M370-I373 PolarHBondContact O-N 3.3Å; M370-F374 HydrophobicContact CE-CE1 4.47Å; M370-F374 HydrophobicContact CE-CE2 3.42Å; M370-F374 VanDerWaalsContact CE-CE2 3.42Å; M370-F374 HydrophobicContact CE-CZ 3.39Å; M370-F374 HydrophobicContact CG-CE1 4.24Å; M370-F374 HydrophobicContact CG-CE2 4.1Å; M370-F374 HydrophobicContact CG-CZ 3.95Å; M370-F374 WeakPolarHBondContact O-CG 3.44Å; M370-F374 PolarHBondContact O-N 3.29Å; M370-F374 HydrophobicContact SD-CZ 4.5Å
371A93.3Very high90.4Very high44 Ų4447.2 Ų47.236%0.36423%0.234SC..Hα-helixtrans-62.2-39177.200000112.1Y367 L368 F374 T375Y367-A371 WeakPolarHBondContact O-CB 3.26Å; Y367-A371 PolarHBondContact O-N 2.89Å; L368-A371 PolarHBondContact O-N 3.25Å; A371-F374 PolarHBondContact O-N 3.07Å; A371-T375 WeakPolarHBondContact O-CB 3.21Å; A371-T375 VanDerWaalsContact O-CG2 3.31Å; A371-T375 WeakPolarHBondContact O-CG2 3.44Å; A371-T375 PolarHBondContact O-N 2.93Å; A371-T375 PolarHBondContact O-OG1 2.88Å
372C93.3Very high90.6Very high1 Ų140.8 Ų40.81%0.00721%0.212CC..Hα-helixtrans-62.8-44.6175.8-68.20000111.5V351 F352 L368 S369 M370 F374 T375 Y376V351-C372 VanDerWaalsContact CG1-SG 3.57Å; F352-C372 HydrophobicContact CB-CB 3.86Å; F352-C372 HydrophobicContact CD2-CB 3.79Å; F352-C372 HydrophobicContact CG-CB 4.28Å; L368-C372 WeakPolarHBondContact O-CB 3.47Å; L368-C372 PolarHBondContact O-N 2.89Å; L368-C372 PolarHBondContact O-SG 2.83Å; S369-C372 PolarHBondContact O-N 3.04Å; M370-C372 VanDerWaalsContact C-N 3.32Å; M370-C372 PolarHBondContact O-N 3.38Å; C372-F374 VanDerWaalsContact C-N 3.34Å; C372-F374 PolarHBondContact O-N 3.04Å; C372-T375 WeakPolarHBondContact CA-OG1 3.2Å; C372-T375 PolarHBondContact O-N 3.16Å; C372-T375 PolarHBondContact O-OG1 2.97Å; C372-Y376 WeakPolarHBondContact O-CB 3.43Å; C372-Y376 PolarHBondContact O-N 3.46Å
373I93.3Very high90.6Very high1 Ų138.8 Ų38.81%0.00520%0.199CC..Hα-helixtrans-61.6-43.8175.8-66.3162.3000110.8I289 V296 F297 T314 F352 S369 M370 Y376 I377I289-I373 HydrophobicContact CG2-CG2 4.2Å; V296-I373 HydrophobicContact CG1-CD1 3.52Å; V296-I373 HydrophobicContact CG1-CG1 4.34Å; F297-I373 HydrophobicContact CD1-CD1 3.82Å; F297-I373 HydrophobicContact CE1-CB 4.28Å; F297-I373 HydrophobicContact CE1-CD1 3.42Å; F297-I373 VanDerWaalsContact CE1-CD1 3.42Å; F297-I373 HydrophobicContact CE1-CG1 4.46Å; F297-I373 HydrophobicContact CE1-CG2 4.18Å; F297-I373 HydrophobicContact CZ-CB 4.46Å; F297-I373 HydrophobicContact CZ-CD1 4.14Å; F297-I373 HydrophobicContact CZ-CG2 3.89Å; T314-I373 HydrophobicContact CG2-CG2 4.24Å; F352-I373 HydrophobicContact CD2-CG1 4.14Å; F352-I373 HydrophobicContact CE2-CD1 3.6Å; F352-I373 HydrophobicContact CE2-CG1 3.62Å; F352-I373 HydrophobicContact CZ-CD1 3.83Å; F352-I373 HydrophobicContact CZ-CG1 4.03Å; S369-I373 WeakPolarHBondContact O-CG1 3.43Å; S369-I373 PolarHBondContact O-N 3.25Å; M370-I373 PolarHBondContact O-N 3.3Å; I373-Y376 WeakPolarHBondContact O-CB 3.48Å; I373-Y376 PolarHBondContact O-N 2.92Å; I373-I377 HydrophobicContact CG2-CD1 3.91Å; I373-I377 VanDerWaalsContact O-CG1 3.3Å; I373-I377 WeakPolarHBondContact O-CG1 3.42Å; I373-I377 PolarHBondContact O-N 2.9Å
374F94.6Very high90.7Very high39 Ų3933.1 Ų33.117%0.17116%0.16CC..Hα-helixtrans-62.4-46.5178.4-73.20.9000112.4F297 V310 T314 M370 A371 C372 I377 L378F297-F374 HydrophobicContact CZ-CE1 4.28Å; V310-F374 HydrophobicContact CG1-CE1 4.15Å; V310-F374 HydrophobicContact CG1-CZ 4.07Å; V310-F374 WeakPolarHBondContact O-CE1 3.39Å; V310-F374 WeakPolarHBondContact O-CZ 3.23Å; T314-F374 HydrophobicContact CG2-CD1 3.89Å; T314-F374 HydrophobicContact CG2-CE1 3.6Å; M370-F374 HydrophobicContact CE-CE1 4.47Å; M370-F374 HydrophobicContact CE-CE2 3.42Å; M370-F374 VanDerWaalsContact CE-CE2 3.42Å; M370-F374 HydrophobicContact CE-CZ 3.39Å; M370-F374 HydrophobicContact CG-CE1 4.24Å; M370-F374 HydrophobicContact CG-CE2 4.1Å; M370-F374 HydrophobicContact CG-CZ 3.95Å; M370-F374 WeakPolarHBondContact O-CG 3.44Å; M370-F374 PolarHBondContact O-N 3.29Å; M370-F374 HydrophobicContact SD-CZ 4.5Å; A371-F374 PolarHBondContact O-N 3.07Å; C372-F374 VanDerWaalsContact C-N 3.34Å; C372-F374 PolarHBondContact O-N 3.04Å; F374-I377 PolarHBondContact O-N 3.26Å; F374-L378 VanDerWaalsContact O-CB 3.28Å; F374-L378 WeakPolarHBondContact O-CB 3.5Å; F374-L378 PolarHBondContact O-N 2.93Å
375T94.8Very high90.1Very high38 Ų3826.8 Ų26.823%0.23314%0.138CC..Hα-helixtrans-70-31.1177.955.10000112.9W348 A371 C372 L378 S379W348-T375 HydrophobicContact CH2-CG2 4.36Å; W348-T375 HydrophobicContact CZ2-CG2 4.05Å; A371-T375 WeakPolarHBondContact O-CB 3.21Å; A371-T375 VanDerWaalsContact O-CG2 3.31Å; A371-T375 WeakPolarHBondContact O-CG2 3.44Å; A371-T375 PolarHBondContact O-N 2.93Å; A371-T375 PolarHBondContact O-OG1 2.88Å; C372-T375 WeakPolarHBondContact CA-OG1 3.2Å; C372-T375 PolarHBondContact O-N 3.16Å; C372-T375 PolarHBondContact O-OG1 2.97Å; T375-L378 PolarHBondContact O-N 3.3Å; T375-S379 VanDerWaalsContact O-CB 3.31Å; T375-S379 WeakPolarHBondContact O-CB 3.49Å; T375-S379 PolarHBondContact O-N 3.23Å; T375-S379 PolarHBondContact O-OG 2.84Å
376Y94.9Very high88.8Confident3 Ų325.9 Ų25.91%0.01213%0.134CC..Hα-helixtrans-61.1-50.2171.6-174.4-89.6000110.8C284 I289 M345 W348 A349 C372 I373 S379 F380 F436C284-Y376 PolarHBondContact O-OH 2.66Å; I289-Y376 HydrophobicContact CD1-CD1 3.89Å; I289-Y376 HydrophobicContact CD1-CE1 3.87Å; M345-Y376 HydrophobicContact CB-CD2 3.99Å; M345-Y376 HydrophobicContact CB-CE2 3.68Å; M345-Y376 HydrophobicContact CE-CD1 4.12Å; M345-Y376 HydrophobicContact CE-CE1 3.41Å; M345-Y376 VanDerWaalsContact CE-CE1 3.41Å; M345-Y376 HydrophobicContact CE-CE2 3.97Å; M345-Y376 WeakPolarHBondContact CE-OH 3.43Å; M345-Y376 HydrophobicContact CG-CD2 4.29Å; M345-Y376 HydrophobicContact CG-CE2 4.21Å; M345-Y376 WeakPolarHBondContact O-CD2 3.16Å; M345-Y376 WeakPolarHBondContact O-CE2 3.48Å; W348-Y376 HydrophobicContact CB-CD2 4.41Å; A349-Y376 HydrophobicContact CB-CE2 4.21Å; C372-Y376 WeakPolarHBondContact O-CB 3.43Å; C372-Y376 PolarHBondContact O-N 3.46Å; I373-Y376 WeakPolarHBondContact O-CB 3.48Å; I373-Y376 PolarHBondContact O-N 2.92Å; Y376-S379 WeakPolarHBondContact O-CB 3.39Å; Y376-S379 PolarHBondContact O-N 2.96Å; Y376-F380 PolarHBondContact O-N 2.6Å; Y376-F436 HydrophobicContact CE1-CE1 4.44Å; Y376-F436 HydrophobicContact CE2-CD1 4.48Å
377I93.6Very high87.6Confident0 Ų025.4 Ų25.40%013%0.133CC..Hα-helixtrans-66.2-40.1178-67.4173.9000111.3N286 I289 Y290 T314 C317 E318 I373 F374 S379 F380 G381N286-I377 WeakPolarHBondContact OD1-CG1 3.37Å; I289-I377 HydrophobicContact CG2-CD1 4.2Å; Y290-I377 HydrophobicContact CE1-CD1 4.27Å; Y290-I377 WeakPolarHBondContact OH-CG2 3.43Å; T314-I377 HydrophobicContact CG2-CD1 3.83Å; C317-I377 HydrophobicContact CB-CG2 4.45Å; E318-I377 HydrophobicContact CB-CG2 3.76Å; E318-I377 HydrophobicContact CG-CG2 4.46Å; I373-I377 HydrophobicContact CG2-CD1 3.91Å; I373-I377 VanDerWaalsContact O-CG1 3.3Å; I373-I377 WeakPolarHBondContact O-CG1 3.42Å; I373-I377 PolarHBondContact O-N 2.9Å; F374-I377 PolarHBondContact O-N 3.26Å; I377-S379 VanDerWaalsContact C-N 3.28Å; I377-S379 PolarHBondContact O-N 3.23Å; I377-F380 WeakPolarHBondContact O-CB 3.28Å; I377-F380 PolarHBondContact O-N 3.3Å; I377-G381 PolarHBondContact O-N 2.94Å
378L94.1Very high86.7Confident62 Ų6217.8 Ų17.833%0.32510%0.104SC..Hα-helixtrans-61.5-40.4174.6-172.2150.3000110.9C317 A321 F374 T375 G381 M382C317-L378 HydrophobicContact CB-CB 4.48Å; A321-L378 HydrophobicContact CB-CG 4.16Å; A321-L378 WeakPolarHBondContact CB-O 3.48Å; F374-L378 VanDerWaalsContact O-CB 3.28Å; F374-L378 WeakPolarHBondContact O-CB 3.5Å; F374-L378 PolarHBondContact O-N 2.93Å; T375-L378 PolarHBondContact O-N 3.3Å; L378-G381 PolarHBondContact O-N 3.46Å; L378-M382 HydrophobicContact CD2-CG 4.21Å; L378-M382 HydrophobicContact CD2-SD 3.56Å; L378-M382 VanDerWaalsContact CD2-SD 3.56Å; L378-M382 WeakPolarHBondContact O-CB 3.41Å; L378-M382 WeakPolarHBondContact O-CG 3.28Å; L378-M382 PolarHBondContact O-N 2.95Å
379S94.3Very high86.2Confident3 Ų315.7 Ų15.72%0.0219%0.093CC..Hα-helixtrans-66.2-39.2176.1-57.90000112L344 T375 Y376 I377 M382 G383L344-S379 WeakPolarHBondContact CB-OG 3.46Å; T375-S379 VanDerWaalsContact O-CB 3.31Å; T375-S379 WeakPolarHBondContact O-CB 3.49Å; T375-S379 PolarHBondContact O-N 3.23Å; T375-S379 PolarHBondContact O-OG 2.84Å; Y376-S379 WeakPolarHBondContact O-CB 3.39Å; Y376-S379 PolarHBondContact O-N 2.96Å; I377-S379 VanDerWaalsContact C-N 3.28Å; I377-S379 PolarHBondContact O-N 3.23Å; S379-M382 PolarHBondContact O-N 2.94Å; S379-G383 PolarHBondContact O-N 3.06Å; S379-G383 VanDerWaalsContact O-N 3.15Å
380F92.3Very high85.4Confident3 Ų317.7 Ų17.71%0.01311%0.113CC..Hα-helixtrans-61.7-49.3172.6176.4-104.8000111.7M281 C284 N286 M345 Y376 I377 M382 G383 P384 A385M281-F380 HydrophobicContact CE-CZ 4.34Å; M281-F380 HydrophobicContact CG-CE2 4.16Å; M281-F380 HydrophobicContact CG-CZ 4.3Å; C284-F380 VanDerWaalsContact SG-CE2 3.59Å; N286-F380 HydrophobicContact CB-CD1 3.77Å; N286-F380 HydrophobicContact CB-CD2 3.9Å; N286-F380 HydrophobicContact CB-CE1 3.8Å; N286-F380 HydrophobicContact CB-CE2 3.94Å; N286-F380 HydrophobicContact CB-CG 3.81Å; N286-F380 HydrophobicContact CB-CZ 3.89Å; N286-F380 VanDerWaalsContact CG-CE1 3.48Å; N286-F380 WeakPolarHBondContact ND2-CD1 3.45Å; N286-F380 WeakPolarHBondContact ND2-CE1 3.41Å; N286-F380 WeakPolarHBondContact OD1-CD1 3.33Å; M345-F380 HydrophobicContact CE-CB 3.86Å; M345-F380 HydrophobicContact CE-CD2 3.91Å; M345-F380 HydrophobicContact CE-CG 4.31Å; M345-F380 HydrophobicContact SD-CB 3.81Å; M345-F380 HydrophobicContact SD-CD2 4.12Å; M345-F380 HydrophobicContact SD-CG 4.49Å; Y376-F380 PolarHBondContact O-N 2.6Å; I377-F380 WeakPolarHBondContact O-CB 3.28Å; I377-F380 PolarHBondContact O-N 3.3Å; F380-M382 VanDerWaalsContact C-N 3.3Å; F380-M382 PolarHBondContact O-N 3.12Å; F380-G383 CarbonylContact O-C 3.55Å; F380-G383 PolarHBondContact O-N 3.4Å; F380-P384 HydrophobicContact CD2-CB 3.96Å; F380-P384 HydrophobicContact CD2-CG 4.16Å; F380-P384 HydrophobicContact CE2-CB 3.88Å; F380-P384 VanDerWaalsContact O-CD 3.29Å; F380-P384 WeakPolarHBondContact O-CD 3.49Å; F380-A385 HydrophobicContact CD1-CB 3.47Å; F380-A385 VanDerWaalsContact CD1-CB 3.47Å; F380-A385 HydrophobicContact CD2-CB 4.48Å; F380-A385 HydrophobicContact CE1-CB 3.19Å; F380-A385 HydrophobicContact CE2-CB 4.25Å; F380-A385 HydrophobicContact CG-CB 4.13Å; F380-A385 HydrophobicContact CZ-CB 3.63Å; F380-A385 WeakPolarHBondContact O-CB 3.14Å; F380-A385 PolarHBondContact O-N 3.45Å
381G88.6Confident84.8Confident0 Ų016.6 Ų16.60%011%0.109CC..Iπ-helixtrans-59-38.6176.300000112.9I377 L378 A386I377-G381 PolarHBondContact O-N 2.94Å; L378-G381 PolarHBondContact O-N 3.46Å; G381-A386 WeakPolarHBondContact O-CB 3.31Å
382M88.1Confident84.1Confident54 Ų5414.7 Ų14.727%0.2669%0.093SC..Iπ-helixtrans-74.9-21.5178.4-74.4-173.169.900114.2A321 C325 L328 L378 S379 F380A321-M382 HydrophobicContact CB-CG 4.02Å; C325-M382 PolarHBondContact SG-O 3.22Å; L328-M382 HydrophobicContact CD1-CE 4.14Å; L378-M382 HydrophobicContact CD2-CG 4.21Å; L378-M382 HydrophobicContact CD2-SD 3.56Å; L378-M382 VanDerWaalsContact CD2-SD 3.56Å; L378-M382 WeakPolarHBondContact O-CB 3.41Å; L378-M382 WeakPolarHBondContact O-CG 3.28Å; L378-M382 PolarHBondContact O-N 2.95Å; S379-M382 PolarHBondContact O-N 2.94Å; F380-M382 VanDerWaalsContact C-N 3.3Å; F380-M382 PolarHBondContact O-N 3.12Å
383G86.3Confident83.6Confident0 Ų014.8 Ų14.80%09%0.093CC..Iπ-helixtrans-118-93.9-175.200000113.2M337 S379 F380 A385 V388M337-G383 WeakPolarHBondContact O-CA 3.38Å; S379-G383 PolarHBondContact O-N 3.06Å; S379-G383 VanDerWaalsContact O-N 3.15Å; F380-G383 CarbonylContact O-C 3.55Å; F380-G383 PolarHBondContact O-N 3.4Å; G383-A385 VanDerWaalsContact C-N 3.34Å; G383-A385 PolarHBondContact O-N 3.29Å; G383-V388 WeakPolarHBondContact O-CG2 3.28Å
384P81.8Confident82.8Confident0 Ų016.7 Ų16.70%011%0.105CC..Iπ-helixtrans-58.9-34.9-173.1-25.734.2000115.7M281 F342 M345 F380 T389M281-P384 HydrophobicContact CG-CB 4.3Å; F342-P384 HydrophobicContact CD1-CG 3.94Å; F342-P384 HydrophobicContact CD2-CG 4.04Å; F342-P384 HydrophobicContact CE1-CB 4.34Å; F342-P384 HydrophobicContact CE1-CG 3.56Å; F342-P384 HydrophobicContact CE2-CB 4.34Å; F342-P384 HydrophobicContact CE2-CG 3.67Å; F342-P384 HydrophobicContact CG-CG 4.16Å; F342-P384 HydrophobicContact CZ-CB 3.92Å; F342-P384 HydrophobicContact CZ-CG 3.42Å; F342-P384 VanDerWaalsContact CZ-CG 3.42Å; M345-P384 HydrophobicContact SD-CG 4.36Å; F380-P384 HydrophobicContact CD2-CB 3.96Å; F380-P384 HydrophobicContact CD2-CG 4.16Å; F380-P384 HydrophobicContact CE2-CB 3.88Å; F380-P384 VanDerWaalsContact O-CD 3.29Å; F380-P384 WeakPolarHBondContact O-CD 3.49Å; P384-T389 WeakPolarHBondContact O-CB 3.34Å; P384-T389 PolarHBondContact O-OG1 3.4Å
385A74.1Confident82.1Confident12 Ų1216.5 Ų16.510%0.09911%0.105CC..Iπ-helixtrans-84.4-35.4-166.100000115.2F380 G383 G387F380-A385 HydrophobicContact CD1-CB 3.47Å; F380-A385 VanDerWaalsContact CD1-CB 3.47Å; F380-A385 HydrophobicContact CD2-CB 4.48Å; F380-A385 HydrophobicContact CE1-CB 3.19Å; F380-A385 HydrophobicContact CE2-CB 4.25Å; F380-A385 HydrophobicContact CG-CB 4.13Å; F380-A385 HydrophobicContact CZ-CB 3.63Å; F380-A385 WeakPolarHBondContact O-CB 3.14Å; F380-A385 PolarHBondContact O-N 3.45Å; G383-A385 VanDerWaalsContact C-N 3.34Å; G383-A385 PolarHBondContact O-N 3.29Å; A385-G387 PolarHBondContact O-N 3.25Å
386A60.8Low81.6Confident2 Ų214.7 Ų14.72%0.0179%0.094CC..THydrogen-bonded Turntrans-76.848.8-167.600000114.7Q157 C325 G381 V388Q157-A386 PolarHBondContact OE1-O 3.47Å; C325-A386 HydrophobicContact CB-CB 3.25Å; C325-A386 WeakPolarHBondContact SG-CB 3.38Å; G381-A386 WeakPolarHBondContact O-CB 3.31Å; A386-V388 PolarHBondContact O-N 3.33Å
387G61.6Low81Confident14 Ų1414.6 Ų14.614%0.1449%0.093CC..THydrogen-bonded Turntrans72.9-5.2177.400000114.2A385 G390 V391A385-G387 PolarHBondContact O-N 3.25Å; G387-G390 PolarHBondContact O-N 3Å; G387-V391 WeakPolarHBondContact O-CB 3.45Å; G387-V391 WeakPolarHBondContact O-CG2 3.43Å; G387-V391 PolarHBondContact O-N 3.38Å
388V70.3Confident80.2Confident4 Ų417.7 Ų17.72%0.02411%0.11CC..Hα-helixtrans-61.3-50.3178.5-167.50000110.2V329 R334 L338 G383 A386 G390 V391 L392V329-V388 HydrophobicContact CG2-CG2 3.92Å; R334-V388 HydrophobicContact CB-CG1 3.69Å; R334-V388 HydrophobicContact CG-CG1 3.82Å; L338-V388 HydrophobicContact CD1-CG1 3.79Å; L338-V388 HydrophobicContact CD2-CB 3.97Å; L338-V388 HydrophobicContact CD2-CG1 3.91Å; L338-V388 HydrophobicContact CG-CB 4.21Å; L338-V388 HydrophobicContact CG-CG1 3.58Å; G383-V388 WeakPolarHBondContact O-CG2 3.28Å; A386-V388 PolarHBondContact O-N 3.33Å; V388-G390 PolarHBondContact O-N 3.3Å; V388-V391 PolarHBondContact O-N 3.11Å; V388-L392 WeakPolarHBondContact O-CG 3.48Å; V388-L392 PolarHBondContact O-N 2.96Å
389T79.3Confident79Confident6 Ų618.4 Ų18.44%0.03711%0.112CC..Hα-helixtrans-65.1-38.5177.6-540000112.7I277 M281 P384 V391 L392 P393I277-T389 HydrophobicContact CG2-CG2 3.84Å; M281-T389 HydrophobicContact CB-CG2 4.32Å; M281-T389 HydrophobicContact SD-CG2 3.76Å; P384-T389 WeakPolarHBondContact O-CB 3.34Å; P384-T389 PolarHBondContact O-OG1 3.4Å; T389-V391 VanDerWaalsContact C-N 3.32Å; T389-V391 PolarHBondContact O-N 3.4Å; T389-L392 PolarHBondContact O-N 3.26Å; T389-P393 WeakPolarHBondContact O-CD 3.35Å
390G75.1Confident78Confident41 Ų4119 Ų1942%0.42312%0.117SC..Hα-helixtrans-70.7-24.4-178.300000114.3G387 V388 Y406G387-G390 PolarHBondContact O-N 3Å; V388-G390 PolarHBondContact O-N 3.3Å; G390-Y406 WeakPolarHBondContact O-CE1 3.29Å; G390-Y406 PolarHBondContact O-OH 2.96Å
391V76.8Confident77.3Confident22 Ų2218.9 Ų18.913%0.13312%0.116CC..Hα-helixtrans-90.3-23179.61780000111.7G387 V388 T389 T394 E395G387-V391 WeakPolarHBondContact O-CB 3.45Å; G387-V391 WeakPolarHBondContact O-CG2 3.43Å; G387-V391 PolarHBondContact O-N 3.38Å; V388-V391 PolarHBondContact O-N 3.11Å; T389-V391 VanDerWaalsContact C-N 3.32Å; T389-V391 PolarHBondContact O-N 3.4Å; V391-T394 WeakPolarHBondContact CG1-OG1 3.29Å; V391-T394 WeakPolarHBondContact O-CA 3.43Å; V391-T394 WeakPolarHBondContact O-CB 3.43Å; V391-T394 PolarHBondContact O-N 2.99Å; V391-T394 PolarHBondContact O-OG1 2.97Å; V391-E395 HydrophobicContact CG1-CG 3.93Å; V391-E395 PolarHBondContact O-N 3.49Å
392L79.6Confident76.8Confident3 Ų321.7 Ų21.72%0.01613%0.127CC..Hα-helixtrans-50.9-44.8179.5-77.5176000114.4I277 L338 V388 T389 T394 E395 I396 T457I277-L392 HydrophobicContact CB-CD1 4.42Å; I277-L392 HydrophobicContact CD1-CD1 3.72Å; I277-L392 HydrophobicContact CG2-CD1 3.87Å; L338-L392 HydrophobicContact CD1-CD1 3.88Å; V388-L392 WeakPolarHBondContact O-CG 3.48Å; V388-L392 PolarHBondContact O-N 2.96Å; T389-L392 PolarHBondContact O-N 3.26Å; L392-T394 PolarHBondContact O-N 2.91Å; L392-E395 PolarHBondContact O-N 3.44Å; L392-E395 VanDerWaalsContact O-N 3.13Å; L392-I396 HydrophobicContact CB-CD1 4.14Å; L392-I396 HydrophobicContact CD2-CD1 4.11Å; L392-I396 WeakPolarHBondContact O-CB 3.3Å; L392-I396 VanDerWaalsContact O-CG1 3.3Å; L392-I396 WeakPolarHBondContact O-CG1 3.39Å; L392-I396 PolarHBondContact O-N 3.18Å; L392-T457 HydrophobicContact CD2-CG2 4.44Å
393P81.6Confident76.2Confident3 Ų322.6 Ų22.62%0.01914%0.136CC..Hα-helixtrans-58.9-30.7176.6-25.535.2000113.5V274 T389 F397 A405 Y406V274-P393 HydrophobicContact CG1-CG 4.22Å; V274-P393 HydrophobicContact CG2-CG 4.39Å; T389-P393 WeakPolarHBondContact O-CD 3.35Å; P393-F397 WeakPolarHBondContact O-CB 3.23Å; P393-F397 PolarHBondContact O-N 3.14Å; P393-A405 HydrophobicContact CB-CB 4.4Å; P393-Y406 HydrophobicContact CB-CD1 4.37Å; P393-Y406 HydrophobicContact CB-CD2 4.23Å; P393-Y406 HydrophobicContact CB-CE1 4.18Å; P393-Y406 HydrophobicContact CB-CE2 4.07Å; P393-Y406 HydrophobicContact CB-CG 4.38Å; P393-Y406 HydrophobicContact CG-CD1 4.37Å; P393-Y406 HydrophobicContact CG-CE1 4.12Å
394T75.9Confident75.9Confident41 Ų4122.7 Ų22.725%0.25214%0.137SC..Hα-helixtrans-74.4-34.4176.561.50000113.8V391 L392 R402 Y406V391-T394 WeakPolarHBondContact CG1-OG1 3.29Å; V391-T394 WeakPolarHBondContact O-CA 3.43Å; V391-T394 WeakPolarHBondContact O-CB 3.43Å; V391-T394 PolarHBondContact O-N 2.99Å; V391-T394 PolarHBondContact O-OG1 2.97Å; L392-T394 PolarHBondContact O-N 2.91Å; T394-R402 HydrophobicContact CG2-CG 4.4Å; T394-R402 PolarHBondContact O-NH2 2.77Å; T394-R402 VanDerWaalsContact O-NH2 3.1Å; T394-Y406 HydrophobicContact CG2-CE2 3.66Å; T394-Y406 WeakPolarHBondContact CG2-OH 3.3Å
395E80.9Confident76Confident36 Ų3622.7 Ų22.717%0.16814%0.137CC..Hα-helixtrans-84.5-25.3-176.3-67.7-179.3170.700111.9R334 V391 L392 T457 L462 I465R334-E395 IonicContact CZ-OE1 2.71Å; R334-E395 IonicContact NE-OE1 2.7Å; R334-E395 PolarHBondContact NE-OE1 3.19Å; R334-E395 VanDerWaalsContact NE-OE1 3.13Å; R334-E395 IonicContact NE-OE2 2.68Å; R334-E395 IonicContact NH2-OE1 3.07Å; R334-E395 PolarHBondContact NH2-OE1 3.07Å; V391-E395 HydrophobicContact CG1-CG 3.93Å; V391-E395 PolarHBondContact O-N 3.49Å; L392-E395 PolarHBondContact O-N 3.44Å; L392-E395 VanDerWaalsContact O-N 3.13Å; E395-T457 HydrophobicContact CB-CG2 4.11Å; E395-T457 WeakPolarHBondContact OE2-CB 3.12Å; E395-T457 PolarHBondContact OE2-OG1 3.38Å; E395-L462 VanDerWaalsContact O-CD1 3.32Å; E395-L462 WeakPolarHBondContact O-CD1 3.39Å; E395-I465 WeakPolarHBondContact O-CD1 3.37Å
396I84.8Confident76.2Confident0 Ų025.4 Ų25.40%015%0.145CC..Hα-helixtrans-95.2-38.3-177.1-63.1173.1000112.4Q270 V274 L392 L454 T457 F469Q270-I396 HydrophobicContact CB-CG2 3.49Å; Q270-I396 VanDerWaalsContact CB-CG2 3.49Å; Q270-I396 HydrophobicContact CG-CG2 3.49Å; Q270-I396 VanDerWaalsContact CG-CG2 3.49Å; Q270-I396 PolarHBondContact NE2-O 3.48Å; Q270-I396 VanDerWaalsContact NE2-O 3.14Å; V274-I396 HydrophobicContact CG2-CD1 4.26Å; L392-I396 HydrophobicContact CB-CD1 4.14Å; L392-I396 HydrophobicContact CD2-CD1 4.11Å; L392-I396 WeakPolarHBondContact O-CB 3.3Å; L392-I396 VanDerWaalsContact O-CG1 3.3Å; L392-I396 WeakPolarHBondContact O-CG1 3.39Å; L392-I396 PolarHBondContact O-N 3.18Å; I396-L454 HydrophobicContact CD1-CD1 4.19Å; I396-T457 HydrophobicContact CG1-CG2 4.47Å; I396-F469 HydrophobicContact CB-CE2 4.43Å; I396-F469 HydrophobicContact CD1-CE2 4.44Å; I396-F469 HydrophobicContact CD1-CZ 4.24Å; I396-F469 HydrophobicContact CG1-CE2 4.12Å; I396-F469 HydrophobicContact CG1-CZ 4.42Å; I396-F469 HydrophobicContact CG2-CD2 4.18Å; I396-F469 HydrophobicContact CG2-CE2 3.63Å; I396-F469 HydrophobicContact CG2-CZ 4Å
397F82.3Confident77.2Confident0 Ų028.3 Ų28.30%016%0.159CC..SBendtrans-101146.4-174.7-71.4-88.7000113.2L261 V267 Q270 L271 V274 P393 A401 R402 A405L261-F397 HydrophobicContact CD2-CD1 4.44Å; L261-F397 HydrophobicContact CD2-CE1 4Å; V267-F397 HydrophobicContact CB-CE1 4.16Å; Q270-F397 HydrophobicContact CB-CE1 3.94Å; Q270-F397 HydrophobicContact CB-CE2 4.15Å; Q270-F397 HydrophobicContact CB-CZ 3.68Å; L271-F397 HydrophobicContact CB-CZ 4.25Å; V274-F397 HydrophobicContact CB-CE2 4.29Å; V274-F397 HydrophobicContact CG2-CD2 4.41Å; V274-F397 HydrophobicContact CG2-CE2 3.7Å; P393-F397 WeakPolarHBondContact O-CB 3.23Å; P393-F397 PolarHBondContact O-N 3.14Å; F397-A401 HydrophobicContact CB-CB 4.39Å; F397-A401 HydrophobicContact CD1-CB 3.82Å; F397-R402 HydrophobicContact CB-CB 4.39Å; F397-A405 HydrophobicContact CB-CB 4.48Å; F397-A405 HydrophobicContact CD1-CB 4.24Å; F397-A405 HydrophobicContact CD2-CB 3.5Å; F397-A405 HydrophobicContact CE1-CB 4.33Å; F397-A405 HydrophobicContact CE2-CB 3.63Å; F397-A405 HydrophobicContact CG-CB 3.82Å; F397-A405 HydrophobicContact CZ-CB 4.03Å
398N76.9Confident78.3Confident66 Ų6628.2 Ų28.235%0.35316%0.156SC..  trans-68162.7169.869.86.7000112.4A400 A401 R402 L462N398-A400 PolarHBondContact O-N 2.96Å; N398-A400 VanDerWaalsContact O-N 3.14Å; N398-A401 PolarHBondContact O-N 2.86Å; N398-A401 VanDerWaalsContact O-N 3.1Å; N398-A401 WeakPolarHBondContact OD1-CB 3.01Å; N398-A401 PolarHBondContact OD1-N 3.26Å; N398-R402 WeakPolarHBondContact O-CB 3.43Å; N398-R402 PolarHBondContact O-N 3.12Å; N398-L462 HydrophobicContact CB-CD2 4.19Å
399Q68.4Low79.1Confident77 Ų7728.3 Ų28.336%0.3616%0.157SC..THydrogen-bonded Turntrans-54.4-37.2-175.2-164.477.2-4.100112.6E246 R402 P403E246-Q399 PolarHBondContact OE1-NE2 3.14Å; E246-Q399 VanDerWaalsContact OE1-NE2 3.16Å; Q399-R402 VanDerWaalsContact OE1-CZ 3.31Å; Q399-P403 WeakPolarHBondContact O-CD 3.45Å
400A73.3Confident79.3Confident15 Ų1528.5 Ų28.512%0.12416%0.159CC..THydrogen-bonded Turntrans-72.1-33.1-179.100000114M253 R256 N398M253-A400 HydrophobicContact SD-CB 4.4Å; R256-A400 PolarHBondContact N-O 2.94Å; N398-A400 PolarHBondContact O-N 2.96Å; N398-A400 VanDerWaalsContact O-N 3.14Å
401A77.6Confident79.9Confident0 Ų027.2 Ų27.20%014%0.144CC..THydrogen-bonded Turntrans-94.8-18.8-179.100000113.6L261 F397 N398 A404 A405L261-A401 HydrophobicContact CD1-CB 4.26Å; L261-A401 HydrophobicContact CD2-CB 4.26Å; L261-A401 HydrophobicContact CG-CB 4.34Å; F397-A401 HydrophobicContact CB-CB 4.39Å; F397-A401 HydrophobicContact CD1-CB 3.82Å; N398-A401 PolarHBondContact O-N 2.86Å; N398-A401 VanDerWaalsContact O-N 3.1Å; N398-A401 WeakPolarHBondContact OD1-CB 3.01Å; N398-A401 PolarHBondContact OD1-N 3.26Å; A401-A404 PolarHBondContact O-N 2.75Å; A401-A405 PolarHBondContact O-N 3.08Å
402R77.4Confident80.5Confident60 Ų6029 Ų2923%0.22615%0.151CC..Hα-helixtrans-56.6-45.2-175.5-176.6-173.1-63.7161.91.9114.3T394 F397 N398 Q399 A404 A405 Y406T394-R402 HydrophobicContact CG2-CG 4.4Å; T394-R402 PolarHBondContact O-NH2 2.77Å; T394-R402 VanDerWaalsContact O-NH2 3.1Å; F397-R402 HydrophobicContact CB-CB 4.39Å; N398-R402 WeakPolarHBondContact O-CB 3.43Å; N398-R402 PolarHBondContact O-N 3.12Å; Q399-R402 VanDerWaalsContact OE1-CZ 3.31Å; R402-A404 VanDerWaalsContact C-N 3.32Å; R402-A404 PolarHBondContact O-N 3.47Å; R402-A405 PolarHBondContact O-N 3.28Å; R402-Y406 HydrophobicContact CG-CD2 3.83Å; R402-Y406 HydrophobicContact CG-CE2 3.77Å; R402-Y406 WeakPolarHBondContact O-CD2 3.11Å; R402-Y406 PolarHBondContact O-N 2.86Å
403P75.1Confident80.9Confident72 Ų7230.1 Ų30.147%0.46816%0.157SC..Hα-helixtrans-61.4-39.5177.8-2434.9000112.9Q399 M407Q399-P403 WeakPolarHBondContact O-CD 3.45Å; P403-M407 PolarHBondContact O-N 2.94Å; P403-M407 VanDerWaalsContact O-N 3.13Å
404A80.4Confident81.4Confident2 Ų230 Ų302%0.01716%0.156CC..Hα-helixtrans-67.4-41.1176.200000112.1P258 L261 A401 R402 M407 I408P258-A404 HydrophobicContact CB-CB 4.37Å; L261-A404 HydrophobicContact CD1-CB 3.57Å; L261-A404 HydrophobicContact CD2-CB 3.86Å; L261-A404 HydrophobicContact CG-CB 4.36Å; A401-A404 PolarHBondContact O-N 2.75Å; R402-A404 VanDerWaalsContact C-N 3.32Å; R402-A404 PolarHBondContact O-N 3.47Å; A404-M407 PolarHBondContact O-N 3.5Å; A404-I408 WeakPolarHBondContact O-CG1 3.28Å; A404-I408 PolarHBondContact O-N 3Å
405A83.3Confident82.2Confident0 Ų030.9 Ų30.90%016%0.159CC..Hα-helixtrans-61.9-43.2175.900000112.1L261 P393 F397 A401 R402 M407 I408 A409L261-A405 HydrophobicContact CD2-CB 4.26Å; P393-A405 HydrophobicContact CB-CB 4.4Å; F397-A405 HydrophobicContact CB-CB 4.48Å; F397-A405 HydrophobicContact CD1-CB 4.24Å; F397-A405 HydrophobicContact CD2-CB 3.5Å; F397-A405 HydrophobicContact CE1-CB 4.33Å; F397-A405 HydrophobicContact CE2-CB 3.63Å; F397-A405 HydrophobicContact CG-CB 3.82Å; F397-A405 HydrophobicContact CZ-CB 4.03Å; A401-A405 PolarHBondContact O-N 3.08Å; R402-A405 PolarHBondContact O-N 3.28Å; A405-M407 PolarHBondContact O-N 3.02Å; A405-I408 PolarHBondContact O-N 3.49Å; A405-A409 VanDerWaalsContact O-CB 3.29Å; A405-A409 WeakPolarHBondContact O-CB 3.28Å; A405-A409 PolarHBondContact O-N 2.88Å
406Y79.3Confident82.8Confident69 Ų6930.4 Ų30.427%0.27116%0.158SC..Hα-helixtrans-60.6-43.5174.6-92.8-66.9000112.9G390 P393 T394 R402 I408 A409 G410G390-Y406 WeakPolarHBondContact O-CE1 3.29Å; G390-Y406 PolarHBondContact O-OH 2.96Å; P393-Y406 HydrophobicContact CB-CD1 4.37Å; P393-Y406 HydrophobicContact CB-CD2 4.23Å; P393-Y406 HydrophobicContact CB-CE1 4.18Å; P393-Y406 HydrophobicContact CB-CE2 4.07Å; P393-Y406 HydrophobicContact CB-CG 4.38Å; P393-Y406 HydrophobicContact CG-CD1 4.37Å; P393-Y406 HydrophobicContact CG-CE1 4.12Å; T394-Y406 HydrophobicContact CG2-CE2 3.66Å; T394-Y406 WeakPolarHBondContact CG2-OH 3.3Å; R402-Y406 HydrophobicContact CG-CD2 3.83Å; R402-Y406 HydrophobicContact CG-CE2 3.77Å; R402-Y406 WeakPolarHBondContact O-CD2 3.11Å; R402-Y406 PolarHBondContact O-N 2.86Å; Y406-I408 PolarHBondContact O-N 3.35Å; Y406-A409 PolarHBondContact O-N 3Å; Y406-G410 PolarHBondContact O-N 2.76Å
407M81.2Confident83.2Confident64 Ų6430.4 Ų30.432%0.31516%0.158SC..Hα-helixtrans-64-41.2178.6-178172.844.200111.7L77 P258 P403 A404 A405 S411L77-M407 HydrophobicContact CD2-CG 4.35Å; L77-M407 HydrophobicContact CD2-SD 4.39Å; P258-M407 HydrophobicContact CB-CE 3.79Å; P258-M407 HydrophobicContact CG-CE 3.31Å; P403-M407 PolarHBondContact O-N 2.94Å; P403-M407 VanDerWaalsContact O-N 3.13Å; A404-M407 PolarHBondContact O-N 3.5Å; A405-M407 PolarHBondContact O-N 3.02Å; M407-S411 WeakPolarHBondContact O-CB 3.25Å; M407-S411 PolarHBondContact O-N 2.95Å; M407-S411 PolarHBondContact O-OG 3.08Å
408I86Confident83.8Confident12 Ų1233.1 Ų33.16%0.06217%0.17CC..Hα-helixtrans-66.4-48.2176.4-65.2166.1000110.5P258 L261 F262 L271 I275 A404 A405 Y406 S411 M412P258-I408 HydrophobicContact CB-CD1 3.94Å; P258-I408 HydrophobicContact CB-CG1 4.02Å; L261-I408 HydrophobicContact CD2-CD1 4.45Å; F262-I408 HydrophobicContact CD2-CD1 4.29Å; F262-I408 HydrophobicContact CE2-CD1 3.54Å; F262-I408 HydrophobicContact CE2-CG1 4.08Å; F262-I408 HydrophobicContact CZ-CD1 3.89Å; F262-I408 HydrophobicContact CZ-CG1 4.31Å; F262-I408 HydrophobicContact CZ-CG2 4.12Å; L271-I408 HydrophobicContact CD1-CD1 3.79Å; L271-I408 HydrophobicContact CD1-CG2 4.26Å; I275-I408 HydrophobicContact CD1-CG2 4.06Å; I275-I408 HydrophobicContact CG1-CG2 3.8Å; A404-I408 WeakPolarHBondContact O-CG1 3.28Å; A404-I408 PolarHBondContact O-N 3Å; A405-I408 PolarHBondContact O-N 3.49Å; Y406-I408 PolarHBondContact O-N 3.35Å; I408-S411 WeakPolarHBondContact O-CB 3.28Å; I408-S411 PolarHBondContact O-N 3.28Å; I408-M412 WeakPolarHBondContact O-CG 3.4Å; I408-M412 PolarHBondContact O-N 2.86Å
409A85.3Confident84.7Confident6 Ų633 Ų335%0.0517%0.171CC..Hα-helixtrans-58.2-50.7178.400000112.1V274 S278 A405 Y406 S411 M412 M413V274-A409 HydrophobicContact CG1-CB 3.61Å; S278-A409 WeakPolarHBondContact OG-CB 3.45Å; A405-A409 VanDerWaalsContact O-CB 3.29Å; A405-A409 WeakPolarHBondContact O-CB 3.28Å; A405-A409 PolarHBondContact O-N 2.88Å; Y406-A409 PolarHBondContact O-N 3Å; A409-S411 VanDerWaalsContact C-N 3.34Å; A409-S411 PolarHBondContact O-N 3.38Å; A409-M412 PolarHBondContact O-N 3.43Å; A409-M413 PolarHBondContact O-N 2.9Å
410G83.9Confident85.9Confident9 Ų929.8 Ų29.89%0.09316%0.157CC..Hα-helixtrans-63.6-39.517800000112.3Y406 M412 M413 W414Y406-G410 PolarHBondContact O-N 2.76Å; G410-M412 PolarHBondContact O-N 3.29Å; G410-M413 PolarHBondContact O-N 3.28Å; G410-W414 PolarHBondContact O-N 3.2Å
411S87.5Confident86.7Confident14 Ų1429 Ų2910%0.09815%0.151CC..Hα-helixtrans-58.6-48.1174.4-68.50000111.8M407 I408 A409 M413 L415M407-S411 WeakPolarHBondContact O-CB 3.25Å; M407-S411 PolarHBondContact O-N 2.95Å; M407-S411 PolarHBondContact O-OG 3.08Å; I408-S411 WeakPolarHBondContact O-CB 3.28Å; I408-S411 PolarHBondContact O-N 3.28Å; A409-S411 VanDerWaalsContact C-N 3.34Å; A409-S411 PolarHBondContact O-N 3.38Å; S411-M413 VanDerWaalsContact C-N 3.34Å; S411-M413 PolarHBondContact O-N 3.06Å; S411-L415 WeakPolarHBondContact O-CB 3.22Å; S411-L415 VanDerWaalsContact O-CG 3.27Å; S411-L415 WeakPolarHBondContact O-CG 3.49Å; S411-L415 PolarHBondContact O-N 2.81Å
412M89.3Confident87.4Confident59 Ų5931 Ų3129%0.29116%0.16SC..Hα-helixtrans-63.6-40.5177.3-67.7-63104.400111.5I275 I408 A409 G410 L415 N416I275-M412 HydrophobicContact CG2-CG 4.33Å; I408-M412 WeakPolarHBondContact O-CG 3.4Å; I408-M412 PolarHBondContact O-N 2.86Å; A409-M412 PolarHBondContact O-N 3.43Å; G410-M412 PolarHBondContact O-N 3.29Å; M412-L415 HydrophobicContact CE-CD1 4.05Å; M412-N416 VanDerWaalsContact O-CB 3.24Å; M412-N416 WeakPolarHBondContact O-CB 3.46Å; M412-N416 PolarHBondContact O-N 2.9Å; M412-N416 PolarHBondContact O-ND2 2.92Å
413M89.1Confident88.1Confident27 Ų2732 Ų3213%0.13317%0.17CC..Hα-helixtrans-59.1-53.2177.4-167.5179.982.100111.3M136 Q282 A409 G410 S411 L415 N416 L417M136-M413 HydrophobicContact CE-CE 3.68Å; M136-M413 HydrophobicContact SD-CE 4.18Å; Q282-M413 WeakPolarHBondContact CG-O 3.2Å; A409-M413 PolarHBondContact O-N 2.9Å; G410-M413 PolarHBondContact O-N 3.28Å; S411-M413 VanDerWaalsContact C-N 3.34Å; S411-M413 PolarHBondContact O-N 3.06Å; M413-L415 PolarHBondContact O-N 2.89Å; M413-N416 PolarHBondContact O-N 3.13Å; M413-L417 WeakPolarHBondContact O-CB 3.38Å; M413-L417 PolarHBondContact O-N 3.28Å
414W91.6Very high88.9Confident2 Ų228.6 Ų28.61%0.00815%0.147CC..Hα-helixtrans-65.8-38.9-179.2-71.6112.8000113.7Y22 F68 F73 A132 M136 G410 L417 F418Y22-W414 AromaticContact CD2-CH2 3.83Å; Y22-W414 HydrophobicContact CD2-CH2 3.83Å; Y22-W414 AromaticContact CE2-CH2 3.52Å; Y22-W414 HydrophobicContact CE2-CH2 3.52Å; Y22-W414 HydrophobicContact CE2-CZ2 4.37Å; Y22-W414 AromaticContact CE2-CZ3 3.99Å; Y22-W414 HydrophobicContact CE2-CZ3 3.99Å; F68-W414 HydrophobicContact CD1-CZ3 4.43Å; F68-W414 HydrophobicContact CE1-CH2 4.35Å; F68-W414 AromaticContact CE1-CZ3 3.93Å; F68-W414 HydrophobicContact CE1-CZ3 3.93Å; F68-W414 HydrophobicContact CZ-CH2 4.43Å; F68-W414 HydrophobicContact CZ-CZ3 4.41Å; F73-W414 HydrophobicContact CB-CB 3.74Å; F73-W414 HydrophobicContact CB-CG 4.4Å; F73-W414 HydrophobicContact CD2-CB 4.42Å; A132-W414 HydrophobicContact CB-CH2 4.07Å; M136-W414 HydrophobicContact SD-CH2 3.99Å; M136-W414 HydrophobicContact SD-CZ2 3.55Å; M136-W414 VanDerWaalsContact SD-CZ2 3.55Å; G410-W414 PolarHBondContact O-N 3.2Å; W414-L417 HydrophobicContact CE3-CD2 3.92Å; W414-L417 HydrophobicContact CZ3-CD2 3.89Å; W414-L417 PolarHBondContact O-N 2.95Å; W414-F418 PolarHBondContact O-N 3.27Å
415L93.1Very high89.3Confident58 Ų5828.5 Ų28.530%0.30415%0.146SC..Hα-helixtrans-67.5-43.2177.2-71.9172.9000111.7F73 S411 M412 M413 L417 F418 V419F73-L415 HydrophobicContact CD1-CD2 4.44Å; F73-L415 HydrophobicContact CD2-CD1 4.44Å; F73-L415 HydrophobicContact CD2-CD2 4.32Å; F73-L415 HydrophobicContact CD2-CG 4Å; F73-L415 HydrophobicContact CE2-CD1 4Å; F73-L415 HydrophobicContact CE2-CD2 4.43Å; F73-L415 HydrophobicContact CE2-CG 4.06Å; F73-L415 HydrophobicContact CG-CD2 4.32Å; F73-L415 HydrophobicContact CG-CG 4.46Å; F73-L415 HydrophobicContact CZ-CD1 4.34Å; S411-L415 WeakPolarHBondContact O-CB 3.22Å; S411-L415 VanDerWaalsContact O-CG 3.27Å; S411-L415 WeakPolarHBondContact O-CG 3.49Å; S411-L415 PolarHBondContact O-N 2.81Å; M412-L415 HydrophobicContact CE-CD1 4.05Å; M413-L415 PolarHBondContact O-N 2.89Å; L415-L417 VanDerWaalsContact C-N 3.28Å; L415-L417 PolarHBondContact O-N 3.32Å; L415-F418 WeakPolarHBondContact O-CB 3.45Å; L415-F418 PolarHBondContact O-N 2.87Å; L415-V419 WeakPolarHBondContact O-CG2 3.46Å; L415-V419 PolarHBondContact O-N 3.39Å
416N94.3Very high89.5Confident27 Ų2731.4 Ų31.414%0.14416%0.159CC..Hα-helixtrans-66.1-33.6175.4-71.3-41.1000111.4S279 Q282 L283 M412 M413 F418 V419 V420S279-N416 VanDerWaalsContact CA-ND2 3.31Å; S279-N416 WeakPolarHBondContact CA-ND2 3.39Å; S279-N416 WeakPolarHBondContact CB-ND2 3.22Å; S279-N416 PolarHBondContact OG-ND2 2.7Å; Q282-N416 HydrophobicContact CB-CB 3.82Å; Q282-N416 HydrophobicContact CG-CB 3.9Å; L283-N416 HydrophobicContact CD2-CB 4Å; L283-N416 HydrophobicContact CG-CB 4.09Å; M412-N416 VanDerWaalsContact O-CB 3.24Å; M412-N416 WeakPolarHBondContact O-CB 3.46Å; M412-N416 PolarHBondContact O-N 2.9Å; M412-N416 PolarHBondContact O-ND2 2.92Å; M413-N416 PolarHBondContact O-N 3.13Å; N416-F418 VanDerWaalsContact C-N 3.31Å; N416-F418 PolarHBondContact O-N 3.49Å; N416-V419 PolarHBondContact O-N 3.3Å; N416-V420 WeakPolarHBondContact O-CG2 3.44Å; N416-V420 PolarHBondContact O-N 3.49Å
417L93Very high90Very high0 Ų030.1 Ų30.10%016%0.157CC..Hα-helixtrans-65.2-39.6176.1-178.364.7000110.4S69 Q282 D287 F291 M413 W414 L415 G421S69-L417 WeakPolarHBondContact OG-CD2 3.2Å; S69-L417 VanDerWaalsContact OG-CG 3.25Å; S69-L417 WeakPolarHBondContact OG-CG 3.26Å; Q282-L417 VanDerWaalsContact CD-CB 3.49Å; Q282-L417 VanDerWaalsContact CG-CA 3.41Å; Q282-L417 HydrophobicContact CG-CB 3.63Å; Q282-L417 HydrophobicContact CG-CD1 4.35Å; D287-L417 HydrophobicContact CB-CD1 3.57Å; F291-L417 HydrophobicContact CE2-CD1 3.94Å; F291-L417 HydrophobicContact CE2-CG 4.42Å; M413-L417 WeakPolarHBondContact O-CB 3.38Å; M413-L417 PolarHBondContact O-N 3.28Å; W414-L417 HydrophobicContact CE3-CD2 3.92Å; W414-L417 HydrophobicContact CZ3-CD2 3.89Å; W414-L417 PolarHBondContact O-N 2.95Å; L415-L417 VanDerWaalsContact C-N 3.28Å; L415-L417 PolarHBondContact O-N 3.32Å; L417-G421 PolarHBondContact O-N 2.96Å
418F94.5Very high90.3Very high57 Ų5727.1 Ų27.125%0.2514%0.142CC..Hα-helixtrans-61.8-48.7172.8174.6-103.3000111.7S66 L70 W414 L415 N416 G421 M422S66-F418 WeakPolarHBondContact O-CD2 3.22Å; L70-F418 HydrophobicContact CD1-CD2 3.94Å; L70-F418 HydrophobicContact CD1-CE2 3.61Å; L70-F418 HydrophobicContact CD1-CZ 4.03Å; L70-F418 HydrophobicContact CD2-CB 4.5Å; L70-F418 HydrophobicContact CD2-CD1 4.35Å; L70-F418 HydrophobicContact CD2-CD2 4.12Å; L70-F418 HydrophobicContact CD2-CE2 4.47Å; L70-F418 HydrophobicContact CD2-CG 4.06Å; L70-F418 HydrophobicContact CG-CD2 3.61Å; L70-F418 HydrophobicContact CG-CE2 3.85Å; L70-F418 HydrophobicContact CG-CG 4.06Å; L70-F418 HydrophobicContact CG-CZ 4.48Å; W414-F418 PolarHBondContact O-N 3.27Å; L415-F418 WeakPolarHBondContact O-CB 3.45Å; L415-F418 PolarHBondContact O-N 2.87Å; N416-F418 VanDerWaalsContact C-N 3.31Å; N416-F418 PolarHBondContact O-N 3.49Å; F418-G421 PolarHBondContact O-N 2.74Å; F418-M422 HydrophobicContact CD2-CG 4.25Å; F418-M422 HydrophobicContact CE1-CG 4.2Å; F418-M422 HydrophobicContact CE2-CG 3.81Å; F418-M422 HydrophobicContact CE2-SD 4.24Å; F418-M422 HydrophobicContact CZ-CG 3.78Å; F418-M422 HydrophobicContact CZ-SD 4.38Å; F418-M422 WeakPolarHBondContact O-CB 3.48Å; F418-M422 WeakPolarHBondContact O-CG 3.34Å; F418-M422 PolarHBondContact O-N 2.69Å
419V94.4Very high90.2Very high63 Ų6330.2 Ų30.238%0.38217%0.165SC..Hα-helixtrans-61-49.9-179.1171.20000111.1L415 N416 M422 I423L415-V419 WeakPolarHBondContact O-CG2 3.46Å; L415-V419 PolarHBondContact O-N 3.39Å; N416-V419 PolarHBondContact O-N 3.3Å; V419-M422 PolarHBondContact O-N 2.9Å; V419-I423 HydrophobicContact CG1-CD1 3.72Å; V419-I423 WeakPolarHBondContact O-CB 3.32Å; V419-I423 VanDerWaalsContact O-CG1 3.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.5Å; V419-I423 PolarHBondContact O-N 2.94Å; V419-I423 VanDerWaalsContact O-N 3.1Å
420V93.6Very high90.3Very high9 Ų932.9 Ų32.96%0.05519%0.193CC..Hα-helixtrans-67.1-42.3179-172.90000110.2L283 S288 N416 M422 I423 F424 F439L283-V420 HydrophobicContact CD2-CG2 3.69Å; S288-V420 WeakPolarHBondContact OG-CG1 3.44Å; N416-V420 WeakPolarHBondContact O-CG2 3.44Å; N416-V420 PolarHBondContact O-N 3.49Å; V420-M422 VanDerWaalsContact C-N 3.29Å; V420-M422 PolarHBondContact O-N 3.49Å; V420-I423 PolarHBondContact O-N 2.89Å; V420-F424 HydrophobicContact CG1-CB 4.3Å; V420-F424 HydrophobicContact CG1-CD2 4.2Å; V420-F424 WeakPolarHBondContact O-CA 3.44Å; V420-F424 WeakPolarHBondContact O-CB 2.96Å; V420-F424 PolarHBondContact O-N 2.67Å; V420-F439 HydrophobicContact CG1-CE1 3.88Å; V420-F439 HydrophobicContact CG1-CZ 4.23Å
421G90.9Very high90.4Very high0 Ų035.8 Ų35.80%021%0.206CC..Hα-helixtrans-54.7-43.1175.800000113.2S66 Y292 L417 F418 P425S66-G421 PolarHBondContact OG-O 3.02Å; Y292-G421 WeakPolarHBondContact CE2-O 3.42Å; Y292-G421 PolarHBondContact OH-O 3.14Å; Y292-G421 VanDerWaalsContact OH-O 3.04Å; L417-G421 PolarHBondContact O-N 2.96Å; F418-G421 PolarHBondContact O-N 2.74Å; G421-P425 WeakPolarHBondContact O-CD 3.27Å
422M92.9Very high90.3Very high41 Ų4137.5 Ų37.520%0.20222%0.218CC..Hα-helixtrans-69.3-39.3178.6-75.8-63.9-5900112.6I63 S66 F418 V419 V420 F426I63-M422 HydrophobicContact CG1-CE 3.86Å; I63-M422 HydrophobicContact CG1-SD 4.07Å; S66-M422 PolarHBondContact OG-N 3.05Å; S66-M422 VanDerWaalsContact OG-N 3.1Å; F418-M422 HydrophobicContact CD2-CG 4.25Å; F418-M422 HydrophobicContact CE1-CG 4.2Å; F418-M422 HydrophobicContact CE2-CG 3.81Å; F418-M422 HydrophobicContact CE2-SD 4.24Å; F418-M422 HydrophobicContact CZ-CG 3.78Å; F418-M422 HydrophobicContact CZ-SD 4.38Å; F418-M422 WeakPolarHBondContact O-CB 3.48Å; F418-M422 WeakPolarHBondContact O-CG 3.34Å; F418-M422 PolarHBondContact O-N 2.69Å; V419-M422 PolarHBondContact O-N 2.9Å; V420-M422 VanDerWaalsContact C-N 3.29Å; V420-M422 PolarHBondContact O-N 3.49Å; M422-F426 WeakPolarHBondContact O-CD2 3.36Å; M422-F426 VanDerWaalsContact O-CE2 3.25Å; M422-F426 WeakPolarHBondContact O-CE2 3.15Å
423I92.2Very high90.3Very high82 Ų8237.6 Ų37.642%0.42122%0.217SC..Hα-helixtrans-90.8-25.9-170.3-64172.3000112V419 V420 F426 L427V419-I423 HydrophobicContact CG1-CD1 3.72Å; V419-I423 WeakPolarHBondContact O-CB 3.32Å; V419-I423 VanDerWaalsContact O-CG1 3.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.5Å; V419-I423 PolarHBondContact O-N 2.94Å; V419-I423 VanDerWaalsContact O-N 3.1Å; V420-I423 PolarHBondContact O-N 2.89Å; I423-F426 PolarHBondContact O-N 3.33Å; I423-F426 VanDerWaalsContact O-N 3.15Å; I423-L427 HydrophobicContact CG2-CD1 3.66Å; I423-L427 HydrophobicContact CG2-CD2 4.31Å; I423-L427 HydrophobicContact CG2-CG 3.66Å; I423-L427 PolarHBondContact O-N 3.09Å
424F91.2Very high90.3Very high0 Ų042.7 Ų42.70%024%0.236CC..Hα-helixtrans-57.9-48.7-169.4-174.2-83000113.8I289 Y292 V296 V420 F426 L427 V428 F439I289-F424 HydrophobicContact CG1-CE2 4.36Å; I289-F424 HydrophobicContact CG1-CZ 4.1Å; Y292-F424 HydrophobicContact CD2-CB 4.19Å; Y292-F424 AromaticContact CD2-CD1 3.56Å; Y292-F424 HydrophobicContact CD2-CD1 3.56Å; Y292-F424 HydrophobicContact CD2-CE1 4.3Å; Y292-F424 HydrophobicContact CD2-CG 4.15Å; Y292-F424 HydrophobicContact CE2-CB 4.33Å; Y292-F424 HydrophobicContact CE2-CD1 4.48Å; Y292-F424 HydrophobicContact CG-CD1 4.03Å; V296-F424 HydrophobicContact CG2-CE1 3.67Å; V296-F424 HydrophobicContact CG2-CZ 3.72Å; V420-F424 HydrophobicContact CG1-CB 4.3Å; V420-F424 HydrophobicContact CG1-CD2 4.2Å; V420-F424 WeakPolarHBondContact O-CA 3.44Å; V420-F424 WeakPolarHBondContact O-CB 2.96Å; V420-F424 PolarHBondContact O-N 2.67Å; F424-F426 VanDerWaalsContact C-N 3.26Å; F424-F426 PolarHBondContact O-N 3.29Å; F424-L427 WeakPolarHBondContact O-CB 3.24Å; F424-L427 PolarHBondContact O-N 3.32Å; F424-L427 VanDerWaalsContact O-N 3.11Å; F424-V428 HydrophobicContact CD1-CG2 3.86Å; F424-V428 HydrophobicContact CE1-CG2 3.54Å; F424-V428 HydrophobicContact CZ-CG2 4.02Å; F424-V428 WeakPolarHBondContact O-CG2 3.43Å; F424-V428 PolarHBondContact O-N 2.74Å; F424-F439 HydrophobicContact CD2-CE1 4.36Å; F424-F439 AromaticContact CD2-CE2 3.7Å; F424-F439 HydrophobicContact CD2-CE2 3.7Å; F424-F439 AromaticContact CD2-CZ 3.41Å; F424-F439 HydrophobicContact CD2-CZ 3.41Å; F424-F439 VanDerWaalsContact CD2-CZ 3.41Å; F424-F439 HydrophobicContact CE2-CD2 4.42Å; F424-F439 AromaticContact CE2-CE2 3.56Å; F424-F439 HydrophobicContact CE2-CE2 3.56Å; F424-F439 AromaticContact CE2-CZ 3.75Å; F424-F439 HydrophobicContact CE2-CZ 3.75Å
425P88.6Confident90.2Very high0 Ų042.9 Ų42.90%024%0.238CC..Hα-helixtrans-62.2-35.7179.4-27.341000112.6T58 T62 Y292 G421 V428 S429T58-P425 HydrophobicContact CG2-CB 4.34Å; T62-P425 HydrophobicContact CG2-CB 4.01Å; T62-P425 HydrophobicContact CG2-CG 3.61Å; Y292-P425 HydrophobicContact CD1-CG 3.62Å; Y292-P425 HydrophobicContact CD2-CG 3.84Å; Y292-P425 HydrophobicContact CE1-CG 3.37Å; Y292-P425 HydrophobicContact CE2-CG 3.6Å; Y292-P425 HydrophobicContact CG-CG 3.85Å; G421-P425 WeakPolarHBondContact O-CD 3.27Å; P425-V428 PolarHBondContact O-N 2.89Å; P425-S429 PolarHBondContact O-N 3.24Å; P425-S429 PolarHBondContact O-OG 3.24Å
426F88.5Confident90Very high60 Ų6040.3 Ų40.326%0.26322%0.224SC..Hα-helixtrans-71.8-31.6176.6-56.2-73.1000112.6Y55 T58 L59 T62 M422 I423 F424 G430Y55-F426 HydrophobicContact CD2-CD1 4.39Å; Y55-F426 AromaticContact CD2-CE1 3.83Å; Y55-F426 HydrophobicContact CD2-CE1 3.83Å; Y55-F426 AromaticContact CE2-CD1 3.82Å; Y55-F426 HydrophobicContact CE2-CD1 3.82Å; Y55-F426 AromaticContact CE2-CE1 3.33Å; Y55-F426 HydrophobicContact CE2-CE1 3.33Å; Y55-F426 HydrophobicContact CE2-CZ 4.29Å; T58-F426 HydrophobicContact CG2-CE1 4.4Å; T58-F426 HydrophobicContact CG2-CZ 4.48Å; L59-F426 HydrophobicContact CD1-CE2 4.47Å; L59-F426 HydrophobicContact CD1-CZ 3.96Å; T62-F426 HydrophobicContact CG2-CE2 3.98Å; T62-F426 HydrophobicContact CG2-CZ 4.31Å; M422-F426 WeakPolarHBondContact O-CD2 3.36Å; M422-F426 VanDerWaalsContact O-CE2 3.25Å; M422-F426 WeakPolarHBondContact O-CE2 3.15Å; I423-F426 PolarHBondContact O-N 3.33Å; I423-F426 VanDerWaalsContact O-N 3.15Å; F424-F426 VanDerWaalsContact C-N 3.26Å; F424-F426 PolarHBondContact O-N 3.29Å; F426-G430 WeakPolarHBondContact O-CA 3.39Å; F426-G430 PolarHBondContact O-N 3.43Å
427L90Very high90Very high42 Ų4242.5 Ų42.522%0.2224%0.239CC..Hα-helixtrans-67.7-43.3171-72.5171.5000111.3I423 F424 L431 F439I423-L427 HydrophobicContact CG2-CD1 3.66Å; I423-L427 HydrophobicContact CG2-CD2 4.31Å; I423-L427 HydrophobicContact CG2-CG 3.66Å; I423-L427 PolarHBondContact O-N 3.09Å; F424-L427 WeakPolarHBondContact O-CB 3.24Å; F424-L427 PolarHBondContact O-N 3.32Å; F424-L427 VanDerWaalsContact O-N 3.11Å; L427-L431 HydrophobicContact CD2-CD1 3.7Å; L427-L431 HydrophobicContact CD2-CG 4.39Å; L427-L431 VanDerWaalsContact O-CB 3.27Å; L427-L431 WeakPolarHBondContact O-CB 3.38Å; L427-L431 PolarHBondContact O-N 2.93Å; L427-F439 HydrophobicContact CD1-CE2 4.5Å; L427-F439 HydrophobicContact CD1-CZ 3.89Å
428V87.1Confident90Very high2 Ų244.6 Ų44.61%0.01225%0.252CS..Hα-helixtrans-61-52.8178173.50000110.3E299 F424 P425 S432 C435E299-V428 HydrophobicContact CB-CG1 4.47Å; E299-V428 HydrophobicContact CG-CG1 3.7Å; F424-V428 HydrophobicContact CD1-CG2 3.86Å; F424-V428 HydrophobicContact CE1-CG2 3.54Å; F424-V428 HydrophobicContact CZ-CG2 4.02Å; F424-V428 WeakPolarHBondContact O-CG2 3.43Å; F424-V428 PolarHBondContact O-N 2.74Å; P425-V428 PolarHBondContact O-N 2.89Å; V428-S432 WeakPolarHBondContact O-CA 3.43Å; V428-S432 PolarHBondContact O-N 3.35Å; V428-S432 VanDerWaalsContact O-N 3.11Å; V428-C435 HydrophobicContact CG2-CB 4.35Å
429S83.9Confident90Very high77 Ų7742.2 Ų42.254%0.53824%0.242SC..Hα-helixtrans-71.5-33.1-179.9-56.60000113.7P425P425-S429 PolarHBondContact O-N 3.24Å; P425-S429 PolarHBondContact O-OG 3.24Å
430G85.8Confident90Very high62 Ų6239.5 Ų39.564%0.63923%0.227SC*.Hα-helixtrans-85.2-34.9-174.300000114.7F426F426-G430 WeakPolarHBondContact O-CA 3.39Å; F426-G430 PolarHBondContact O-N 3.43Å
431L87.5Confident90.1Very high70 Ų7041.5 Ų41.537%0.36624%0.244SC..Hα-helixtrans-98.4-13.4179.5-62.7177.7000113.2L427 E433 Y434 C435 P438L427-L431 HydrophobicContact CD2-CD1 3.7Å; L427-L431 HydrophobicContact CD2-CG 4.39Å; L427-L431 VanDerWaalsContact O-CB 3.27Å; L427-L431 WeakPolarHBondContact O-CB 3.38Å; L427-L431 PolarHBondContact O-N 2.93Å; L431-E433 PolarHBondContact O-N 3.03Å; L431-E433 VanDerWaalsContact O-N 3.09Å; L431-Y434 PolarHBondContact O-N 3.16Å; L431-C435 HydrophobicContact CB-CB 4.43Å; L431-P438 HydrophobicContact CD1-CG 3.93Å
432S85.9Confident90.3Very high50 Ų5044 Ų4435%0.3526%0.257SS..G310 helixtrans47.3-113.1179.4-173.70000111.2V428 Y434 C435V428-S432 WeakPolarHBondContact O-CA 3.43Å; V428-S432 PolarHBondContact O-N 3.35Å; V428-S432 VanDerWaalsContact O-N 3.11Å; S432-Y434 PolarHBondContact O-N 2.52Å; S432-C435 VanDerWaalsContact O-CB 3.27Å; S432-C435 WeakPolarHBondContact O-CB 3.12Å; S432-C435 PolarHBondContact O-N 3.18Å; S432-C435 PolarHBondContact O-SG 3.03Å
433E87.3Confident90.5Very high60 Ų6042 Ų4228%0.2825%0.247SC..G310 helixtrans-53.4-29.8178.9-57.7169.6-155.200114.1T353 L356 S357 L431T353-E433 WeakPolarHBondContact CG2-O 3.01Å; T353-E433 PolarHBondContact OG1-O 3.19Å; L356-E433 HydrophobicContact CB-CB 4.21Å; L356-E433 HydrophobicContact CB-CG 4.32Å; S357-E433 VanDerWaalsContact CA-OE2 3.22Å; S357-E433 WeakPolarHBondContact CA-OE2 3.39Å; S357-E433 VanDerWaalsContact CB-OE2 3.26Å; S357-E433 WeakPolarHBondContact CB-OE2 3.24Å; S357-E433 PolarHBondContact OG-OE2 2.86Å; L431-E433 PolarHBondContact O-N 3.03Å; L431-E433 VanDerWaalsContact O-N 3.09Å
434Y90.5Very high90.7Very high135 Ų13541.6 Ų41.653%0.52925%0.245SC..G310 helixtrans-93.47.8-177.1-56.4-80000113.9T353 L431 S432 F436 V437T353-Y434 HydrophobicContact CG2-CD1 4Å; T353-Y434 HydrophobicContact CG2-CE1 4.41Å; L431-Y434 PolarHBondContact O-N 3.16Å; S432-Y434 PolarHBondContact O-N 2.52Å; Y434-F436 PolarHBondContact O-N 3.42Å; Y434-F436 VanDerWaalsContact O-N 3.11Å; Y434-V437 HydrophobicContact CD1-CG2 4.17Å; Y434-V437 WeakPolarHBondContact O-CB 3.36Å; Y434-V437 PolarHBondContact O-N 2.95Å
435C88.3Confident90.9Very high6 Ų645.1 Ų45.14%0.04127%0.27CS..THydrogen-bonded Turntrans-59.3-26.7-172.860.30000114.8V428 L431 S432 F439V428-C435 HydrophobicContact CG2-CB 4.35Å; L431-C435 HydrophobicContact CB-CB 4.43Å; S432-C435 VanDerWaalsContact O-CB 3.27Å; S432-C435 WeakPolarHBondContact O-CB 3.12Å; S432-C435 PolarHBondContact O-N 3.18Å; S432-C435 PolarHBondContact O-SG 3.03Å; C435-F439 WeakPolarHBondContact O-CE2 3.47Å
436F89.5Confident91.2Very high3 Ų345.6 Ų45.61%0.01327%0.273CS..THydrogen-bonded Turntrans-91.8-7.3177.4-86.4-110.4000115.3I289 V296 A349 F352 Y376 Y434 F439 G440I289-F436 HydrophobicContact CD1-CE1 3.68Å; I289-F436 HydrophobicContact CD1-CZ 3.75Å; I289-F436 HydrophobicContact CG1-CE1 4.3Å; I289-F436 HydrophobicContact CG1-CZ 3.92Å; V296-F436 HydrophobicContact CG1-CE2 4.16Å; V296-F436 HydrophobicContact CG1-CZ 4.35Å; A349-F436 HydrophobicContact CB-CB 4.37Å; F352-F436 HydrophobicContact CD1-CB 3.96Å; F352-F436 HydrophobicContact CD1-CD1 4.3Å; F352-F436 AromaticContact CD1-CD2 3.53Å; F352-F436 HydrophobicContact CD1-CD2 3.53Å; F352-F436 HydrophobicContact CD1-CE2 4.03Å; F352-F436 AromaticContact CD1-CG 3.67Å; F352-F436 HydrophobicContact CD1-CG 3.67Å; F352-F436 AromaticContact CE1-CD2 3.29Å; F352-F436 HydrophobicContact CE1-CD2 3.29Å; F352-F436 AromaticContact CE1-CE2 3.46Å; F352-F436 HydrophobicContact CE1-CE2 3.46Å; F352-F436 VanDerWaalsContact CE1-CE2 3.46Å; F352-F436 AromaticContact CE1-CG 3.95Å; F352-F436 HydrophobicContact CE1-CG 3.95Å; F352-F436 HydrophobicContact CE1-CZ 4.23Å; F352-F436 HydrophobicContact CZ-CD2 4.43Å; F352-F436 HydrophobicContact CZ-CE2 4.23Å; Y376-F436 HydrophobicContact CE1-CE1 4.44Å; Y376-F436 HydrophobicContact CE2-CD1 4.48Å; Y434-F436 PolarHBondContact O-N 3.42Å; Y434-F436 VanDerWaalsContact O-N 3.11Å; F436-F439 HydrophobicContact CD1-CD2 4.4Å; F436-F439 HydrophobicContact CG-CD2 4.4Å; F436-F439 PolarHBondContact O-N 3.31Å; F436-G440 PolarHBondContact O-N 3.04Å
437V93.6Very high91.5Very high74 Ų7442.9 Ų42.945%0.44826%0.262SS..Hα-helixtrans-60.2-45179.5175.90000112.5T353 Y434 F439 G440 A441T353-V437 HydrophobicContact CG2-CG2 4.06Å; Y434-V437 HydrophobicContact CD1-CG2 4.17Å; Y434-V437 WeakPolarHBondContact O-CB 3.36Å; Y434-V437 PolarHBondContact O-N 2.95Å; V437-F439 VanDerWaalsContact C-N 3.32Å; V437-F439 PolarHBondContact O-N 3.4Å; V437-G440 PolarHBondContact O-N 3.48Å; V437-A441 PolarHBondContact O-N 3.48Å
438P94.2Very high91.8Very high44 Ų4445.6 Ų45.629%0.28628%0.276SS..Hα-helixtrans-59.6-41.5176.1-23.634.7000112.6L431 A441 I442L431-P438 HydrophobicContact CD1-CG 3.93Å; P438-A441 PolarHBondContact O-N 3.41Å; P438-I442 VanDerWaalsContact O-CG1 3.31Å; P438-I442 WeakPolarHBondContact O-CG1 3.2Å; P438-I442 PolarHBondContact O-N 3.34Å; P438-I442 VanDerWaalsContact O-N 3.11Å
439F93.8Very high92.2Very high6 Ų646.7 Ų46.73%0.02628%0.28CS..Hα-helixtrans-67.5-41.7178.7-57.1-55.1000111.7L283 V420 F424 L427 C435 F436 V437 A441 I442 C443L283-F439 VanDerWaalsContact O-CD1 3.31Å; L283-F439 WeakPolarHBondContact O-CD1 3.3Å; V420-F439 HydrophobicContact CG1-CE1 3.88Å; V420-F439 HydrophobicContact CG1-CZ 4.23Å; F424-F439 HydrophobicContact CD2-CE1 4.36Å; F424-F439 AromaticContact CD2-CE2 3.7Å; F424-F439 HydrophobicContact CD2-CE2 3.7Å; F424-F439 AromaticContact CD2-CZ 3.41Å; F424-F439 HydrophobicContact CD2-CZ 3.41Å; F424-F439 VanDerWaalsContact CD2-CZ 3.41Å; F424-F439 HydrophobicContact CE2-CD2 4.42Å; F424-F439 AromaticContact CE2-CE2 3.56Å; F424-F439 HydrophobicContact CE2-CE2 3.56Å; F424-F439 AromaticContact CE2-CZ 3.75Å; F424-F439 HydrophobicContact CE2-CZ 3.75Å; L427-F439 HydrophobicContact CD1-CE2 4.5Å; L427-F439 HydrophobicContact CD1-CZ 3.89Å; C435-F439 WeakPolarHBondContact O-CE2 3.47Å; F436-F439 HydrophobicContact CD1-CD2 4.4Å; F436-F439 HydrophobicContact CG-CD2 4.4Å; F436-F439 PolarHBondContact O-N 3.31Å; V437-F439 VanDerWaalsContact C-N 3.32Å; V437-F439 PolarHBondContact O-N 3.4Å; F439-A441 PolarHBondContact O-N 2.91Å; F439-I442 PolarHBondContact O-N 2.98Å; F439-C443 PolarHBondContact O-N 3.41Å; F439-C443 PolarHBondContact O-SG 2.87Å
440G94.7Very high92.6Very high7 Ų743.1 Ų43.17%0.07226%0.255CS..Hα-helixtrans-60.8-41.4173.600000112.8F436 V437 I442 C443 L444F436-G440 PolarHBondContact O-N 3.04Å; V437-G440 PolarHBondContact O-N 3.48Å; G440-I442 PolarHBondContact O-N 3.25Å; G440-C443 PolarHBondContact O-N 2.8Å; G440-L444 WeakPolarHBondContact O-CB 3.31Å; G440-L444 PolarHBondContact O-N 3.34Å
441A95.9Very high92.8Very high50 Ų5041.1 Ų41.141%0.41324%0.235SC..Hα-helixtrans-63.9-39.7176.600000112.5V437 P438 F439 L444 S445V437-A441 PolarHBondContact O-N 3.48Å; P438-A441 PolarHBondContact O-N 3.41Å; F439-A441 PolarHBondContact O-N 2.91Å; A441-L444 PolarHBondContact O-N 3.16Å; A441-S445 WeakPolarHBondContact O-CB 3.49Å; A441-S445 PolarHBondContact O-N 3.18Å; A441-S445 PolarHBondContact O-OG 2.83Å
442I95.8Very high92.9Very high53 Ų5343.9 Ų43.927%0.27225%0.249SC..Hα-helixtrans-65.4-44174.9-67.3167.9000110.3L283 P438 F439 G440 S445 S446L283-I442 HydrophobicContact CB-CD1 4.07Å; L283-I442 HydrophobicContact CB-CG2 3.88Å; P438-I442 VanDerWaalsContact O-CG1 3.31Å; P438-I442 WeakPolarHBondContact O-CG1 3.2Å; P438-I442 PolarHBondContact O-N 3.34Å; P438-I442 VanDerWaalsContact O-N 3.11Å; F439-I442 PolarHBondContact O-N 2.98Å; G440-I442 PolarHBondContact O-N 3.25Å; I442-S445 PolarHBondContact O-N 3.36Å; I442-S446 VanDerWaalsContact O-CB 3.29Å; I442-S446 WeakPolarHBondContact O-CB 3.36Å; I442-S446 PolarHBondContact O-N 3.36Å; I442-S446 PolarHBondContact O-OG 3.34Å
443C95.4Very high93.1Very high0 Ų045 Ų450%025%0.248CC..Hα-helixtrans-60.3-47.1176-66.90000111.6F342 M345 T346 F439 G440 S445 S446 A447F342-C443 HydrophobicContact CB-CB 4.49Å; F342-C443 WeakPolarHBondContact CB-O 3.31Å; F342-C443 HydrophobicContact CD1-CB 4.07Å; M345-C443 HydrophobicContact CB-CB 4.31Å; T346-C443 WeakPolarHBondContact OG1-CB 3.35Å; F439-C443 PolarHBondContact O-N 3.41Å; F439-C443 PolarHBondContact O-SG 2.87Å; G440-C443 PolarHBondContact O-N 2.8Å; C443-S445 PolarHBondContact O-N 3.28Å; C443-S446 PolarHBondContact O-N 3.39Å; C443-A447 PolarHBondContact O-N 3.15Å
444L96.7Very high93.1Very high73 Ų7342.3 Ų42.338%0.38224%0.235SC..Hα-helixtrans-61.6-48.1178.9-17858.3000111.8L343 T346 G440 A441 S446 A447 L448L343-L444 HydrophobicContact CD2-CD1 4.34Å; T346-L444 HydrophobicContact CG2-CB 3.83Å; T346-L444 HydrophobicContact CG2-CD1 4.36Å; T346-L444 HydrophobicContact CG2-CG 4.46Å; T346-L444 PolarHBondContact OG1-N 2.7Å; T346-L444 VanDerWaalsContact OG1-N 3.12Å; G440-L444 WeakPolarHBondContact O-CB 3.31Å; G440-L444 PolarHBondContact O-N 3.34Å; A441-L444 PolarHBondContact O-N 3.16Å; L444-S446 PolarHBondContact O-N 2.9Å; L444-A447 PolarHBondContact O-N 2.76Å; L444-L448 HydrophobicContact CD1-CG 4.47Å; L444-L448 HydrophobicContact CG-CD1 4.31Å; L444-L448 WeakPolarHBondContact O-CG 3.49Å; L444-L448 PolarHBondContact O-N 3.39Å
445S96.6Very high93Very high74 Ų7436.5 Ų36.552%0.51721%0.214SC..Hα-helixtrans-59.5-38.6178-57.60000111.2A441 I442 C443 Y449A441-S445 WeakPolarHBondContact O-CB 3.49Å; A441-S445 PolarHBondContact O-N 3.18Å; A441-S445 PolarHBondContact O-OG 2.83Å; I442-S445 PolarHBondContact O-N 3.36Å; C443-S445 PolarHBondContact O-N 3.28Å; S445-Y449 WeakPolarHBondContact O-CB 3.36Å; S445-Y449 PolarHBondContact O-N 2.84Å
446S94.7Very high92.9Very high9 Ų938.2 Ų38.26%0.06322%0.221CC..Hα-helixtrans-69.9-42.3178.2-56.40000112A280 I442 C443 L444 L448 Y449 I450A280-S446 WeakPolarHBondContact CB-OG 3.32Å; I442-S446 VanDerWaalsContact O-CB 3.29Å; I442-S446 WeakPolarHBondContact O-CB 3.36Å; I442-S446 PolarHBondContact O-N 3.36Å; I442-S446 PolarHBondContact O-OG 3.34Å; C443-S446 PolarHBondContact O-N 3.39Å; L444-S446 PolarHBondContact O-N 2.9Å; S446-L448 PolarHBondContact O-N 3.32Å; S446-Y449 PolarHBondContact O-N 3.42Å; S446-I450 WeakPolarHBondContact O-CB 3.29Å; S446-I450 WeakPolarHBondContact O-CD1 3.47Å; S446-I450 VanDerWaalsContact O-CG1 3.28Å; S446-I450 WeakPolarHBondContact O-CG1 3.34Å; S446-I450 PolarHBondContact O-N 3Å
447A95.3Very high92.6Very high3 Ų338.4 Ų38.43%0.02522%0.223CC..Hα-helixtrans-60-44.917400000111.9M339 F342 L343 C443 L444 I450 G451M339-A447 HydrophobicContact CG-CB 4.49Å; F342-A447 HydrophobicContact CB-CB 3.88Å; L343-A447 HydrophobicContact CD2-CB 3.75Å; L343-A447 HydrophobicContact CG-CB 3.73Å; C443-A447 PolarHBondContact O-N 3.15Å; L444-A447 PolarHBondContact O-N 2.76Å; A447-I450 PolarHBondContact O-N 3.2Å; A447-G451 PolarHBondContact O-N 3.09Å
448L95.8Very high92.1Very high99 Ų9938.7 Ų38.752%0.51822%0.218SC..Hα-helixtrans-62.4-44.7175.8-68.8173.5000111.3L444 S446 I450 G451 L452L444-L448 HydrophobicContact CD1-CG 4.47Å; L444-L448 HydrophobicContact CG-CD1 4.31Å; L444-L448 WeakPolarHBondContact O-CG 3.49Å; L444-L448 PolarHBondContact O-N 3.39Å; S446-L448 PolarHBondContact O-N 3.32Å; L448-I450 PolarHBondContact O-N 3.38Å; L448-G451 PolarHBondContact O-N 3.48Å; L448-L452 WeakPolarHBondContact O-CB 3.35Å; L448-L452 VanDerWaalsContact O-CG 3.29Å; L448-L452 WeakPolarHBondContact O-CG 3.46Å; L448-L452 PolarHBondContact O-N 2.69Å
449Y94.8Very high91.2Very high26 Ų2640.8 Ų40.810%0.10225%0.247CC..Hα-helixtrans-59.9-48.6177.2-178.4-92000112S273 I276 S445 S446 G451 L452 F453S273-Y449 WeakPolarHBondContact CA-OH 3.31Å; S273-Y449 PolarHBondContact OG-OH 3.34Å; I276-Y449 HydrophobicContact CB-CD1 4.43Å; I276-Y449 HydrophobicContact CB-CE1 4.22Å; I276-Y449 HydrophobicContact CD1-CD2 3.94Å; I276-Y449 HydrophobicContact CD1-CE1 4.14Å; I276-Y449 HydrophobicContact CD1-CE2 3.48Å; I276-Y449 VanDerWaalsContact CD1-CE2 3.48Å; I276-Y449 HydrophobicContact CD1-CG 4.45Å; I276-Y449 HydrophobicContact CG2-CD1 3.8Å; I276-Y449 HydrophobicContact CG2-CE1 4.09Å; I276-Y449 HydrophobicContact CG2-CG 4.05Å; S445-Y449 WeakPolarHBondContact O-CB 3.36Å; S445-Y449 PolarHBondContact O-N 2.84Å; S446-Y449 PolarHBondContact O-N 3.42Å; Y449-G451 VanDerWaalsContact C-N 3.29Å; Y449-G451 PolarHBondContact O-N 2.99Å; Y449-L452 PolarHBondContact O-N 3.09Å; Y449-L452 VanDerWaalsContact O-N 3.14Å; Y449-F453 HydrophobicContact CD2-CB 4.41Å; Y449-F453 AromaticContact CD2-CD2 3.52Å; Y449-F453 HydrophobicContact CD2-CD2 3.52Å; Y449-F453 HydrophobicContact CD2-CE2 4.18Å; Y449-F453 HydrophobicContact CD2-CG 4.27Å; Y449-F453 HydrophobicContact CE1-CB 4.26Å; Y449-F453 HydrophobicContact CE2-CB 3.97Å; Y449-F453 AromaticContact CE2-CD2 3.62Å; Y449-F453 HydrophobicContact CE2-CD2 3.62Å; Y449-F453 HydrophobicContact CE2-CE2 4.38Å; Y449-F453 AromaticContact CE2-CG 3.95Å; Y449-F453 HydrophobicContact CE2-CG 3.95Å; Y449-F453 HydrophobicContact CG-CD2 4.21Å; Y449-F453 PolarHBondContact O-N 3.33Å
450I92.7Very high90.5Very high1 Ų144 Ų441%0.00526%0.262CS..Hα-helixtrans-62.4-39.4177.2-69.8160.6000110.9I277 R335 L338 M339 F342 S446 A447 L448 L452 L454I277-I450 HydrophobicContact CD1-CG1 4.28Å; I277-I450 HydrophobicContact CG1-CG1 4.21Å; R335-I450 HydrophobicContact CG-CG2 3.86Å; R335-I450 PolarHBondContact NE-O 2.92Å; L338-I450 HydrophobicContact CB-CD1 3.88Å; L338-I450 HydrophobicContact CB-CG2 4.27Å; M339-I450 HydrophobicContact CB-CG2 4.05Å; F342-I450 HydrophobicContact CD2-CD1 3.54Å; F342-I450 HydrophobicContact CE2-CD1 3.6Å; S446-I450 WeakPolarHBondContact O-CB 3.29Å; S446-I450 WeakPolarHBondContact O-CD1 3.47Å; S446-I450 VanDerWaalsContact O-CG1 3.28Å; S446-I450 WeakPolarHBondContact O-CG1 3.34Å; S446-I450 PolarHBondContact O-N 3Å; A447-I450 PolarHBondContact O-N 3.2Å; L448-I450 PolarHBondContact O-N 3.38Å; I450-L452 VanDerWaalsContact C-N 3.26Å; I450-L452 PolarHBondContact O-N 2.92Å; I450-L454 HydrophobicContact CB-CB 4.49Å; I450-L454 HydrophobicContact CG1-CD2 4.41Å; I450-L454 HydrophobicContact CG2-CB 4.19Å; I450-L454 HydrophobicContact CG2-CD2 3.88Å; I450-L454 PolarHBondContact O-N 3.4Å
451G90.6Very high89.7Confident21 Ų2146.5 Ų46.522%0.21628%0.277CS..Hα-helixtrans-64.2-26.217600000113.7R335 A447 L448 Y449R335-G451 PolarHBondContact NH2-O 3.28Å; A447-G451 PolarHBondContact O-N 3.09Å; L448-G451 PolarHBondContact O-N 3.48Å; Y449-G451 VanDerWaalsContact C-N 3.29Å; Y449-G451 PolarHBondContact O-N 2.99Å
452L89.8Confident88.7Confident128 Ų12847 Ų4767%0.6727%0.273SS*.Hα-helixtrans-105.5-37.7-175.7-66.4173.3000114L448 Y449 I450L448-L452 WeakPolarHBondContact O-CB 3.35Å; L448-L452 VanDerWaalsContact O-CG 3.29Å; L448-L452 WeakPolarHBondContact O-CG 3.46Å; L448-L452 PolarHBondContact O-N 2.69Å; Y449-L452 PolarHBondContact O-N 3.09Å; Y449-L452 VanDerWaalsContact O-N 3.14Å; I450-L452 VanDerWaalsContact C-N 3.26Å; I450-L452 PolarHBondContact O-N 2.92Å
453F88.7Confident87.5Confident74 Ų7448.5 Ų48.533%0.32529%0.288SS..Hα-helixtrans-117.8-19.1-165.7-61.9-76.4000114.8W269 Y449 P455W269-F453 HydrophobicContact CE3-CD1 4.35Å; W269-F453 AromaticContact CH2-CD1 3.89Å; W269-F453 HydrophobicContact CH2-CD1 3.89Å; W269-F453 AromaticContact CH2-CE1 3.75Å; W269-F453 HydrophobicContact CH2-CE1 3.75Å; W269-F453 HydrophobicContact CH2-CZ 4.49Å; W269-F453 AromaticContact CZ3-CD1 3.63Å; W269-F453 HydrophobicContact CZ3-CD1 3.63Å; W269-F453 AromaticContact CZ3-CE1 3.96Å; W269-F453 HydrophobicContact CZ3-CE1 3.96Å; W269-F453 HydrophobicContact CZ3-CG 4.14Å; Y449-F453 HydrophobicContact CD2-CB 4.41Å; Y449-F453 AromaticContact CD2-CD2 3.52Å; Y449-F453 HydrophobicContact CD2-CD2 3.52Å; Y449-F453 HydrophobicContact CD2-CE2 4.18Å; Y449-F453 HydrophobicContact CD2-CG 4.27Å; Y449-F453 HydrophobicContact CE1-CB 4.26Å; Y449-F453 HydrophobicContact CE2-CB 3.97Å; Y449-F453 AromaticContact CE2-CD2 3.62Å; Y449-F453 HydrophobicContact CE2-CD2 3.62Å; Y449-F453 HydrophobicContact CE2-CE2 4.38Å; Y449-F453 AromaticContact CE2-CG 3.95Å; Y449-F453 HydrophobicContact CE2-CG 3.95Å; Y449-F453 HydrophobicContact CG-CD2 4.21Å; Y449-F453 PolarHBondContact O-N 3.33Å; F453-P455 VanDerWaalsContact O-CD 3.28Å; F453-P455 WeakPolarHBondContact O-CD 3.29Å
454L88.8Confident86.8Confident3 Ų351.6 Ų51.62%0.01631%0.307CS..PPolyproline II helixtrans-87.3116.1-179.3-17169.4000110.6I277 R335 L338 I396 I450I277-L454 HydrophobicContact CD1-CD1 3.77Å; I277-L454 HydrophobicContact CD1-CD2 3.82Å; I277-L454 HydrophobicContact CD1-CG 4.31Å; R335-L454 WeakPolarHBondContact CD-O 3.12Å; R335-L454 PolarHBondContact NE-O 2.82Å; R335-L454 VanDerWaalsContact NE-O 3.1Å; L338-L454 HydrophobicContact CD1-CD2 3.99Å; I396-L454 HydrophobicContact CD1-CD1 4.19Å; I450-L454 HydrophobicContact CB-CB 4.49Å; I450-L454 HydrophobicContact CG1-CD2 4.41Å; I450-L454 HydrophobicContact CG2-CB 4.19Å; I450-L454 HydrophobicContact CG2-CD2 3.88Å; I450-L454 PolarHBondContact O-N 3.4Å
455P86.6Confident86Confident12 Ų1248.2 Ų48.28%0.07829%0.289CS..PPolyproline II helixtrans-68.6149.9170.827.7-33.2000111.2F453 T457 E468 F469F453-P455 VanDerWaalsContact O-CD 3.28Å; F453-P455 WeakPolarHBondContact O-CD 3.29Å; P455-T457 PolarHBondContact O-N 3.46Å; P455-E468 HydrophobicContact CB-CB 4.49Å; P455-E468 WeakPolarHBondContact CB-OE2 3.21Å; P455-F469 HydrophobicContact CG-CD2 4Å; P455-F469 HydrophobicContact CG-CE1 4.28Å; P455-F469 HydrophobicContact CG-CE2 3.33Å; P455-F469 HydrophobicContact CG-CZ 3.51Å
456E87.9Confident85.2Confident43 Ų4347.1 Ų47.120%0.20128%0.28CS..PPolyproline II helixtrans-70.7126.5171.2179.958.7-110.500109.5R334 R335 K458 K460R334-E456 PolarHBondContact N-OE1 3.36Å; R334-E456 PolarHBondContact N-OE2 3.24Å; R335-E456 WeakPolarHBondContact CB-OE2 3.33Å; R335-E456 PolarHBondContact N-OE2 2.87Å; E456-K458 HydrophobicContact CG-CB 4.07Å; E456-K458 WeakPolarHBondContact OE1-CB 3.11Å; E456-K458 PolarHBondContact OE1-N 2.97Å; E456-K460 WeakPolarHBondContact O-CD 3.44Å; E456-K460 WeakPolarHBondContact O-CE 3.46Å; E456-K460 PolarHBondContact O-NZ 2.91Å
457T83.4Confident84.5Confident6 Ų650.6 Ų50.64%0.03730%0.304CS..  trans-94.5-18.7-178.756.40000112.6R334 L392 E395 I396 P455 G459 K460 I465R334-T457 WeakPolarHBondContact CD-OG1 3.43Å; L392-T457 HydrophobicContact CD2-CG2 4.44Å; E395-T457 HydrophobicContact CB-CG2 4.11Å; E395-T457 WeakPolarHBondContact OE2-CB 3.12Å; E395-T457 PolarHBondContact OE2-OG1 3.38Å; I396-T457 HydrophobicContact CG1-CG2 4.47Å; P455-T457 PolarHBondContact O-N 3.46Å; T457-G459 PolarHBondContact O-N 3.15Å; T457-K460 PolarHBondContact O-N 3.13Å; T457-I465 HydrophobicContact CG2-CD1 4.05Å
458K82.2Confident84Confident80 Ų8054 Ų5435%0.34832%0.319SS..THydrogen-bonded Turntrans-56.5121.7-178.4175.6179.1158163.40111.9E330 R331 E456 K460E330-K458 WeakPolarHBondContact O-CE 3.14Å; E330-K458 PolarHBondContact O-NZ 2.73Å; R331-K458 PolarHBondContact O-NZ 2.98Å; E456-K458 HydrophobicContact CG-CB 4.07Å; E456-K458 WeakPolarHBondContact OE1-CB 3.11Å; E456-K458 PolarHBondContact OE1-N 2.97Å; K458-K460 PolarHBondContact O-N 3.38Å
459G74.7Confident83.5Confident88 Ų8849.3 Ų49.391%0.90730%0.295SS*.THydrogen-bonded Turntrans70.37.5172.100000114.7T457T457-G459 PolarHBondContact O-N 3.15Å
460K80Confident82.9Confident75 Ų7552.5 Ų52.533%0.32631%0.31SS..  trans-97.1147.3177.5-61.8-166.4-170.61740111E456 T457 K458 V464 I465 E468E456-K460 WeakPolarHBondContact O-CD 3.44Å; E456-K460 WeakPolarHBondContact O-CE 3.46Å; E456-K460 PolarHBondContact O-NZ 2.91Å; T457-K460 PolarHBondContact O-N 3.13Å; K458-K460 PolarHBondContact O-N 3.38Å; K460-V464 HydrophobicContact CD-CG1 4.03Å; K460-I465 HydrophobicContact CB-CD1 4.15Å; K460-I465 HydrophobicContact CB-CG1 3.92Å; K460-I465 HydrophobicContact CD-CG1 4.47Å; K460-E468 VanDerWaalsContact NZ-CD 3.29Å; K460-E468 IonicContact NZ-OE1 3.6Å; K460-E468 PolarHBondContact NZ-OE1 3.09Å; K460-E468 IonicContact NZ-OE2 3.33Å; K460-E468 PolarHBondContact NZ-OE2 2.79Å
461S78.4Confident82.3Confident58 Ų5854 Ų5441%0.40633%0.326SS..  trans-73.7154169.665.10000110.7S463 V464 I465S461-S463 PolarHBondContact O-N 3.22Å; S461-S463 PolarHBondContact OG-OG 3.32Å; S461-V464 PolarHBondContact O-N 3.34Å; S461-V464 VanDerWaalsContact O-N 3.12Å; S461-V464 WeakPolarHBondContact OG-CG2 3.26Å; S461-V464 PolarHBondContact OG-N 2.85Å; S461-I465 PolarHBondContact O-N 3.39Å; S461-I465 VanDerWaalsContact O-N 3.17Å
462L74.1Confident81.8Confident61 Ų6155.2 Ų55.232%0.31933%0.327SS..Hα-helixtrans-56.2-34175.9-177.270.3000112.3E395 N398 I465 T466E395-L462 VanDerWaalsContact O-CD1 3.32Å; E395-L462 WeakPolarHBondContact O-CD1 3.39Å; N398-L462 HydrophobicContact CB-CD2 4.19Å; L462-I465 PolarHBondContact O-N 2.86Å; L462-T466 VanDerWaalsContact O-CB 3.31Å; L462-T466 WeakPolarHBondContact O-CB 3.25Å; L462-T466 PolarHBondContact O-N 2.7Å; L462-T466 PolarHBondContact O-OG1 3.21Å
463S70.8Confident81.5Confident85 Ų8549.6 Ų49.659%0.59430%0.297SS*.Hα-helixtrans-64.2-41.6177.954.70000112.7S461 T466 S467S461-S463 PolarHBondContact O-N 3.22Å; S461-S463 PolarHBondContact OG-OG 3.32Å; S463-T466 PolarHBondContact O-N 2.92Å; S463-S467 WeakPolarHBondContact O-CB 3.11Å; S463-S467 PolarHBondContact O-N 3.33Å
464V79.6Confident81Confident64 Ų6447.6 Ų47.639%0.38829%0.288SS..Hα-helixtrans-67.2-45.7177.4173.70000110.3K460 S461 T466 S467 E468K460-V464 HydrophobicContact CD-CG1 4.03Å; S461-V464 PolarHBondContact O-N 3.34Å; S461-V464 VanDerWaalsContact O-N 3.12Å; S461-V464 WeakPolarHBondContact OG-CG2 3.26Å; S461-V464 PolarHBondContact OG-N 2.85Å; V464-T466 VanDerWaalsContact C-N 3.33Å; V464-T466 PolarHBondContact O-N 3.08Å; V464-S467 WeakPolarHBondContact O-CB 3.43Å; V464-S467 PolarHBondContact O-N 2.91Å; V464-S467 VanDerWaalsContact O-N 3.16Å; V464-E468 PolarHBondContact O-N 3.35Å
465I80.9Confident80Confident3 Ų354.2 Ų54.22%0.01532%0.317CS..Hα-helixtrans-59.9-46.1177-63.6166.2000110.3E395 T457 K460 S461 L462 S467 E468 F469E395-I465 WeakPolarHBondContact O-CD1 3.37Å; T457-I465 HydrophobicContact CG2-CD1 4.05Å; K460-I465 HydrophobicContact CB-CD1 4.15Å; K460-I465 HydrophobicContact CB-CG1 3.92Å; K460-I465 HydrophobicContact CD-CG1 4.47Å; S461-I465 PolarHBondContact O-N 3.39Å; S461-I465 VanDerWaalsContact O-N 3.17Å; L462-I465 PolarHBondContact O-N 2.86Å; I465-S467 VanDerWaalsContact C-N 3.29Å; I465-S467 PolarHBondContact O-N 3.31Å; I465-E468 PolarHBondContact O-N 3.06Å; I465-F469 HydrophobicContact CG2-CD2 3.76Å; I465-F469 HydrophobicContact CG2-CE2 3.7Å; I465-F469 VanDerWaalsContact O-CD2 3.27Å; I465-F469 WeakPolarHBondContact O-CD2 3.2Å; I465-F469 PolarHBondContact O-N 3.44Å
466T80.3Confident78.6Confident51 Ų5155.5 Ų55.531%0.31333%0.333SS..Hα-helixtrans-61.2-38.7177.7-56.10000111.4L462 S463 V464 F469 H470L462-T466 VanDerWaalsContact O-CB 3.31Å; L462-T466 WeakPolarHBondContact O-CB 3.25Å; L462-T466 PolarHBondContact O-N 2.7Å; L462-T466 PolarHBondContact O-OG1 3.21Å; S463-T466 PolarHBondContact O-N 2.92Å; V464-T466 VanDerWaalsContact C-N 3.33Å; V464-T466 PolarHBondContact O-N 3.08Å; T466-F469 PolarHBondContact O-N 3.24Å; T466-H470 VanDerWaalsContact O-CB 3.25Å; T466-H470 WeakPolarHBondContact O-CB 3.41Å; T466-H470 PolarHBondContact O-N 3.38Å
467S79.3Confident77Confident82 Ų8258.5 Ų58.557%0.57335%0.347SS*.Hα-helixtrans-64.4-42.6175.7-174.90000112.7S463 V464 I465 F469 H470 G471S463-S467 WeakPolarHBondContact O-CB 3.11Å; S463-S467 PolarHBondContact O-N 3.33Å; V464-S467 WeakPolarHBondContact O-CB 3.43Å; V464-S467 PolarHBondContact O-N 2.91Å; V464-S467 VanDerWaalsContact O-N 3.16Å; I465-S467 VanDerWaalsContact C-N 3.29Å; I465-S467 PolarHBondContact O-N 3.31Å; S467-F469 PolarHBondContact O-N 3.46Å; S467-H470 WeakPolarHBondContact O-CB 3.23Å; S467-H470 PolarHBondContact O-N 2.79Å; S467-G471 PolarHBondContact O-N 3.14Å
468E84.6Confident75.6Confident74 Ų7463.3 Ų63.335%0.34637%0.372SS..Hα-helixtrans-61.3-44.5175.5-72.2179.6-167.300111.4P455 K460 V464 I465 G471 M472P455-E468 HydrophobicContact CB-CB 4.49Å; P455-E468 WeakPolarHBondContact CB-OE2 3.21Å; K460-E468 VanDerWaalsContact NZ-CD 3.29Å; K460-E468 IonicContact NZ-OE1 3.6Å; K460-E468 PolarHBondContact NZ-OE1 3.09Å; K460-E468 IonicContact NZ-OE2 3.33Å; K460-E468 PolarHBondContact NZ-OE2 2.79Å; V464-E468 PolarHBondContact O-N 3.35Å; I465-E468 PolarHBondContact O-N 3.06Å; E468-G471 PolarHBondContact O-N 3.06Å; E468-M472 PolarHBondContact O-N 2.8Å
469F84.9Confident74.2Confident0 Ų065.1 Ų65.10%038%0.382CS..Hα-helixtrans-65.8-37173.4-81-72.1000113W269 Q270 I396 P455 I465 T466 S467 G471 M472 N473W269-F469 HydrophobicContact CB-CD1 3.87Å; W269-F469 HydrophobicContact CB-CE1 4.42Å; Q270-F469 HydrophobicContact CB-CD1 4.45Å; Q270-F469 HydrophobicContact CG-CB 3.67Å; Q270-F469 HydrophobicContact CG-CD1 3.62Å; Q270-F469 HydrophobicContact CG-CD2 3.61Å; Q270-F469 HydrophobicContact CG-CE1 4.13Å; Q270-F469 HydrophobicContact CG-CE2 4.09Å; Q270-F469 HydrophobicContact CG-CG 3.35Å; Q270-F469 HydrophobicContact CG-CZ 4.33Å; I396-F469 HydrophobicContact CB-CE2 4.43Å; I396-F469 HydrophobicContact CD1-CE2 4.44Å; I396-F469 HydrophobicContact CD1-CZ 4.24Å; I396-F469 HydrophobicContact CG1-CE2 4.12Å; I396-F469 HydrophobicContact CG1-CZ 4.42Å; I396-F469 HydrophobicContact CG2-CD2 4.18Å; I396-F469 HydrophobicContact CG2-CE2 3.63Å; I396-F469 HydrophobicContact CG2-CZ 4Å; P455-F469 HydrophobicContact CG-CD2 4Å; P455-F469 HydrophobicContact CG-CE1 4.28Å; P455-F469 HydrophobicContact CG-CE2 3.33Å; P455-F469 HydrophobicContact CG-CZ 3.51Å; I465-F469 HydrophobicContact CG2-CD2 3.76Å; I465-F469 HydrophobicContact CG2-CE2 3.7Å; I465-F469 VanDerWaalsContact O-CD2 3.27Å; I465-F469 WeakPolarHBondContact O-CD2 3.2Å; I465-F469 PolarHBondContact O-N 3.44Å; T466-F469 PolarHBondContact O-N 3.24Å; S467-F469 PolarHBondContact O-N 3.46Å; F469-G471 VanDerWaalsContact C-N 3.32Å; F469-G471 PolarHBondContact O-N 3.08Å; F469-M472 HydrophobicContact CB-CE 4.47Å; F469-M472 HydrophobicContact CD1-CE 3.31Å; F469-M472 HydrophobicContact CE1-CE 3.65Å; F469-M472 HydrophobicContact CG-CE 4Å; F469-M472 WeakPolarHBondContact O-CB 3.39Å; F469-M472 PolarHBondContact O-N 3.08Å; F469-M472 VanDerWaalsContact O-N 3.1Å; F469-N473 PolarHBondContact O-N 3.12Å; F469-N473 PolarHBondContact O-ND2 2.7Å; F469-N473 VanDerWaalsContact O-ND2 3.13Å
470H81.9Confident73.2Confident93 Ų9367.6 Ų67.643%0.43137%0.368SS..Hα-helixtrans-61.4-42.2176.2-168.1-80.9000111.1T466 S467 M472 N473 F474T466-H470 VanDerWaalsContact O-CB 3.25Å; T466-H470 WeakPolarHBondContact O-CB 3.41Å; T466-H470 PolarHBondContact O-N 3.38Å; S467-H470 WeakPolarHBondContact O-CB 3.23Å; S467-H470 PolarHBondContact O-N 2.79Å; H470-M472 PolarHBondContact O-N 2.89Å; H470-N473 PolarHBondContact O-N 3.44Å; H470-N473 VanDerWaalsContact O-N 3.15Å; H470-F474 AromaticContact CD2-CD2 3.74Å; H470-F474 AromaticContact CD2-CE2 3.55Å; H470-F474 AromaticContact CE1-CD2 3.26Å; H470-F474 WeakPolarHBondContact CE1-CD2 3.38Å; H470-F474 AromaticContact CE1-CE2 3.61Å; H470-F474 AromaticContact CG-CD2 3.8Å; H470-F474 AromaticContact ND1-CD2 3.52Å; H470-F474 AromaticContact NE2-CD2 3.41Å; H470-F474 WeakPolarHBondContact NE2-CD2 3.31Å; H470-F474 AromaticContact NE2-CE2 3.22Å; H470-F474 WeakPolarHBondContact NE2-CE2 3.17Å; H470-F474 WeakPolarHBondContact O-CD2 3.38Å; H470-F474 PolarHBondContact O-N 2.86Å; H470-F474 VanDerWaalsContact O-N 3.08Å
471G79.9Confident71.9Confident33 Ų3366.6 Ų66.634%0.3437%0.37SS..Hα-helixtrans-55.8-38.8172.300000112.8S467 E468 F469 K475S467-G471 PolarHBondContact O-N 3.14Å; E468-G471 PolarHBondContact O-N 3.06Å; F469-G471 VanDerWaalsContact C-N 3.32Å; F469-G471 PolarHBondContact O-N 3.08Å; G471-K475 WeakPolarHBondContact O-CA 3.37Å; G471-K475 WeakPolarHBondContact O-CB 3.4Å; G471-K475 PolarHBondContact O-N 3.43Å; G471-K475 VanDerWaalsContact O-N 3.09Å
472M81.8Confident70.8Confident46 Ų4669 Ų6923%0.22738%0.378CS..Hα-helixtrans-73.1-38175.3-63.9-170.4-75.800113.2W269 E468 F469 H470 F474W269-M472 HydrophobicContact CB-CB 4.41Å; W269-M472 HydrophobicContact CD2-CB 4.43Å; W269-M472 HydrophobicContact CG-CB 3.92Å; W269-M472 PolarHBondContact NE1-O 3.35Å; E468-M472 PolarHBondContact O-N 2.8Å; F469-M472 HydrophobicContact CB-CE 4.47Å; F469-M472 HydrophobicContact CD1-CE 3.31Å; F469-M472 HydrophobicContact CE1-CE 3.65Å; F469-M472 HydrophobicContact CG-CE 4Å; F469-M472 WeakPolarHBondContact O-CB 3.39Å; F469-M472 PolarHBondContact O-N 3.08Å; F469-M472 VanDerWaalsContact O-N 3.1Å; H470-M472 PolarHBondContact O-N 2.89Å; M472-F474 VanDerWaalsContact C-N 3.27Å; M472-F474 PolarHBondContact O-N 3.47Å
473N81.8Confident70Confident10 Ų1072 Ų725%0.05339%0.39CS..Hα-helixtrans-67-28.8-179.5-72.9-41000112.8R265 S266 W269 F469 H470R265-N473 VanDerWaalsContact O-CG 3.28Å; R265-N473 PolarHBondContact O-OD1 2.79Å; S266-N473 VanDerWaalsContact C-ND2 3.28Å; S266-N473 PolarHBondContact O-ND2 2.79Å; W269-N473 WeakPolarHBondContact CB-OD1 3.49Å; W269-N473 PolarHBondContact N-OD1 2.91Å; F469-N473 PolarHBondContact O-N 3.12Å; F469-N473 PolarHBondContact O-ND2 2.7Å; F469-N473 VanDerWaalsContact O-ND2 3.13Å; H470-N473 PolarHBondContact O-N 3.44Å; H470-N473 VanDerWaalsContact O-N 3.15Å
474F79.7Confident69.3Low32 Ų3273.5 Ų73.514%0.1439%0.391CS..THydrogen-bonded Turntrans-121.315.9-173.1-61.8-74.6000114.2R265 H470 M472 G476 Q477 N478R265-F474 HydrophobicContact CG-CE1 4.25Å; R265-F474 HydrophobicContact CG-CZ 4.4Å; H470-F474 AromaticContact CD2-CD2 3.74Å; H470-F474 AromaticContact CD2-CE2 3.55Å; H470-F474 AromaticContact CE1-CD2 3.26Å; H470-F474 WeakPolarHBondContact CE1-CD2 3.38Å; H470-F474 AromaticContact CE1-CE2 3.61Å; H470-F474 AromaticContact CG-CD2 3.8Å; H470-F474 AromaticContact ND1-CD2 3.52Å; H470-F474 AromaticContact NE2-CD2 3.41Å; H470-F474 WeakPolarHBondContact NE2-CD2 3.31Å; H470-F474 AromaticContact NE2-CE2 3.22Å; H470-F474 WeakPolarHBondContact NE2-CE2 3.17Å; H470-F474 WeakPolarHBondContact O-CD2 3.38Å; H470-F474 PolarHBondContact O-N 2.86Å; H470-F474 VanDerWaalsContact O-N 3.08Å; M472-F474 VanDerWaalsContact C-N 3.27Å; M472-F474 PolarHBondContact O-N 3.47Å; F474-G476 PolarHBondContact O-N 3.27Å; F474-G476 VanDerWaalsContact O-N 3.13Å; F474-Q477 HydrophobicContact CB-CB 4.47Å; F474-Q477 PolarHBondContact O-N 3.21Å; F474-N478 PolarHBondContact O-N 3.32Å; F474-N478 VanDerWaalsContact O-N 3.13Å
475K66.6Low68.1Low142 Ų14276.6 Ų76.662%0.61740%0.401SS*.Hα-helixtrans-48.8-43.5-179.7-142.7177.4-178.6-175.30112.9G471 Q477 N478 E479G471-K475 WeakPolarHBondContact O-CA 3.37Å; G471-K475 WeakPolarHBondContact O-CB 3.4Å; G471-K475 PolarHBondContact O-N 3.43Å; G471-K475 VanDerWaalsContact O-N 3.09Å; K475-Q477 PolarHBondContact O-N 3.39Å; K475-N478 PolarHBondContact O-N 2.86Å; K475-E479 PolarHBondContact O-N 2.85Å; K475-E479 VanDerWaalsContact O-N 3.16Å
476G57.3Low67Low39 Ų3979.8 Ų79.840%0.40242%0.421SS..Hα-helixtrans-79-9177.100000116.6F474 K480F474-G476 PolarHBondContact O-N 3.27Å; F474-G476 VanDerWaalsContact O-N 3.13Å; G476-K480 WeakPolarHBondContact O-CG 3.46Å
477Q55.8Low65.8Low106 Ų10684 Ų8450%0.49544%0.437SS..Hα-helixtrans-88.4-34.7169.6-98.2-178.4-16.800111.3F474 K475 S481F474-Q477 HydrophobicContact CB-CB 4.47Å; F474-Q477 PolarHBondContact O-N 3.21Å; K475-Q477 PolarHBondContact O-N 3.39Å; Q477-S481 WeakPolarHBondContact O-CB 3.39Å; Q477-S481 PolarHBondContact O-N 3.28Å; Q477-S481 PolarHBondContact O-OG 3.09Å; Q477-S481 VanDerWaalsContact O-OG 3.06Å
478N52.8Low64.9Low108 Ų10888 Ų8858%0.57844%0.441SS*.Hα-helixtrans-68.2-37.9172.4-82.8-4.2000112.1F474 K475 S481 L482F474-N478 PolarHBondContact O-N 3.32Å; F474-N478 VanDerWaalsContact O-N 3.13Å; K475-N478 PolarHBondContact O-N 2.86Å; N478-S481 WeakPolarHBondContact CA-OG 3.14Å; N478-S481 PolarHBondContact O-OG 2.87Å; N478-S481 VanDerWaalsContact O-OG 3.05Å; N478-L482 VanDerWaalsContact O-CB 3.23Å; N478-L482 WeakPolarHBondContact O-CB 3.45Å; N478-L482 PolarHBondContact O-N 3.16Å
479E53.7Low63.7Low118 Ų11891.3 Ų91.355%0.55145%0.454SS*.Hα-helixtrans-65.7-45.2173-76.8170.6174.400111.4K475 S481 L482 E483K475-E479 PolarHBondContact O-N 2.85Å; K475-E479 VanDerWaalsContact O-N 3.16Å; E479-S481 PolarHBondContact O-N 2.95Å; E479-L482 PolarHBondContact O-N 3.25Å; E479-E483 WeakPolarHBondContact O-CB 3.43Å; E479-E483 WeakPolarHBondContact O-CG 3.45Å; E479-E483 PolarHBondContact O-N 2.9Å
480K52.8Low62.3Low140 Ų14096.6 Ų96.661%0.60948%0.481SS*.Hα-helixtrans-64.8-38.2176.3-82.5-177174.9-174.90113.9G476 L484G476-K480 WeakPolarHBondContact O-CG 3.46Å; K480-L484 WeakPolarHBondContact O-CB 3.42Å; K480-L484 WeakPolarHBondContact O-CD1 3.31Å; K480-L484 WeakPolarHBondContact O-CG 3.34Å; K480-L484 PolarHBondContact O-N 3Å
481S53.4Low61.2Low53 Ų5393.9 Ų93.937%0.37148%0.479SS..Hα-helixtrans-70.6-3617762.30000111.7Q477 N478 E479 Q485Q477-S481 WeakPolarHBondContact O-CB 3.39Å; Q477-S481 PolarHBondContact O-N 3.28Å; Q477-S481 PolarHBondContact O-OG 3.09Å; Q477-S481 VanDerWaalsContact O-OG 3.06Å; N478-S481 WeakPolarHBondContact CA-OG 3.14Å; N478-S481 PolarHBondContact O-OG 2.87Å; N478-S481 VanDerWaalsContact O-OG 3.05Å; E479-S481 PolarHBondContact O-N 2.95Å; S481-Q485 WeakPolarHBondContact O-CB 3.18Å; S481-Q485 PolarHBondContact O-N 2.72Å
482L55.7Low60Low109 Ų10997.8 Ų97.857%0.57149%0.488SS*.Hα-helixtrans-67.6-43.1173-156.983000111.2N478 E479 Q485 T486N478-L482 VanDerWaalsContact O-CB 3.23Å; N478-L482 WeakPolarHBondContact O-CB 3.45Å; N478-L482 PolarHBondContact O-N 3.16Å; E479-L482 PolarHBondContact O-N 3.25Å; L482-Q485 PolarHBondContact O-N 3.36Å; L482-T486 WeakPolarHBondContact O-CB 3.34Å; L482-T486 PolarHBondContact O-N 3.38Å; L482-T486 PolarHBondContact O-OG1 2.91Å
483E55.4Low58.8Low125 Ų125100 Ų10058%0.58450%0.504SS*.Hα-helixtrans-60.7-44.4173.6-78.5176.8169.700111.8E479 T486 Q487E479-E483 WeakPolarHBondContact O-CB 3.43Å; E479-E483 WeakPolarHBondContact O-CG 3.45Å; E479-E483 PolarHBondContact O-N 2.9Å; E483-T486 PolarHBondContact O-N 3.23Å; E483-Q487 WeakPolarHBondContact O-CB 3.14Å; E483-Q487 WeakPolarHBondContact O-CG 3.35Å; E483-Q487 PolarHBondContact O-N 2.79Å
484L57.3Low57.4Low115 Ų115103.4 Ų103.460%0.60253%0.528SS*.Hα-helixtrans-62.9-42.3175.1-88.6155.7000112.4K480 T486 Q487 Y488K480-L484 WeakPolarHBondContact O-CB 3.42Å; K480-L484 WeakPolarHBondContact O-CD1 3.31Å; K480-L484 WeakPolarHBondContact O-CG 3.34Å; K480-L484 PolarHBondContact O-N 3Å; L484-T486 VanDerWaalsContact C-N 3.33Å; L484-Q487 PolarHBondContact O-N 2.72Å; L484-Y488 WeakPolarHBondContact O-CB 3.37Å; L484-Y488 PolarHBondContact O-N 2.97Å
485Q54.6Low56.1Low129 Ų129108.2 Ų108.260%0.60355%0.554SS**Hα-helixtrans-66.7-35.1174-88.3-175.3-34.900112.6S481 L482 Y488 K489S481-Q485 WeakPolarHBondContact O-CB 3.18Å; S481-Q485 PolarHBondContact O-N 2.72Å; L482-Q485 PolarHBondContact O-N 3.36Å; Q485-Y488 PolarHBondContact O-N 3.11Å; Q485-K489 WeakPolarHBondContact O-CB 3.44Å; Q485-K489 WeakPolarHBondContact O-CG 3.33Å; Q485-K489 PolarHBondContact O-N 3.38Å
486T58Low55.4Low70 Ų70105.7 Ų105.743%0.42956%0.555SS.*Hα-helixtrans-71.7-39.7178.2-49.10000110.6L482 E483 L484 K489 L490L482-T486 WeakPolarHBondContact O-CB 3.34Å; L482-T486 PolarHBondContact O-N 3.38Å; L482-T486 PolarHBondContact O-OG1 2.91Å; E483-T486 PolarHBondContact O-N 3.23Å; L484-T486 VanDerWaalsContact C-N 3.33Å; T486-K489 PolarHBondContact O-N 3.06Å; T486-L490 HydrophobicContact CG2-CD1 4.05Å; T486-L490 WeakPolarHBondContact O-CB 3.46Å; T486-L490 WeakPolarHBondContact O-CD1 3.32Å; T486-L490 PolarHBondContact O-N 2.88Å
487Q55.6Low55.2Low139 Ų139109 Ų10965%0.6557%0.567SS**Hα-helixtrans-64.1-39.9170.9-79.8-172-27.200112.4E483 L484 L490 G491E483-Q487 WeakPolarHBondContact O-CB 3.14Å; E483-Q487 WeakPolarHBondContact O-CG 3.35Å; E483-Q487 PolarHBondContact O-N 2.79Å; L484-Q487 PolarHBondContact O-N 2.72Å; Q487-L490 PolarHBondContact O-N 3.32Å; Q487-G491 PolarHBondContact O-N 3.18Å
488Y59.1Low55Low168 Ų168108.1 Ų108.166%0.65958%0.578SS**Hα-helixtrans-63.9-45.4176.4-159-91.1000111.5L484 Q485 G491 E492L484-Y488 WeakPolarHBondContact O-CB 3.37Å; L484-Y488 PolarHBondContact O-N 2.97Å; Q485-Y488 PolarHBondContact O-N 3.11Å; Y488-G491 PolarHBondContact O-N 3.16Å; Y488-E492 HydrophobicContact CD1-CG 4.44Å; Y488-E492 HydrophobicContact CE1-CG 4.34Å; Y488-E492 PolarHBondContact O-N 2.98Å
489K59Low54.5Low142 Ų142113 Ų11362%0.61760%0.603SS**Hα-helixtrans-65.4-39.6175.1-78.2-176.9175.7-177.90113.1Q485 T486 G491 E492 V493Q485-K489 WeakPolarHBondContact O-CB 3.44Å; Q485-K489 WeakPolarHBondContact O-CG 3.33Å; Q485-K489 PolarHBondContact O-N 3.38Å; T486-K489 PolarHBondContact O-N 3.06Å; K489-G491 VanDerWaalsContact C-N 3.3Å; K489-E492 PolarHBondContact O-N 3.4Å; K489-V493 VanDerWaalsContact O-CG2 3.27Å; K489-V493 WeakPolarHBondContact O-CG2 3.5Å; K489-V493 PolarHBondContact O-N 3.49Å
490L56.8Low54.5Low111 Ų111112.7 Ų112.758%0.58161%0.605SS**Hα-helixtrans-63.6-38.4172.9-107.1102.7000111.5T486 Q487 V493 C494T486-L490 HydrophobicContact CG2-CD1 4.05Å; T486-L490 WeakPolarHBondContact O-CB 3.46Å; T486-L490 WeakPolarHBondContact O-CD1 3.32Å; T486-L490 PolarHBondContact O-N 2.88Å; Q487-L490 PolarHBondContact O-N 3.32Å; L490-V493 PolarHBondContact O-N 3.3Å; L490-C494 WeakPolarHBondContact O-CB 3.41Å; L490-C494 PolarHBondContact O-N 3.04Å
491G57.7Low54.6Low37 Ų37111.3 Ų111.338%0.38161%0.605SS.*Hα-helixtrans-61.1-45.9174.500000112.7Q487 Y488 K489 C494 L495Q487-G491 PolarHBondContact O-N 3.18Å; Y488-G491 PolarHBondContact O-N 3.16Å; K489-G491 VanDerWaalsContact C-N 3.3Å; G491-C494 PolarHBondContact O-N 3.44Å; G491-L495 PolarHBondContact O-N 3.44Å
492E56.2Low54.6Low114 Ų114114.5 Ų114.553%0.53362%0.618SS.*Hα-helixtrans-64.4-40.4175.7-77.3-177.8155.300112.8Y488 K489 L495 S496Y488-E492 HydrophobicContact CD1-CG 4.44Å; Y488-E492 HydrophobicContact CE1-CG 4.34Å; Y488-E492 PolarHBondContact O-N 2.98Å; K489-E492 PolarHBondContact O-N 3.4Å; E492-L495 PolarHBondContact O-N 3.41Å; E492-S496 WeakPolarHBondContact O-CB 3.27Å; E492-S496 PolarHBondContact O-N 3.16Å
493V56.4Low54.6Low93 Ų93114.8 Ų114.856%0.56462%0.621SS**Hα-helixtrans-66.8-43.4177.8173.10000111.2K489 L490 L495 S496 T497K489-V493 VanDerWaalsContact O-CG2 3.27Å; K489-V493 WeakPolarHBondContact O-CG2 3.5Å; K489-V493 PolarHBondContact O-N 3.49Å; L490-V493 PolarHBondContact O-N 3.3Å; V493-L495 VanDerWaalsContact C-N 3.32Å; V493-L495 PolarHBondContact O-N 3.31Å; V493-S496 PolarHBondContact O-N 3Å; V493-T497 PolarHBondContact O-N 3.34Å; V493-T497 VanDerWaalsContact O-N 3.15Å; V493-T497 PolarHBondContact O-OG1 3.38Å; V493-T497 VanDerWaalsContact O-OG1 3.11Å
494C52.6Low54.5Low82 Ų82114.2 Ų114.255%0.55462%0.623SS**Hα-helixtrans-63-37.1174.9-83.30000112.6L490 G491 S496 T497 A498L490-C494 WeakPolarHBondContact O-CB 3.41Å; L490-C494 PolarHBondContact O-N 3.04Å; G491-C494 PolarHBondContact O-N 3.44Å; C494-S496 VanDerWaalsContact C-N 3.34Å; C494-T497 PolarHBondContact O-OG1 3.4Å; C494-T497 VanDerWaalsContact O-OG1 3.13Å; C494-A498 PolarHBondContact O-N 3.43Å
495L51.1Low54.3Low132 Ų132114.1 Ų114.169%0.69163%0.625SS**Hα-helixtrans-67.4-35.8175.6-133.996.4000111.9G491 E492 V493 A498G491-L495 PolarHBondContact O-N 3.44Å; E492-L495 PolarHBondContact O-N 3.41Å; V493-L495 VanDerWaalsContact C-N 3.32Å; V493-L495 PolarHBondContact O-N 3.31Å; L495-A498 PolarHBondContact O-N 2.72Å
496S52.1Low54.3Low89 Ų89113.1 Ų113.162%0.62263%0.626SS**Hα-helixtrans-75.1-21179.7-171.90000114.2E492 V493 C494E492-S496 WeakPolarHBondContact O-CB 3.27Å; E492-S496 PolarHBondContact O-N 3.16Å; V493-S496 PolarHBondContact O-N 3Å; C494-S496 VanDerWaalsContact C-N 3.34Å
497T53.8Low54Low109 Ų109116.4 Ų116.467%0.66964%0.641SS**THydrogen-bonded Turntrans-92.7-7.2174.8450000113.9V493 C494V493-T497 PolarHBondContact O-N 3.34Å; V493-T497 VanDerWaalsContact O-N 3.15Å; V493-T497 PolarHBondContact O-OG1 3.38Å; V493-T497 VanDerWaalsContact O-OG1 3.11Å; C494-T497 PolarHBondContact O-OG1 3.4Å; C494-T497 VanDerWaalsContact O-OG1 3.13Å
498A50.7Low53.9Low87 Ų87114.5 Ų114.572%0.71964%0.641SS**  trans-99.20.6179.400000113.7C494 L495C494-A498 PolarHBondContact O-N 3.43Å; L495-A498 PolarHBondContact O-N 2.72Å
499L41.6Very low53.4Low210 Ų210109.6 Ų109.6100%1.09964%0.639SS**  trans-101.10165.9-84159.9000108.8

Retrieved 499 of 499 residues in 547.1 ms (Link to these results)

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