A0A087XXR8_POEFO Loading...

Calcium homeostasis modulator 3

AlphaFold DB , UniProt , Accession A0A087XXR8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 330 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
1L53.6Low58.1Low191 Ų191134.9 Ų134.9100%164%0.639SS**  0-51.90-155.778.1000111.9E3 R4 L5L1-E3 PolarHBondContact O-N 3.02Å; L1-R4 PolarHBondContact O-N 3.26Å; L1-L5 PolarHBondContact O-N 3.07Å
2M55.5Low57.2Low160 Ų160130.1 Ų130.179%0.78861%0.614SS**Hα-helixtrans-57.2-42.8177.8-86.8-164.6-74.800114.9R4 L5 K6M2-R4 VanDerWaalsContact C-N 3.33Å; M2-R4 PolarHBondContact O-N 3.42Å; M2-L5 PolarHBondContact O-N 2.91Å; M2-K6 WeakPolarHBondContact O-CB 3.49Å; M2-K6 PolarHBondContact O-N 3.03Å
3E61.1Low56.4Low138 Ų138130.8 Ų130.865%0.64562%0.617SS**Hα-helixtrans-61.6-39.3176.6-70.8-81.7124.300112.7L1 K6 L7L1-E3 PolarHBondContact O-N 3.02Å; E3-K6 PolarHBondContact O-N 3.18Å; E3-L7 PolarHBondContact O-N 3.23Å
4R59.8Low55.6Low198 Ų198127.6 Ų127.675%0.74762%0.616SS**Hα-helixtrans-71.9-37.8177.9-63.4-103.7-179.4166.8-0.7110.9L1 M2 L7 V8L1-R4 PolarHBondContact O-N 3.26Å; M2-R4 VanDerWaalsContact C-N 3.33Å; M2-R4 PolarHBondContact O-N 3.42Å; R4-L7 PolarHBondContact O-N 2.84Å; R4-V8 WeakPolarHBondContact O-CB 3.48Å; R4-V8 VanDerWaalsContact O-CG2 3.26Å; R4-V8 WeakPolarHBondContact O-CG2 3.48Å; R4-V8 PolarHBondContact O-N 2.91Å
5L63.6Low55.6Low106 Ų106124 Ų12456%0.55560%0.601SS**Hα-helixtrans-66.6-39.5173.3-155.190000111.2L1 M2 V8 L9L1-L5 PolarHBondContact O-N 3.07Å; M2-L5 PolarHBondContact O-N 2.91Å; L5-V8 PolarHBondContact O-N 3.34Å; L5-L9 HydrophobicContact CD2-CD1 4.06Å; L5-L9 HydrophobicContact CG-CD1 4.2Å; L5-L9 VanDerWaalsContact O-CB 3.25Å; L5-L9 WeakPolarHBondContact O-CB 3.45Å; L5-L9 WeakPolarHBondContact O-CD1 3.43Å; L5-L9 VanDerWaalsContact O-CG 3.27Å; L5-L9 WeakPolarHBondContact O-CG 3.43Å; L5-L9 PolarHBondContact O-N 2.69Å
6K62Low55.7Low135 Ų135118.3 Ų118.359%0.58758%0.578SS**Hα-helixtrans-61.5-46.9172.9-89.8-174.6175.5-179.60111.7M2 E3 V8 L9 Q10M2-K6 WeakPolarHBondContact O-CB 3.49Å; M2-K6 PolarHBondContact O-N 3.03Å; E3-K6 PolarHBondContact O-N 3.18Å; K6-V8 VanDerWaalsContact C-N 3.33Å; K6-V8 PolarHBondContact O-N 2.9Å; K6-L9 PolarHBondContact O-N 3.06Å; K6-Q10 WeakPolarHBondContact O-CB 3.26Å; K6-Q10 PolarHBondContact O-N 3.35Å
7L63.3Low56Low110 Ų110113.3 Ų113.358%0.57655%0.553SS**Hα-helixtrans-62.2-39.9176.4-83.7163.1000112.4E3 R4 Q10 Y11E3-L7 PolarHBondContact O-N 3.23Å; R4-L7 PolarHBondContact O-N 2.84Å; L7-Q10 PolarHBondContact O-N 3.21Å; L7-Y11 WeakPolarHBondContact O-CB 3.2Å; L7-Y11 PolarHBondContact O-N 3.37Å
8V57.5Low56.2Low75 Ų75108.3 Ų108.346%0.45553%0.532SS..Hα-helixtrans-67.4-44.9175170.20000110.9R4 L5 K6 Q10 Y11 F12R4-V8 WeakPolarHBondContact O-CB 3.48Å; R4-V8 VanDerWaalsContact O-CG2 3.26Å; R4-V8 WeakPolarHBondContact O-CG2 3.48Å; R4-V8 PolarHBondContact O-N 2.91Å; L5-V8 PolarHBondContact O-N 3.34Å; K6-V8 VanDerWaalsContact C-N 3.33Å; K6-V8 PolarHBondContact O-N 2.9Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; V8-Q10 PolarHBondContact O-N 3.32Å; V8-Y11 PolarHBondContact O-N 3.29Å; V8-F12 HydrophobicContact CG1-CD2 3.63Å; V8-F12 HydrophobicContact CG1-CE2 3.43Å; V8-F12 VanDerWaalsContact CG1-CE2 3.43Å; V8-F12 WeakPolarHBondContact O-CD2 3.46Å; V8-F12 PolarHBondContact O-N 2.92Å
9L56.8Low56.7Low99 Ų99106 Ų10652%0.51852%0.521SS..Hα-helixtrans-61.8-40.9175-80163.3000111.7L5 K6 F12 Q13L5-L9 HydrophobicContact CD2-CD1 4.06Å; L5-L9 HydrophobicContact CG-CD1 4.2Å; L5-L9 VanDerWaalsContact O-CB 3.25Å; L5-L9 WeakPolarHBondContact O-CB 3.45Å; L5-L9 WeakPolarHBondContact O-CD1 3.43Å; L5-L9 VanDerWaalsContact O-CG 3.27Å; L5-L9 WeakPolarHBondContact O-CG 3.43Å; L5-L9 PolarHBondContact O-N 2.69Å; K6-L9 PolarHBondContact O-N 3.06Å; L9-F12 CarbonylContact O-C 3.58Å; L9-F12 WeakPolarHBondContact O-CB 3.4Å; L9-F12 PolarHBondContact O-N 2.96Å; L9-Q13 WeakPolarHBondContact O-CB 3.38Å; L9-Q13 PolarHBondContact O-N 3.37Å
10Q55.3Low57.3Low123 Ų123101 Ų10158%0.57550%0.497SS*.Hα-helixtrans-71.7-32.6179-163.7170.19.200111.6K6 L7 V8 Q13 S14K6-Q10 WeakPolarHBondContact O-CB 3.26Å; K6-Q10 PolarHBondContact O-N 3.35Å; L7-Q10 PolarHBondContact O-N 3.21Å; V8-Q10 VanDerWaalsContact C-N 3.34Å; V8-Q10 PolarHBondContact O-N 3.32Å; Q10-Q13 PolarHBondContact O-N 2.92Å; Q10-S14 WeakPolarHBondContact O-CB 3.47Å; Q10-S14 PolarHBondContact O-N 3.06Å; Q10-S14 PolarHBondContact O-OG 2.91Å
11Y50.3Low58Low149 Ų14999.4 Ų99.458%0.58449%0.49SS*.Hα-helixtrans-70.4-38169.8-180-95.5000112.6L7 V8 Q13 S14L7-Y11 WeakPolarHBondContact O-CB 3.2Å; L7-Y11 PolarHBondContact O-N 3.37Å; V8-Y11 PolarHBondContact O-N 3.29Å; Y11-Q13 VanDerWaalsContact C-N 3.35Å; Y11-S14 PolarHBondContact O-OG 3.31Å
12F47.8Very low59.2Low77 Ų7791.1 Ų91.134%0.33845%0.451SS..Hα-helixtrans-62.1-47.1167.7-81.7-67.1000109.4V8 L9 S14 N15 S18 I19V8-F12 HydrophobicContact CG1-CD2 3.63Å; V8-F12 HydrophobicContact CG1-CE2 3.43Å; V8-F12 VanDerWaalsContact CG1-CE2 3.43Å; V8-F12 WeakPolarHBondContact O-CD2 3.46Å; V8-F12 PolarHBondContact O-N 2.92Å; L9-F12 CarbonylContact O-C 3.58Å; L9-F12 WeakPolarHBondContact O-CB 3.4Å; L9-F12 PolarHBondContact O-N 2.96Å; F12-S14 VanDerWaalsContact C-N 3.31Å; F12-S14 PolarHBondContact O-N 3.2Å; F12-N15 PolarHBondContact O-N 3.38Å; F12-N15 VanDerWaalsContact O-O 3.08Å; F12-S18 WeakPolarHBondContact CD1-O 3.5Å; F12-S18 WeakPolarHBondContact CD1-OG 3.19Å; F12-S18 VanDerWaalsContact CE1-OG 3.26Å; F12-S18 WeakPolarHBondContact CE1-OG 3.43Å; F12-I19 WeakPolarHBondContact O-CG1 3.37Å
13Q47.3Very low60.5Low139 Ų13986.9 Ų86.965%0.6543%0.431SS*.Hα-helixtrans-65.2-28.1-176.1-156.4170.64.700113.9L9 Q10 Y11L9-Q13 WeakPolarHBondContact O-CB 3.38Å; L9-Q13 PolarHBondContact O-N 3.37Å; Q10-Q13 PolarHBondContact O-N 2.92Å; Y11-Q13 VanDerWaalsContact C-N 3.35Å
14S44.6Very low61.5Low86 Ų8680.9 Ų80.960%0.60140%0.404SS*.Hα-helixtrans-79.8-16.7179.169.10000114Q10 Y11 F12Q10-S14 WeakPolarHBondContact O-CB 3.47Å; Q10-S14 PolarHBondContact O-N 3.06Å; Q10-S14 PolarHBondContact O-OG 2.91Å; Y11-S14 PolarHBondContact O-OG 3.31Å; F12-S14 VanDerWaalsContact C-N 3.31Å; F12-S14 PolarHBondContact O-N 3.2Å
15N55.9Low62.8Low74 Ų7476 Ų7640%0.39639%0.392SS..  trans-126.899.3-175-149-9.8000109.6F12 E17 S18 I19F12-N15 PolarHBondContact O-N 3.38Å; F12-N15 VanDerWaalsContact O-O 3.08Å; N15-E17 PolarHBondContact O-N 3.06Å; N15-S18 WeakPolarHBondContact O-CA 3.26Å; N15-S18 WeakPolarHBondContact O-CB 3.49Å; N15-S18 PolarHBondContact O-N 2.98Å; N15-I19 PolarHBondContact O-N 2.95Å
16S56.3Low64.1Low33 Ų3374.9 Ų74.923%0.23139%0.39CS..Hα-helixtrans-55.5-34.6-174.650.10000113.3S18 S20 D223S16-S18 VanDerWaalsContact C-N 3.31Å; S16-S18 PolarHBondContact O-N 3.4Å; S16-S20 PolarHBondContact O-N 3.47Å; S16-D223 VanDerWaalsContact CB-OD2 3.27Å; S16-D223 WeakPolarHBondContact CB-OD2 3.49Å; S16-D223 PolarHBondContact OG-OD2 3.4Å
17E61.1Low65.4Low33 Ų3370 Ų7015%0.15437%0.37CS..Hα-helixtrans-63.2-35.9172.1-65.2-158.112800112.2N15 N21 R106 R216N15-E17 PolarHBondContact O-N 3.06Å; E17-N21 WeakPolarHBondContact O-CB 3.48Å; E17-N21 PolarHBondContact O-N 3.26Å; E17-N21 VanDerWaalsContact O-N 3.14Å; E17-N21 PolarHBondContact O-ND2 3.49Å; E17-R106 IonicContact OE1-NH2 3.87Å; E17-R216 IonicContact OE2-NH2 2.79Å
18S60.5Low66.8Low24 Ų2465.3 Ų65.317%0.16835%0.347CS..Hα-helixtrans-72.5-39.4-179.4-161.60000112.2F12 N15 S16 N21 G22F12-S18 WeakPolarHBondContact CD1-O 3.5Å; F12-S18 WeakPolarHBondContact CD1-OG 3.19Å; F12-S18 VanDerWaalsContact CE1-OG 3.26Å; F12-S18 WeakPolarHBondContact CE1-OG 3.43Å; N15-S18 WeakPolarHBondContact O-CA 3.26Å; N15-S18 WeakPolarHBondContact O-CB 3.49Å; N15-S18 PolarHBondContact O-N 2.98Å; S16-S18 VanDerWaalsContact C-N 3.31Å; S16-S18 PolarHBondContact O-N 3.4Å; S18-N21 PolarHBondContact O-N 3.41Å; S18-G22 PolarHBondContact O-N 3.04Å
19I65.8Low68.4Low64 Ų6467 Ų6733%0.32835%0.352SS..Hα-helixtrans-62.3-50.3175.3-51.9178.9000110.7F12 N15 N21 G22 I23F12-I19 WeakPolarHBondContact O-CG1 3.37Å; N15-I19 PolarHBondContact O-N 2.95Å; I19-N21 VanDerWaalsContact C-N 3.31Å; I19-N21 PolarHBondContact O-N 3.4Å; I19-G22 PolarHBondContact O-N 3.44Å; I19-G22 VanDerWaalsContact O-N 3.1Å; I19-I23 HydrophobicContact CG2-CD1 3.83Å; I19-I23 HydrophobicContact CG2-CG1 4.34Å; I19-I23 WeakPolarHBondContact O-CG1 3.4Å; I19-I23 PolarHBondContact O-N 3.1Å
20S67.3Low70.1Confident5 Ų565.2 Ų65.24%0.03535%0.345CS..Hα-helixtrans-60-42.4-179.6171.40000111.4S16 I23 C24 N72 R106S16-S20 PolarHBondContact O-N 3.47Å; S20-I23 PolarHBondContact O-N 3.19Å; S20-C24 PolarHBondContact O-N 3.06Å; S20-C24 PolarHBondContact O-SG 2.83Å; S20-N72 PolarHBondContact OG-OD1 3.31Å; S20-R106 PolarHBondContact OG-NH1 2.97Å
21N72.1Confident71.9Confident68 Ų6859.3 Ų59.336%0.36432%0.318SS..Hα-helixtrans-63.9-41.7174-70.3-23.3000112E17 S18 I19 C24 I25 R106E17-N21 WeakPolarHBondContact O-CB 3.48Å; E17-N21 PolarHBondContact O-N 3.26Å; E17-N21 VanDerWaalsContact O-N 3.14Å; E17-N21 PolarHBondContact O-ND2 3.49Å; S18-N21 PolarHBondContact O-N 3.41Å; I19-N21 VanDerWaalsContact C-N 3.31Å; I19-N21 PolarHBondContact O-N 3.4Å; N21-C24 PolarHBondContact O-N 3.37Å; N21-I25 WeakPolarHBondContact O-CG1 3.26Å; N21-I25 PolarHBondContact O-N 2.92Å; N21-I25 VanDerWaalsContact O-N 3.16Å; N21-R106 WeakPolarHBondContact OD1-CD 3.26Å; N21-R106 PolarHBondContact OD1-NE 3.16Å
22G80Confident74Confident18 Ų1854.5 Ų54.519%0.18630%0.304CS..Hα-helixtrans-60.2-46.1176.400000112.7S18 I19 C24 I25 V26S18-G22 PolarHBondContact O-N 3.04Å; I19-G22 PolarHBondContact O-N 3.44Å; I19-G22 VanDerWaalsContact O-N 3.1Å; G22-C24 VanDerWaalsContact C-N 3.35Å; G22-C24 PolarHBondContact O-N 3.33Å; G22-I25 WeakPolarHBondContact O-CB 3.47Å; G22-I25 PolarHBondContact O-N 3.38Å; G22-V26 WeakPolarHBondContact O-CG2 3.3Å; G22-V26 PolarHBondContact O-N 3.13Å
23I82.1Confident76.1Confident70 Ų7057.8 Ų57.836%0.35932%0.318SS..Hα-helixtrans-65-39179.6-61.8164.7000111.5I19 S20 I25 V26 L27 V71I19-I23 HydrophobicContact CG2-CD1 3.83Å; I19-I23 HydrophobicContact CG2-CG1 4.34Å; I19-I23 WeakPolarHBondContact O-CG1 3.4Å; I19-I23 PolarHBondContact O-N 3.1Å; S20-I23 PolarHBondContact O-N 3.19Å; I23-I25 VanDerWaalsContact C-N 3.3Å; I23-I25 PolarHBondContact O-N 3.32Å; I23-V26 PolarHBondContact O-N 3.3Å; I23-L27 PolarHBondContact O-N 2.95Å; I23-V71 HydrophobicContact CB-CG1 4.29Å; I23-V71 HydrophobicContact CD1-CG1 3.88Å; I23-V71 HydrophobicContact CG2-CB 4.42Å; I23-V71 HydrophobicContact CG2-CG1 3.41Å; I23-V71 VanDerWaalsContact CG2-CG1 3.41Å
24C83.1Confident78.3Confident12 Ų1255.3 Ų55.38%0.08131%0.309CS..Hα-helixtrans-63.6-36.9176.7-64.30000112.2S20 N21 G22 L27 A28 L109S20-C24 PolarHBondContact O-N 3.06Å; S20-C24 PolarHBondContact O-SG 2.83Å; N21-C24 PolarHBondContact O-N 3.37Å; G22-C24 VanDerWaalsContact C-N 3.35Å; G22-C24 PolarHBondContact O-N 3.33Å; C24-L27 PolarHBondContact O-N 3Å; C24-A28 PolarHBondContact O-N 3.3Å; C24-L109 HydrophobicContact CB-CD2 4.4Å
25I86.6Confident80.6Confident96 Ų9652.2 Ų52.249%0.49228%0.284SS..Hα-helixtrans-64.8-45173.5-67164.8000110.3N21 G22 I23 L27 A28 L29N21-I25 WeakPolarHBondContact O-CG1 3.26Å; N21-I25 PolarHBondContact O-N 2.92Å; N21-I25 VanDerWaalsContact O-N 3.16Å; G22-I25 WeakPolarHBondContact O-CB 3.47Å; G22-I25 PolarHBondContact O-N 3.38Å; I23-I25 VanDerWaalsContact C-N 3.3Å; I23-I25 PolarHBondContact O-N 3.32Å; I25-L27 VanDerWaalsContact C-N 3.32Å; I25-L27 PolarHBondContact O-N 3.13Å; I25-A28 PolarHBondContact O-N 3.05Å; I25-L29 HydrophobicContact CG2-CD1 4.27Å; I25-L29 WeakPolarHBondContact O-CG 3.5Å; I25-L29 PolarHBondContact O-N 3.28Å
26V90.3Very high82.2Confident83 Ų8353.2 Ų53.250%0.50329%0.293SS..Hα-helixtrans-59.3-44.51761730000110.8G22 I23 A28 L29 V30G22-V26 WeakPolarHBondContact O-CG2 3.3Å; G22-V26 PolarHBondContact O-N 3.13Å; I23-V26 PolarHBondContact O-N 3.3Å; V26-A28 VanDerWaalsContact C-N 3.3Å; V26-A28 PolarHBondContact O-N 2.71Å; V26-L29 PolarHBondContact O-N 3.5Å; V26-L29 VanDerWaalsContact O-N 3.13Å; V26-V30 HydrophobicContact CG1-CG2 4.3Å; V26-V30 WeakPolarHBondContact O-CG2 3.37Å; V26-V30 PolarHBondContact O-N 2.91Å
27L90.3Very high83.9Confident33 Ų3356.2 Ų56.217%0.17331%0.314CS..Hα-helixtrans-61-39.3178.1-167.366.2000111.9I23 C24 I25 V30 S31 F64 L67 A110I23-L27 PolarHBondContact O-N 2.95Å; C24-L27 PolarHBondContact O-N 3Å; I25-L27 VanDerWaalsContact C-N 3.32Å; I25-L27 PolarHBondContact O-N 3.13Å; L27-V30 PolarHBondContact O-N 3.41Å; L27-S31 PolarHBondContact O-N 3.16Å; L27-F64 HydrophobicContact CD1-CD1 3.82Å; L27-F64 HydrophobicContact CD1-CE1 4.21Å; L27-F64 HydrophobicContact CD2-CD1 4.48Å; L27-F64 HydrophobicContact CG-CD1 3.99Å; L27-L67 HydrophobicContact CD2-CB 4.37Å; L27-A110 HydrophobicContact CB-CB 4.16Å; L27-A110 HydrophobicContact CD2-CB 3.97Å; L27-A110 HydrophobicContact CG-CB 3.78Å
28A91.4Very high85.2Confident11 Ų1158.7 Ų58.79%0.09133%0.325CS..Hα-helixtrans-66.8-39.3174.400000112.4C24 I25 V26 S31 V32 L109 A110 V113C24-A28 PolarHBondContact O-N 3.3Å; I25-A28 PolarHBondContact O-N 3.05Å; V26-A28 VanDerWaalsContact C-N 3.3Å; V26-A28 PolarHBondContact O-N 2.71Å; A28-S31 PolarHBondContact O-N 3.47Å; A28-S31 PolarHBondContact O-OG 2.95Å; A28-V32 WeakPolarHBondContact O-CG2 3.25Å; A28-V32 PolarHBondContact O-N 2.93Å; A28-V32 VanDerWaalsContact O-N 3.15Å; A28-L109 HydrophobicContact CB-CD2 4.43Å; A28-L109 HydrophobicContact CB-CG 4.3Å; A28-A110 HydrophobicContact CB-CB 4.22Å; A28-V113 HydrophobicContact CB-CG2 4.23Å
29L91.7Very high86.5Confident109 Ų10963.5 Ų63.557%0.57135%0.348SS*.Hα-helixtrans-65.4-40.9174.6-68.6173.1000111.7I25 V26 S31 V32 K33I25-L29 HydrophobicContact CG2-CD1 4.27Å; I25-L29 WeakPolarHBondContact O-CG 3.5Å; I25-L29 PolarHBondContact O-N 3.28Å; V26-L29 PolarHBondContact O-N 3.5Å; V26-L29 VanDerWaalsContact O-N 3.13Å; L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 3.35Å; L29-V32 PolarHBondContact O-N 2.9Å; L29-K33 WeakPolarHBondContact O-CG 3.33Å; L29-K33 PolarHBondContact O-N 3.01Å
30V93.5Very high87.7Confident62 Ų6262 Ų6238%0.37634%0.339SS..Hα-helixtrans-61.7-40.5174.21690000110.6V26 L27 V32 K33 L34V26-V30 HydrophobicContact CG1-CG2 4.3Å; V26-V30 WeakPolarHBondContact O-CG2 3.37Å; V26-V30 PolarHBondContact O-N 2.91Å; L27-V30 PolarHBondContact O-N 3.41Å; V30-V32 PolarHBondContact O-N 3.03Å; V30-K33 PolarHBondContact O-N 3.36Å; V30-L34 HydrophobicContact CG1-CD1 3.64Å; V30-L34 HydrophobicContact CG1-CG 4.2Å; V30-L34 WeakPolarHBondContact O-CB 3.43Å; V30-L34 WeakPolarHBondContact O-CG 3.43Å; V30-L34 PolarHBondContact O-N 3.49Å
31S92.9Very high88.8Confident0 Ų066.4 Ų66.40%036%0.363CS..Hα-helixtrans-62.6-42.8177.384.20000112.1L27 A28 L29 L34 Y35 W114L27-S31 PolarHBondContact O-N 3.16Å; A28-S31 PolarHBondContact O-N 3.47Å; A28-S31 PolarHBondContact O-OG 2.95Å; L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 3.35Å; S31-L34 PolarHBondContact O-N 2.88Å; S31-Y35 WeakPolarHBondContact O-CB 3.24Å; S31-Y35 PolarHBondContact O-N 2.85Å; S31-W114 WeakPolarHBondContact O-CZ3 3.46Å
32V93.2Very high89.7Confident48 Ų4864.3 Ų64.329%0.29135%0.353SS..Hα-helixtrans-61.3-46.9173.6177.80000111A28 L29 V30 Y35 T36 V113 V117A28-V32 WeakPolarHBondContact O-CG2 3.25Å; A28-V32 PolarHBondContact O-N 2.93Å; A28-V32 VanDerWaalsContact O-N 3.15Å; L29-V32 PolarHBondContact O-N 2.9Å; V30-V32 PolarHBondContact O-N 3.03Å; V32-Y35 WeakPolarHBondContact O-CB 3.4Å; V32-Y35 PolarHBondContact O-N 3.47Å; V32-T36 HydrophobicContact CG1-CG2 4.47Å; V32-T36 WeakPolarHBondContact O-CG2 3.37Å; V32-T36 PolarHBondContact O-N 3.29Å; V32-T36 PolarHBondContact O-OG1 2.89Å; V32-V113 HydrophobicContact CG2-CG1 3.5Å; V32-V117 HydrophobicContact CG2-CG2 4.23Å
33K92.6Very high90.2Very high145 Ų14566 Ų6663%0.6336%0.36SS*.Hα-helixtrans-63.6-43.9-179.3-73.5-64.7-176.5-177.70112.4L29 V30 Y35 T36 S37L29-K33 WeakPolarHBondContact O-CG 3.33Å; L29-K33 PolarHBondContact O-N 3.01Å; V30-K33 PolarHBondContact O-N 3.36Å; K33-Y35 VanDerWaalsContact C-N 3.34Å; K33-T36 WeakPolarHBondContact CA-OG1 3.45Å; K33-T36 PolarHBondContact O-N 2.91Å; K33-T36 PolarHBondContact O-OG1 2.96Å; K33-S37 WeakPolarHBondContact O-CB 3.25Å; K33-S37 PolarHBondContact O-N 3.42Å; K33-S37 PolarHBondContact O-OG 3.48Å
34L93.6Very high90.5Very high87 Ų8763.2 Ų63.246%0.45535%0.347SS..Hα-helixtrans-60.1-45.2174.6-78168.6000110.7V30 S31 T36 S37 F38 F64 W114V30-L34 HydrophobicContact CG1-CD1 3.64Å; V30-L34 HydrophobicContact CG1-CG 4.2Å; V30-L34 WeakPolarHBondContact O-CB 3.43Å; V30-L34 WeakPolarHBondContact O-CG 3.43Å; V30-L34 PolarHBondContact O-N 3.49Å; S31-L34 PolarHBondContact O-N 2.88Å; L34-T36 PolarHBondContact O-N 3.36Å; L34-S37 PolarHBondContact O-N 3.09Å; L34-F38 WeakPolarHBondContact O-CB 2.99Å; L34-F38 PolarHBondContact O-N 3.32Å; L34-F64 HydrophobicContact CD1-CE1 4.14Å; L34-F64 HydrophobicContact CD1-CZ 3.66Å; L34-W114 HydrophobicContact CB-CZ3 4.14Å
35Y92.6Very high90.8Very high21 Ų2166.9 Ų66.98%0.08237%0.366CS..Hα-helixtrans-59.2-47.6175.8180-97000112.5S31 V32 K33 S37 F38 W114 V117 T118 D121 I124S31-Y35 WeakPolarHBondContact O-CB 3.24Å; S31-Y35 PolarHBondContact O-N 2.85Å; V32-Y35 WeakPolarHBondContact O-CB 3.4Å; V32-Y35 PolarHBondContact O-N 3.47Å; K33-Y35 VanDerWaalsContact C-N 3.34Å; Y35-S37 VanDerWaalsContact C-N 3.26Å; Y35-S37 PolarHBondContact O-N 2.97Å; Y35-F38 PolarHBondContact O-N 2.83Å; Y35-W114 HydrophobicContact CD2-CH2 4.22Å; Y35-W114 HydrophobicContact CD2-CZ2 4.15Å; Y35-V117 HydrophobicContact CD1-CG1 3.21Å; Y35-V117 HydrophobicContact CE1-CG1 3.51Å; Y35-V117 HydrophobicContact CG-CG1 3.78Å; Y35-T118 HydrophobicContact CD2-CG2 3.69Å; Y35-T118 HydrophobicContact CE2-CG2 3.44Å; Y35-T118 VanDerWaalsContact CE2-CG2 3.44Å; Y35-D121 HydrophobicContact CE1-CB 4.03Å; Y35-D121 WeakPolarHBondContact OH-CB 3.25Å; Y35-D121 PolarHBondContact OH-OD2 3.02Å; Y35-I124 HydrophobicContact CE2-CD1 3.81Å
36T89.7Confident90.6Very high95 Ų9564.8 Ų64.858%0.58336%0.358SS*.Hα-helixtrans-68.6-24.5-178.854.50000113.8V32 K33 L34V32-T36 HydrophobicContact CG1-CG2 4.47Å; V32-T36 WeakPolarHBondContact O-CG2 3.37Å; V32-T36 PolarHBondContact O-N 3.29Å; V32-T36 PolarHBondContact O-OG1 2.89Å; K33-T36 WeakPolarHBondContact CA-OG1 3.45Å; K33-T36 PolarHBondContact O-N 2.91Å; K33-T36 PolarHBondContact O-OG1 2.96Å; L34-T36 PolarHBondContact O-N 3.36Å
37S91.2Very high90.2Very high96 Ų9668.6 Ų68.667%0.67137%0.371SS*.Hα-helixtrans-91.1-17.8178.2-48.70000112.2K33 L34 Y35 D39K33-S37 WeakPolarHBondContact O-CB 3.25Å; K33-S37 PolarHBondContact O-N 3.42Å; K33-S37 PolarHBondContact O-OG 3.48Å; L34-S37 PolarHBondContact O-N 3.09Å; Y35-S37 VanDerWaalsContact C-N 3.26Å; Y35-S37 PolarHBondContact O-N 2.97Å; S37-D39 PolarHBondContact O-N 3.4Å
38F89.5Confident90.2Very high86 Ų8673.7 Ų73.738%0.37739%0.388SS..  trans-76.9116.2180176-104.7000110.2L34 Y35 F40 V56L34-F38 WeakPolarHBondContact O-CB 2.99Å; L34-F38 PolarHBondContact O-N 3.32Å; Y35-F38 PolarHBondContact O-N 2.83Å; F38-F40 HydrophobicContact CD1-CB 4.04Å; F38-F40 HydrophobicContact CE1-CB 3.72Å; F38-F40 HydrophobicContact CE1-CD2 4.01Å; F38-F40 HydrophobicContact CE1-CG 4.37Å; F38-F40 PolarHBondContact O-N 3.35Å; F38-F40 VanDerWaalsContact O-N 3.17Å; F38-V56 HydrophobicContact CD1-CG1 4.48Å; F38-V56 HydrophobicContact CE1-CG1 3.68Å; F38-V56 HydrophobicContact CZ-CG1 4.18Å; F38-V56 HydrophobicContact CZ-CG2 4.36Å
39D87.9Confident90.3Very high124 Ų12473.2 Ų73.266%0.66338%0.384SS*.  trans-84.390.8177.2-170.137.6000110.8S37 N41S37-D39 PolarHBondContact O-N 3.4Å; D39-N41 PolarHBondContact O-N 3.43Å; D39-N41 PolarHBondContact O-ND2 3.4Å; D39-N41 PolarHBondContact OD2-ND2 2.99Å
40F90.5Very high90.3Very high32 Ų3272.8 Ų72.814%0.1438%0.378CS..  trans-71.5116.9178.6174.8-101.2000111.3F38 C42 Y52 V56 K123 I124 C127F38-F40 HydrophobicContact CD1-CB 4.04Å; F38-F40 HydrophobicContact CE1-CB 3.72Å; F38-F40 HydrophobicContact CE1-CD2 4.01Å; F38-F40 HydrophobicContact CE1-CG 4.37Å; F38-F40 PolarHBondContact O-N 3.35Å; F38-F40 VanDerWaalsContact O-N 3.17Å; F40-C42 HydrophobicContact CE1-CB 4.16Å; F40-C42 HydrophobicContact CZ-CB 4.42Å; F40-Y52 AromaticContact CD2-CE1 3.83Å; F40-Y52 HydrophobicContact CD2-CE1 3.83Å; F40-Y52 AromaticContact CE2-CD1 3.76Å; F40-Y52 HydrophobicContact CE2-CD1 3.76Å; F40-Y52 AromaticContact CE2-CE1 3.29Å; F40-Y52 HydrophobicContact CE2-CE1 3.29Å; F40-Y52 HydrophobicContact CZ-CD1 4.22Å; F40-Y52 HydrophobicContact CZ-CE1 4.01Å; F40-V56 HydrophobicContact CD2-CG1 4.31Å; F40-V56 HydrophobicContact CD2-CG2 4.34Å; F40-V56 HydrophobicContact CE2-CG2 4.27Å; F40-K123 HydrophobicContact CD1-CB 4.39Å; F40-I124 HydrophobicContact CD1-CG1 4.09Å; F40-I124 HydrophobicContact CD2-CD1 4.47Å; F40-I124 HydrophobicContact CD2-CG1 3.85Å; F40-I124 HydrophobicContact CE1-CG1 4.17Å; F40-I124 HydrophobicContact CE2-CG1 3.91Å; F40-I124 HydrophobicContact CG-CG1 3.92Å; F40-I124 HydrophobicContact CZ-CB 4.4Å; F40-I124 HydrophobicContact CZ-CG1 4.08Å; F40-C127 HydrophobicContact CE1-CB 3.84Å; F40-C127 HydrophobicContact CZ-CB 3.72Å
41N90.6Very high90.3Very high99 Ų9975.8 Ų75.853%0.52939%0.391SS..  trans-115.7114.9178.2-73.7-73000110.6D39 Y52D39-N41 PolarHBondContact O-N 3.43Å; D39-N41 PolarHBondContact O-ND2 3.4Å; D39-N41 PolarHBondContact OD2-ND2 2.99Å; N41-Y52 WeakPolarHBondContact O-CE1 3.27Å
42C91.1Very high90.3Very high23 Ų2380 Ų8016%0.15541%0.408CS..  trans-76131.9-179.4-174.70000110.7F40 C44 C127 P157F40-C42 HydrophobicContact CE1-CB 4.16Å; F40-C42 HydrophobicContact CZ-CB 4.42Å; C42-C44 PolarHBondContact O-N 3.13Å; C42-C127 HydrophobicContact CB-CB 3.82Å; C42-C127 WeakPolarHBondContact CB-SG 3.39Å; C42-C127 WeakPolarHBondContact SG-CB 3.35Å; C42-C127 CovalentContact SG-SG 2.03Å; C42-C127 PolarHBondContact SG-SG 3.49Å; C42-P157 HydrophobicContact CB-CB 4.15Å; C42-P157 HydrophobicContact CB-CG 4.29Å; C42-P157 WeakPolarHBondContact SG-CG 3.36Å
43P90.3Very high90.4Very high53 Ų5377.7 Ų77.734%0.34439%0.394SS..  trans-71.9-14.9-177.327.3-34.6000114.1L45 Y52P43-L45 HydrophobicContact CB-CD1 4.36Å; P43-L45 PolarHBondContact O-N 3.29Å; P43-Y52 HydrophobicContact CG-CD1 4.22Å; P43-Y52 HydrophobicContact CG-CG 4.33Å
44C89.1Confident90.5Very high13 Ų1373.3 Ų73.39%0.08838%0.377CS..  trans52.937178.4-65.60000114.9C42 N49 A154 K155 C158C42-C44 PolarHBondContact O-N 3.13Å; C44-N49 WeakPolarHBondContact CA-OD1 3.45Å; C44-N49 PolarHBondContact N-OD1 2.92Å; C44-A154 WeakPolarHBondContact CA-O 3.42Å; C44-K155 HydrophobicContact CB-CG 4.21Å; C44-C158 HydrophobicContact CB-CB 4Å; C44-C158 WeakPolarHBondContact CB-SG 3.41Å; C44-C158 WeakPolarHBondContact SG-CB 3.38Å; C44-C158 CovalentContact SG-SG 2Å; C44-C158 PolarHBondContact SG-SG 3.4Å
45L88.2Confident90.5Very high88 Ų8870.3 Ų70.346%0.46137%0.367SS..  trans-114.9127.9175.2-71.8159000108.6P43 Q47 Y48 N49P43-L45 HydrophobicContact CB-CD1 4.36Å; P43-L45 PolarHBondContact O-N 3.29Å; L45-Q47 VanDerWaalsContact C-N 3.27Å; L45-Q47 PolarHBondContact O-N 3.22Å; L45-Q47 VanDerWaalsContact O-N 3.09Å; L45-Y48 HydrophobicContact CB-CD2 3.97Å; L45-Y48 HydrophobicContact CD1-CD2 4.06Å; L45-Y48 PolarHBondContact O-N 2.9Å; L45-Y48 VanDerWaalsContact O-N 3.08Å; L45-N49 PolarHBondContact N-OD1 2.82Å; L45-N49 WeakPolarHBondContact O-CB 2.84Å; L45-N49 PolarHBondContact O-N 3.38Å; L45-N49 PolarHBondContact O-OD1 3.05Å; L45-N49 VanDerWaalsContact O-OD1 3.05Å
46P82.3Confident90.6Very high52 Ų5270.2 Ų70.234%0.33837%0.369SS..THydrogen-bonded Turntrans-57.6-34.2-167.918-30.2000114.4I150 A154P46-I150 HydrophobicContact CB-CG2 3.86Å; P46-A154 HydrophobicContact CB-CB 3.94Å
47Q83.1Confident90.9Very high163 Ų16367.3 Ų67.376%0.76235%0.349SS*.THydrogen-bonded Turntrans-85.4-32.1178.6-66.2-175.6-13.500113.5L45L45-Q47 VanDerWaalsContact C-N 3.27Å; L45-Q47 PolarHBondContact O-N 3.22Å; L45-Q47 VanDerWaalsContact O-N 3.09Å
48Y89.7Confident91Very high140 Ų14065.7 Ų65.755%0.54934%0.335SS..Hα-helixtrans-90.1-23.8-173.5-67.6-81.7000113.6L45 K50 L51 Y52L45-Y48 HydrophobicContact CB-CD2 3.97Å; L45-Y48 HydrophobicContact CD1-CD2 4.06Å; L45-Y48 PolarHBondContact O-N 2.9Å; L45-Y48 VanDerWaalsContact O-N 3.08Å; Y48-K50 VanDerWaalsContact C-N 3.33Å; Y48-K50 PolarHBondContact O-N 2.9Å; Y48-L51 PolarHBondContact O-N 3.38Å; Y48-Y52 VanDerWaalsContact O-CB 3.27Å; Y48-Y52 WeakPolarHBondContact O-CB 3.29Å; Y48-Y52 PolarHBondContact O-N 3.27Å
49N92.2Very high91.3Very high1 Ų165.2 Ų65.21%0.00534%0.339CS..Hα-helixtrans-52.4-48.5179.6-83.28.9000113.1C44 L45 S53 C127 A154C44-N49 WeakPolarHBondContact CA-OD1 3.45Å; C44-N49 PolarHBondContact N-OD1 2.92Å; L45-N49 PolarHBondContact N-OD1 2.82Å; L45-N49 WeakPolarHBondContact O-CB 2.84Å; L45-N49 PolarHBondContact O-N 3.38Å; L45-N49 PolarHBondContact O-OD1 3.05Å; L45-N49 VanDerWaalsContact O-OD1 3.05Å; N49-S53 WeakPolarHBondContact O-CB 3.5Å; N49-S53 PolarHBondContact O-N 3Å; N49-S53 VanDerWaalsContact O-N 3.15Å; N49-S53 PolarHBondContact O-OG 2.74Å; N49-C127 WeakPolarHBondContact CB-O 3.28Å; N49-A154 WeakPolarHBondContact ND2-CA 3.12Å; N49-A154 PolarHBondContact ND2-O 2.94Å
50K91.8Very high91.7Very high101 Ų10160.6 Ų60.644%0.43932%0.316SS..Hα-helixtrans-68.2-47.8179.8-175.9171.9179.5178.50111.4Y48 L54Y48-K50 VanDerWaalsContact C-N 3.33Å; Y48-K50 PolarHBondContact O-N 2.9Å; K50-L54 HydrophobicContact CD-CD1 4.48Å; K50-L54 HydrophobicContact CG-CD1 3.73Å; K50-L54 HydrophobicContact CG-CG 4.3Å; K50-L54 VanDerWaalsContact O-CB 3.28Å; K50-L54 WeakPolarHBondContact O-CB 3.41Å; K50-L54 VanDerWaalsContact O-CG 3.23Å; K50-L54 WeakPolarHBondContact O-CG 3.41Å; K50-L54 PolarHBondContact O-N 3.41Å
51L94Very high92Very high124 Ų12459.6 Ų59.665%0.64931%0.313SS*.Hα-helixtrans-63-49.1-178-176.464.5000111.8Y48 G55Y48-L51 PolarHBondContact O-N 3.38Å; L51-G55 PolarHBondContact O-N 3.29Å
52Y94.1Very high92.3Very high89 Ų8959.2 Ų59.235%0.34931%0.31SS..Hα-helixtrans-61.6-49.6179.8177.3-108.1000111.5F40 N41 P43 Y48 G55 V56F40-Y52 AromaticContact CD2-CE1 3.83Å; F40-Y52 HydrophobicContact CD2-CE1 3.83Å; F40-Y52 AromaticContact CE2-CD1 3.76Å; F40-Y52 HydrophobicContact CE2-CD1 3.76Å; F40-Y52 AromaticContact CE2-CE1 3.29Å; F40-Y52 HydrophobicContact CE2-CE1 3.29Å; F40-Y52 HydrophobicContact CZ-CD1 4.22Å; F40-Y52 HydrophobicContact CZ-CE1 4.01Å; N41-Y52 WeakPolarHBondContact O-CE1 3.27Å; P43-Y52 HydrophobicContact CG-CD1 4.22Å; P43-Y52 HydrophobicContact CG-CG 4.33Å; Y48-Y52 VanDerWaalsContact O-CB 3.27Å; Y48-Y52 WeakPolarHBondContact O-CB 3.29Å; Y48-Y52 PolarHBondContact O-N 3.27Å; Y52-G55 PolarHBondContact O-N 3.43Å; Y52-V56 HydrophobicContact CE1-CG2 4.32Å; Y52-V56 HydrophobicContact CE2-CG2 4.19Å; Y52-V56 WeakPolarHBondContact O-CG2 3.35Å; Y52-V56 PolarHBondContact O-N 3.39Å
53S94.4Very high92.5Very high0 Ų062.4 Ų62.40%032%0.324CS..Hα-helixtrans-65.5-42.4-178.5-58.60000112.8N49 G55 V56 M57 I124 C127 A128N49-S53 WeakPolarHBondContact O-CB 3.5Å; N49-S53 PolarHBondContact O-N 3Å; N49-S53 VanDerWaalsContact O-N 3.15Å; N49-S53 PolarHBondContact O-OG 2.74Å; S53-G55 VanDerWaalsContact C-N 3.3Å; S53-G55 PolarHBondContact O-N 2.88Å; S53-V56 PolarHBondContact O-N 2.65Å; S53-M57 WeakPolarHBondContact O-CB 3.46Å; S53-M57 PolarHBondContact O-N 3.32Å; S53-I124 WeakPolarHBondContact CB-O 3.5Å; S53-I124 VanDerWaalsContact O-CG2 3.22Å; S53-I124 WeakPolarHBondContact O-CG2 3.35Å; S53-C127 WeakPolarHBondContact OG-CB 3.3Å; S53-C127 PolarHBondContact OG-SG 3.48Å; S53-A128 PolarHBondContact OG-N 3.15Å
54L94.2Very high92.8Very high52 Ų5260.5 Ų60.527%0.27231%0.311SS..Hα-helixtrans-65.2-36.6174.7-71.4177.8000111.4K50 M57 T58K50-L54 HydrophobicContact CD-CD1 4.48Å; K50-L54 HydrophobicContact CG-CD1 3.73Å; K50-L54 HydrophobicContact CG-CG 4.3Å; K50-L54 VanDerWaalsContact O-CB 3.28Å; K50-L54 WeakPolarHBondContact O-CB 3.41Å; K50-L54 VanDerWaalsContact O-CG 3.23Å; K50-L54 WeakPolarHBondContact O-CG 3.41Å; K50-L54 PolarHBondContact O-N 3.41Å; L54-M57 HydrophobicContact CD2-CE 3.77Å; L54-M57 PolarHBondContact O-N 3.49Å; L54-T58 WeakPolarHBondContact O-CB 3.26Å; L54-T58 VanDerWaalsContact O-CG2 3.32Å; L54-T58 WeakPolarHBondContact O-CG2 3.45Å; L54-T58 PolarHBondContact O-N 3.02Å; L54-T58 PolarHBondContact O-OG1 3.27Å
55G95.1Very high93.1Very high25 Ų2562.5 Ų62.526%0.25832%0.318SS..Hα-helixtrans-56.3-53171.200000112.3L51 Y52 S53 M57 T58 V59L51-G55 PolarHBondContact O-N 3.29Å; Y52-G55 PolarHBondContact O-N 3.43Å; S53-G55 VanDerWaalsContact C-N 3.3Å; S53-G55 PolarHBondContact O-N 2.88Å; G55-M57 VanDerWaalsContact C-N 3.26Å; G55-M57 PolarHBondContact O-N 3.45Å; G55-T58 PolarHBondContact O-N 3.24Å; G55-T58 VanDerWaalsContact O-N 3.15Å; G55-T58 PolarHBondContact O-OG1 3.17Å; G55-V59 VanDerWaalsContact O-CB 3.31Å; G55-V59 WeakPolarHBondContact O-CB 3.45Å; G55-V59 WeakPolarHBondContact O-CG2 3.26Å; G55-V59 PolarHBondContact O-N 3.29Å
56V94.7Very high93.4Very high18 Ų1864 Ų6411%0.10932%0.321CS..Hα-helixtrans-64.5-31.8177.8-179.70000112F38 F40 Y52 S53 P60 W114 I124F38-V56 HydrophobicContact CD1-CG1 4.48Å; F38-V56 HydrophobicContact CE1-CG1 3.68Å; F38-V56 HydrophobicContact CZ-CG1 4.18Å; F38-V56 HydrophobicContact CZ-CG2 4.36Å; F40-V56 HydrophobicContact CD2-CG1 4.31Å; F40-V56 HydrophobicContact CD2-CG2 4.34Å; F40-V56 HydrophobicContact CE2-CG2 4.27Å; Y52-V56 HydrophobicContact CE1-CG2 4.32Å; Y52-V56 HydrophobicContact CE2-CG2 4.19Å; Y52-V56 WeakPolarHBondContact O-CG2 3.35Å; Y52-V56 PolarHBondContact O-N 3.39Å; S53-V56 PolarHBondContact O-N 2.65Å; V56-P60 WeakPolarHBondContact O-CD 3.15Å; V56-P60 WeakPolarHBondContact O-CG 3.38Å; V56-W114 PolarHBondContact O-NE1 2.86Å; V56-I124 HydrophobicContact CB-CD1 4.44Å; V56-I124 HydrophobicContact CG1-CD1 3.65Å; V56-I124 HydrophobicContact CG1-CG1 4.48Å
57M94.4Very high93.9Very high35 Ų3565.1 Ų65.117%0.17232%0.323CS..Hα-helixtrans-72.8-29.4175.8-162.7172.377.600112.5S53 L54 G55 P61 I115 L119 I124S53-M57 WeakPolarHBondContact O-CB 3.46Å; S53-M57 PolarHBondContact O-N 3.32Å; L54-M57 HydrophobicContact CD2-CE 3.77Å; L54-M57 PolarHBondContact O-N 3.49Å; G55-M57 VanDerWaalsContact C-N 3.26Å; G55-M57 PolarHBondContact O-N 3.45Å; M57-P61 WeakPolarHBondContact O-CD 3.27Å; M57-P61 VanDerWaalsContact O-CG 3.25Å; M57-P61 WeakPolarHBondContact O-CG 3.24Å; M57-I115 HydrophobicContact CG-CD1 3.91Å; M57-I115 WeakPolarHBondContact O-CD1 3.38Å; M57-L119 HydrophobicContact SD-CD2 4.45Å; M57-I124 HydrophobicContact CB-CG2 4.24Å
58T94.4Very high94.3Very high61 Ų6157.5 Ų57.537%0.37429%0.289SS..Hα-helixtrans-108.9-39.1-169.953.90000114.9L54 G55 P61 I62L54-T58 WeakPolarHBondContact O-CB 3.26Å; L54-T58 VanDerWaalsContact O-CG2 3.32Å; L54-T58 WeakPolarHBondContact O-CG2 3.45Å; L54-T58 PolarHBondContact O-N 3.02Å; L54-T58 PolarHBondContact O-OG1 3.27Å; G55-T58 PolarHBondContact O-N 3.24Å; G55-T58 VanDerWaalsContact O-N 3.15Å; G55-T58 PolarHBondContact O-OG1 3.17Å; T58-P61 VanDerWaalsContact O-CD 3.3Å; T58-P61 WeakPolarHBondContact O-CD 3.42Å; T58-I62 WeakPolarHBondContact O-CD1 3.42Å; T58-I62 VanDerWaalsContact O-CG1 3.28Å; T58-I62 WeakPolarHBondContact O-CG1 3.19Å; T58-I62 PolarHBondContact O-N 3.16Å; T58-I62 VanDerWaalsContact O-N 3.17Å
59V96.3Very high94.3Very high77 Ų7752.1 Ų52.147%0.46727%0.271SS..Hα-helixtrans-64.9-48.6-175173.10000112.1G55 I62 I63G55-V59 VanDerWaalsContact O-CB 3.31Å; G55-V59 WeakPolarHBondContact O-CB 3.45Å; G55-V59 WeakPolarHBondContact O-CG2 3.26Å; G55-V59 PolarHBondContact O-N 3.29Å; V59-I62 WeakPolarHBondContact O-CB 3.22Å; V59-I62 PolarHBondContact O-N 3.32Å; V59-I62 VanDerWaalsContact O-N 3.13Å; V59-I63 HydrophobicContact CG1-CD1 3.9Å; V59-I63 HydrophobicContact CG1-CG1 4.45Å; V59-I63 WeakPolarHBondContact O-CG1 3.41Å; V59-I63 PolarHBondContact O-N 3.47Å
60P95.6Very high94.2Very high26 Ų2658.6 Ų58.617%0.16931%0.305CS..Hα-helixtrans-61.6-43178.7-20.133000113.4V56 I62 I63 F64 W114V56-P60 WeakPolarHBondContact O-CD 3.15Å; V56-P60 WeakPolarHBondContact O-CG 3.38Å; P60-I62 VanDerWaalsContact C-N 3.3Å; P60-I62 PolarHBondContact O-N 3Å; P60-I63 PolarHBondContact O-N 3.45Å; P60-I63 VanDerWaalsContact O-N 3.16Å; P60-F64 HydrophobicContact CB-CD2 4.43Å; P60-F64 HydrophobicContact CB-CE2 4.18Å; P60-F64 WeakPolarHBondContact O-CD2 3.31Å; P60-F64 PolarHBondContact O-N 2.72Å; P60-W114 HydrophobicContact CB-CD2 3.98Å; P60-W114 HydrophobicContact CB-CE3 4.37Å; P60-W114 HydrophobicContact CB-CH2 3.99Å; P60-W114 HydrophobicContact CB-CZ2 3.57Å; P60-W114 HydrophobicContact CB-CZ3 4.36Å; P60-W114 HydrophobicContact CG-CH2 4.17Å; P60-W114 HydrophobicContact CG-CZ2 3.5Å
61P96.1Very high93.8Very high12 Ų1257.5 Ų57.58%0.07831%0.306CS..Hα-helixtrans-55.5-40.5170.6-31.838.4000114.1M57 T58 F64 F65 P111 W114 I115M57-P61 WeakPolarHBondContact O-CD 3.27Å; M57-P61 VanDerWaalsContact O-CG 3.25Å; M57-P61 WeakPolarHBondContact O-CG 3.24Å; T58-P61 VanDerWaalsContact O-CD 3.3Å; T58-P61 WeakPolarHBondContact O-CD 3.42Å; P61-F64 PolarHBondContact O-N 3.15Å; P61-F65 VanDerWaalsContact O-CB 3.29Å; P61-F65 WeakPolarHBondContact O-CB 3.46Å; P61-F65 PolarHBondContact O-N 2.87Å; P61-P111 HydrophobicContact CB-CB 3.94Å; P61-P111 WeakPolarHBondContact O-CG 3.42Å; P61-W114 VanDerWaalsContact CD-CD1 3.42Å; P61-W114 HydrophobicContact CG-CB 4.15Å; P61-W114 HydrophobicContact CG-CG 3.87Å; P61-I115 HydrophobicContact CG-CD1 3.81Å; P61-I115 HydrophobicContact CG-CG1 4Å
62I96.8Very high93.3Very high90 Ų9051.8 Ų51.846%0.46228%0.276SS..Hα-helixtrans-63.5-44.5176.6-67.4165.3000110.2T58 V59 P60 F65 F66T58-I62 WeakPolarHBondContact O-CD1 3.42Å; T58-I62 VanDerWaalsContact O-CG1 3.28Å; T58-I62 WeakPolarHBondContact O-CG1 3.19Å; T58-I62 PolarHBondContact O-N 3.16Å; T58-I62 VanDerWaalsContact O-N 3.17Å; V59-I62 WeakPolarHBondContact O-CB 3.22Å; V59-I62 PolarHBondContact O-N 3.32Å; V59-I62 VanDerWaalsContact O-N 3.13Å; P60-I62 VanDerWaalsContact C-N 3.3Å; P60-I62 PolarHBondContact O-N 3Å; I62-F65 WeakPolarHBondContact O-CB 3.07Å; I62-F65 PolarHBondContact O-N 3.31Å; I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.5Å; I62-F66 VanDerWaalsContact CG2-CE2 3.5Å; I62-F66 WeakPolarHBondContact O-CD2 3.25Å; I62-F66 PolarHBondContact O-N 2.91Å; I62-F66 VanDerWaalsContact O-N 3.08Å
63I96.3Very high92.5Very high91 Ų9151.8 Ų51.847%0.46728%0.275SS..Hα-helixtrans-61-49.4176.3-65168000110.6V59 P60 F65 F66 L67V59-I63 HydrophobicContact CG1-CD1 3.9Å; V59-I63 HydrophobicContact CG1-CG1 4.45Å; V59-I63 WeakPolarHBondContact O-CG1 3.41Å; V59-I63 PolarHBondContact O-N 3.47Å; P60-I63 PolarHBondContact O-N 3.45Å; P60-I63 VanDerWaalsContact O-N 3.16Å; I63-F65 VanDerWaalsContact C-N 3.25Å; I63-F65 PolarHBondContact O-N 3.11Å; I63-F66 PolarHBondContact O-N 3.26Å; I63-L67 HydrophobicContact CG2-CD1 3.94Å; I63-L67 HydrophobicContact CG2-CG 4.36Å; I63-L67 WeakPolarHBondContact O-CG 3.32Å; I63-L67 PolarHBondContact O-N 2.91Å
64F95.3Very high91.8Very high13 Ų1352.1 Ų52.16%0.05728%0.277CS..Hα-helixtrans-62.1-33.9177.8-73.2-58.2000112.7L27 L34 P60 P61 G68 A110 P111 W114L27-F64 HydrophobicContact CD1-CD1 3.82Å; L27-F64 HydrophobicContact CD1-CE1 4.21Å; L27-F64 HydrophobicContact CD2-CD1 4.48Å; L27-F64 HydrophobicContact CG-CD1 3.99Å; L34-F64 HydrophobicContact CD1-CE1 4.14Å; L34-F64 HydrophobicContact CD1-CZ 3.66Å; P60-F64 HydrophobicContact CB-CD2 4.43Å; P60-F64 HydrophobicContact CB-CE2 4.18Å; P60-F64 WeakPolarHBondContact O-CD2 3.31Å; P60-F64 PolarHBondContact O-N 2.72Å; P61-F64 PolarHBondContact O-N 3.15Å; F64-G68 PolarHBondContact O-N 3.44Å; F64-A110 HydrophobicContact CB-CB 4.17Å; F64-A110 HydrophobicContact CG-CB 4.43Å; F64-P111 HydrophobicContact CB-CG 4.11Å; F64-W114 HydrophobicContact CD2-CE3 4.42Å; F64-W114 HydrophobicContact CE2-CD2 4.25Å; F64-W114 AromaticContact CE2-CE3 3.61Å; F64-W114 HydrophobicContact CE2-CE3 3.61Å; F64-W114 AromaticContact CE2-CZ3 3.97Å; F64-W114 HydrophobicContact CE2-CZ3 3.97Å; F64-W114 HydrophobicContact CZ-CE3 4.44Å
65F95.4Very high91.3Very high55 Ų5550.5 Ų50.524%0.24127%0.27CS..Hα-helixtrans-63-50.4175.6175.7-104.5000110.8P61 I62 I63 L67 G68 V69 L104 A107 L108 P111P61-F65 VanDerWaalsContact O-CB 3.29Å; P61-F65 WeakPolarHBondContact O-CB 3.46Å; P61-F65 PolarHBondContact O-N 2.87Å; I62-F65 WeakPolarHBondContact O-CB 3.07Å; I62-F65 PolarHBondContact O-N 3.31Å; I63-F65 VanDerWaalsContact C-N 3.25Å; I63-F65 PolarHBondContact O-N 3.11Å; F65-L67 PolarHBondContact O-N 2.92Å; F65-G68 PolarHBondContact O-N 2.77Å; F65-V69 HydrophobicContact CE1-CG2 4.14Å; F65-V69 HydrophobicContact CE2-CG2 4.2Å; F65-V69 HydrophobicContact CZ-CG2 3.96Å; F65-V69 WeakPolarHBondContact O-CG2 3.49Å; F65-V69 PolarHBondContact O-N 2.84Å; F65-L104 HydrophobicContact CE2-CD1 3.63Å; F65-L104 HydrophobicContact CZ-CD1 3.79Å; F65-A107 HydrophobicContact CD2-CB 4.16Å; F65-A107 HydrophobicContact CE2-CB 4.12Å; F65-L108 HydrophobicContact CD2-CD2 3.73Å; F65-L108 HydrophobicContact CD2-CG 4.27Å; F65-L108 HydrophobicContact CE2-CD2 3.88Å; F65-L108 HydrophobicContact CE2-CG 4.15Å; F65-P111 HydrophobicContact CB-CG 3.8Å
66F94.7Very high90.6Very high120 Ų12051 Ų5153%0.52627%0.274SS..Hα-helixtrans-63.6-42.2177.5-74.7-65.8000112.3I62 I63 G68 V69 L70I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.5Å; I62-F66 VanDerWaalsContact CG2-CE2 3.5Å; I62-F66 WeakPolarHBondContact O-CD2 3.25Å; I62-F66 PolarHBondContact O-N 2.91Å; I62-F66 VanDerWaalsContact O-N 3.08Å; I63-F66 PolarHBondContact O-N 3.26Å; F66-G68 VanDerWaalsContact C-N 3.31Å; F66-G68 PolarHBondContact O-N 3.02Å; F66-V69 PolarHBondContact O-N 3.49Å; F66-L70 WeakPolarHBondContact O-CB 3.27Å; F66-L70 VanDerWaalsContact O-CG 3.26Å; F66-L70 WeakPolarHBondContact O-CG 3.45Å; F66-L70 PolarHBondContact O-N 3.42Å
67L92.7Very high90Very high74 Ų7450.3 Ų50.339%0.38727%0.27SS..Hα-helixtrans-60.3-42.3173.6-70.2174.9000111.6L27 I63 F65 V69 L70 V71L27-L67 HydrophobicContact CD2-CB 4.37Å; I63-L67 HydrophobicContact CG2-CD1 3.94Å; I63-L67 HydrophobicContact CG2-CG 4.36Å; I63-L67 WeakPolarHBondContact O-CG 3.32Å; I63-L67 PolarHBondContact O-N 2.91Å; F65-L67 PolarHBondContact O-N 2.92Å; L67-V69 VanDerWaalsContact C-N 3.34Å; L67-V69 PolarHBondContact O-N 2.88Å; L67-L70 PolarHBondContact O-N 3.17Å; L67-V71 WeakPolarHBondContact O-CB 3.48Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.38Å; L67-V71 PolarHBondContact O-N 3.19Å
68G91.3Very high89.5Confident4 Ų449.7 Ų49.74%0.04127%0.267CS..Hα-helixtrans-61.5-39.9175.700000112.6F64 F65 F66 N72F64-G68 PolarHBondContact O-N 3.44Å; F65-G68 PolarHBondContact O-N 2.77Å; F66-G68 VanDerWaalsContact C-N 3.31Å; F66-G68 PolarHBondContact O-N 3.02Å; G68-N72 VanDerWaalsContact O-CB 3.27Å; G68-N72 WeakPolarHBondContact O-CB 3.12Å; G68-N72 PolarHBondContact O-N 2.87Å
69V90.6Very high89Confident26 Ų2651.9 Ų51.916%0.15827%0.274CS..Hα-helixtrans-67.1-49.3174171.50000110.9F65 F66 L67 V71 N72 T75 M103 A107F65-V69 HydrophobicContact CE1-CG2 4.14Å; F65-V69 HydrophobicContact CE2-CG2 4.2Å; F65-V69 HydrophobicContact CZ-CG2 3.96Å; F65-V69 WeakPolarHBondContact O-CG2 3.49Å; F65-V69 PolarHBondContact O-N 2.84Å; F66-V69 PolarHBondContact O-N 3.49Å; L67-V69 VanDerWaalsContact C-N 3.34Å; L67-V69 PolarHBondContact O-N 2.88Å; V69-V71 VanDerWaalsContact C-N 3.3Å; V69-V71 PolarHBondContact O-N 3.41Å; V69-N72 PolarHBondContact O-N 3.01Å; V69-N72 VanDerWaalsContact O-N 3.16Å; V69-T75 HydrophobicContact CG1-CG2 3.74Å; V69-T75 WeakPolarHBondContact O-CB 3.2Å; V69-T75 PolarHBondContact O-OG1 3.48Å; V69-M103 HydrophobicContact CG1-SD 4.2Å; V69-M103 HydrophobicContact CG2-CE 4.44Å; V69-A107 HydrophobicContact CG2-CB 3.77Å
70L89.3Confident88.3Confident138 Ų13852.1 Ų52.172%0.72327%0.273SS*.Hα-helixtrans-61.2-37.9-176.8-72.6171.3000113F66 L67 N72F66-L70 WeakPolarHBondContact O-CB 3.27Å; F66-L70 VanDerWaalsContact O-CG 3.26Å; F66-L70 WeakPolarHBondContact O-CG 3.45Å; F66-L70 PolarHBondContact O-N 3.42Å; L67-L70 PolarHBondContact O-N 3.17Å; L70-N72 VanDerWaalsContact C-N 3.33Å
71V84.9Confident87.7Confident77 Ų7751.4 Ų51.447%0.46727%0.267SS..Hα-helixtrans-85.1-11.6-177.8-1770000112.1I23 L67 V69 R73I23-V71 HydrophobicContact CB-CG1 4.29Å; I23-V71 HydrophobicContact CD1-CG1 3.88Å; I23-V71 HydrophobicContact CG2-CB 4.42Å; I23-V71 HydrophobicContact CG2-CG1 3.41Å; I23-V71 VanDerWaalsContact CG2-CG1 3.41Å; L67-V71 WeakPolarHBondContact O-CB 3.48Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.38Å; L67-V71 PolarHBondContact O-N 3.19Å; V69-V71 VanDerWaalsContact C-N 3.3Å; V69-V71 PolarHBondContact O-N 3.41Å; V71-R73 PolarHBondContact O-N 3.12Å
72N82.8Confident87Confident4 Ų459.1 Ų59.12%0.02130%0.295CS..  trans-78.5117.3-179.2-168-18.5000111.4S20 G68 V69 L70 H74 T75 M103S20-N72 PolarHBondContact OG-OD1 3.31Å; G68-N72 VanDerWaalsContact O-CB 3.27Å; G68-N72 WeakPolarHBondContact O-CB 3.12Å; G68-N72 PolarHBondContact O-N 2.87Å; V69-N72 PolarHBondContact O-N 3.01Å; V69-N72 VanDerWaalsContact O-N 3.16Å; L70-N72 VanDerWaalsContact C-N 3.33Å; N72-H74 PolarHBondContact O-N 3.43Å; N72-H74 PolarHBondContact OD1-CD2 2.78Å; N72-H74 PolarHBondContact OD1-N 2.77Å; N72-T75 VanDerWaalsContact O-CB 3.22Å; N72-T75 WeakPolarHBondContact O-CB 2.86Å; N72-T75 PolarHBondContact O-N 2.9Å; N72-T75 PolarHBondContact O-OG1 3.34Å; N72-M103 HydrophobicContact CB-CG 4.49Å; N72-M103 WeakPolarHBondContact ND2-CA 3.44Å
73R77.6Confident86.3Confident89 Ų8961.3 Ų61.334%0.33631%0.305SS..Hα-helixtrans-55.3-35.2176.6-178.3169.9169.3829.9113.4V71 T75 G76 V77 D223V71-R73 PolarHBondContact O-N 3.12Å; R73-T75 PolarHBondContact O-N 2.58Å; R73-G76 PolarHBondContact O-N 2.85Å; R73-V77 PolarHBondContact O-N 3.35Å; R73-D223 IonicContact CZ-OD1 3.77Å; R73-D223 VanDerWaalsContact CZ-OD1 3.28Å; R73-D223 IonicContact NE-OD1 3.12Å; R73-D223 PolarHBondContact NE-OD1 2.98Å; R73-D223 IonicContact NE-OD2 3.17Å; R73-D223 PolarHBondContact NH2-O 3.25Å; R73-D223 IonicContact NH2-OD1 3.01Å; R73-D223 PolarHBondContact NH2-OD1 2.83Å; R73-D223 VanDerWaalsContact NH2-OD1 3.08Å
74H79.7Confident85.6Confident7 Ų757.2 Ų57.23%0.03228%0.284CS..Hα-helixtrans-64.3-21.8177.7-67.9-75.8000113N72 M78 L99 R106N72-H74 PolarHBondContact O-N 3.43Å; N72-H74 PolarHBondContact OD1-CD2 2.78Å; N72-H74 PolarHBondContact OD1-N 2.77Å; H74-M78 WeakPolarHBondContact O-CB 3.19Å; H74-M78 PolarHBondContact O-N 2.93Å; H74-L99 HydrophobicContact CB-CD2 4.43Å; H74-L99 WeakPolarHBondContact ND1-CD2 3.36Å; H74-R106 PolarHBondContact CD2-NH1 2.82Å; H74-R106 PolarHBondContact NE2-NH1 3.2Å; H74-R106 PolarHBondContact NE2-NH2 3.12Å
75T83.1Confident84.8Confident19 Ų1958.3 Ų58.312%0.11729%0.292CS..Hα-helixtrans-65.7-44.4175.7-57.90000111.2V69 N72 R73 M78 M79 M103V69-T75 HydrophobicContact CG1-CG2 3.74Å; V69-T75 WeakPolarHBondContact O-CB 3.2Å; V69-T75 PolarHBondContact O-OG1 3.48Å; N72-T75 VanDerWaalsContact O-CB 3.22Å; N72-T75 WeakPolarHBondContact O-CB 2.86Å; N72-T75 PolarHBondContact O-N 2.9Å; N72-T75 PolarHBondContact O-OG1 3.34Å; R73-T75 PolarHBondContact O-N 2.58Å; T75-M78 PolarHBondContact O-N 3.19Å; T75-M79 WeakPolarHBondContact O-CB 3.44Å; T75-M79 VanDerWaalsContact O-CG 3.27Å; T75-M79 WeakPolarHBondContact O-CG 3.47Å; T75-M79 PolarHBondContact O-N 3.44Å; T75-M103 HydrophobicContact CG2-SD 4.12Å; T75-M103 VanDerWaalsContact OG1-CG 3.24Å; T75-M103 WeakPolarHBondContact OG1-CG 3.31Å; T75-M103 PolarHBondContact OG1-SD 3.22Å
76G81.8Confident83.6Confident34 Ų3461.4 Ų61.435%0.35132%0.315SS..Hα-helixtrans-61.5-53.7175.800000111.5R73 M78 M79 D80R73-G76 PolarHBondContact O-N 2.85Å; G76-M78 VanDerWaalsContact C-N 3.27Å; G76-M78 PolarHBondContact O-N 3.02Å; G76-M79 PolarHBondContact O-N 3.32Å; G76-M79 VanDerWaalsContact O-N 3.11Å; G76-D80 PolarHBondContact O-N 3.36Å
77V82Confident82.6Confident5 Ų556.9 Ų56.93%0.0330%0.302CS..Hα-helixtrans-57.9-40.3178.9-1780000111.8R73 E81 L222R73-V77 PolarHBondContact O-N 3.35Å; V77-E81 WeakPolarHBondContact O-CB 3.48Å; V77-E81 PolarHBondContact O-N 3.41Å; V77-L222 HydrophobicContact CG1-CB 3.97Å
78M83.4Confident81.5Confident22 Ų2258.9 Ų58.911%0.10831%0.313CS..Hα-helixtrans-66.2-45.3177-177.7-160.77800111.8H74 T75 G76 E81 W82 L99 F100 M103H74-M78 WeakPolarHBondContact O-CB 3.19Å; H74-M78 PolarHBondContact O-N 2.93Å; T75-M78 PolarHBondContact O-N 3.19Å; G76-M78 VanDerWaalsContact C-N 3.27Å; G76-M78 PolarHBondContact O-N 3.02Å; M78-E81 PolarHBondContact O-N 2.92Å; M78-W82 WeakPolarHBondContact O-CB 3.37Å; M78-W82 PolarHBondContact O-N 3.19Å; M78-L99 HydrophobicContact CB-CB 4.46Å; M78-F100 HydrophobicContact CE-CD2 4.47Å; M78-F100 HydrophobicContact SD-CB 3.91Å; M78-F100 HydrophobicContact SD-CD2 3.74Å; M78-F100 HydrophobicContact SD-CG 4.33Å; M78-M103 HydrophobicContact CE-SD 4.35Å; M78-M103 HydrophobicContact SD-SD 4.37Å
79M83.7Confident80.8Confident107 Ų10759.1 Ų59.153%0.52731%0.313SS..Hα-helixtrans-64.5-41.8179.4-75-60.6-154.500111.5T75 G76 W82 M83T75-M79 WeakPolarHBondContact O-CB 3.44Å; T75-M79 VanDerWaalsContact O-CG 3.27Å; T75-M79 WeakPolarHBondContact O-CG 3.47Å; T75-M79 PolarHBondContact O-N 3.44Å; G76-M79 PolarHBondContact O-N 3.32Å; G76-M79 VanDerWaalsContact O-N 3.11Å; M79-W82 PolarHBondContact O-N 3.33Å; M79-M83 WeakPolarHBondContact O-CB 3.27Å; M79-M83 PolarHBondContact O-N 2.94Å
80D82Confident80Confident82 Ų8262.3 Ų62.344%0.43934%0.337SS..Hα-helixtrans-64.8-45.9177.6-70.3-20.6000111.3G76 W82 M83 R84 Q226G76-D80 PolarHBondContact O-N 3.36Å; D80-W82 VanDerWaalsContact C-N 3.3Å; D80-W82 PolarHBondContact O-N 2.69Å; D80-M83 PolarHBondContact O-N 3.08Å; D80-R84 VanDerWaalsContact O-CB 3.27Å; D80-R84 WeakPolarHBondContact O-CB 3.27Å; D80-R84 PolarHBondContact O-N 3.27Å; D80-Q226 PolarHBondContact OD2-NE2 3.44Å
81E81.9Confident79.4Confident10 Ų1059.4 Ų59.45%0.04732%0.318CS..Hα-helixtrans-69.2-29.3177.1-166.462.7-161.600112.4V77 M78 R84 R89 L222 K300V77-E81 WeakPolarHBondContact O-CB 3.48Å; V77-E81 PolarHBondContact O-N 3.41Å; M78-E81 PolarHBondContact O-N 2.92Å; E81-R84 IonicContact OE1-NH1 2.88Å; E81-R84 PolarHBondContact OE1-NH1 2.93Å; E81-R84 VanDerWaalsContact OE1-NH1 3.12Å; E81-R89 IonicContact OE1-CZ 3.91Å; E81-R89 IonicContact OE1-NH2 2.84Å; E81-R89 PolarHBondContact OE1-NH2 3.05Å; E81-R89 IonicContact OE2-NH2 2.87Å; E81-R89 PolarHBondContact OE2-NH2 3.26Å; E81-L222 HydrophobicContact CG-CD1 4.33Å; E81-K300 IonicContact OE2-NZ 3.55Å
82W81.1Confident79.1Confident175 Ų17558.7 Ų58.766%0.66331%0.312SS*.Hα-helixtrans-68.3-49174.3-175.6-92.5000111.6M78 M79 D80 R84 K91 V96M78-W82 WeakPolarHBondContact O-CB 3.37Å; M78-W82 PolarHBondContact O-N 3.19Å; M79-W82 PolarHBondContact O-N 3.33Å; D80-W82 VanDerWaalsContact C-N 3.3Å; D80-W82 PolarHBondContact O-N 2.69Å; W82-R84 VanDerWaalsContact C-N 3.34Å; W82-K91 PolarHBondContact O-NZ 3.22Å; W82-V96 HydrophobicContact CE3-CG1 3.77Å; W82-V96 HydrophobicContact CZ3-CG1 4.01Å
83M82.4Confident79Confident135 Ų13562.6 Ų62.667%0.66534%0.337SS*.Hα-helixtrans-74.4-24.2-177.6-167.763.698.700112.8M79 D80M79-M83 WeakPolarHBondContact O-CB 3.27Å; M79-M83 PolarHBondContact O-N 2.94Å; D80-M83 PolarHBondContact O-N 3.08Å
84R81.9Confident79.2Confident5 Ų560.5 Ų60.52%0.01934%0.339CS..SBendtrans-49.3130.6178.6-179.9-178167.4-112.6-21.6112D80 E81 W82 R89 K91D80-R84 VanDerWaalsContact O-CB 3.27Å; D80-R84 WeakPolarHBondContact O-CB 3.27Å; D80-R84 PolarHBondContact O-N 3.27Å; E81-R84 IonicContact OE1-NH1 2.88Å; E81-R84 PolarHBondContact OE1-NH1 2.93Å; E81-R84 VanDerWaalsContact OE1-NH1 3.12Å; W82-R84 VanDerWaalsContact C-N 3.34Å; R84-R89 VanDerWaalsContact CZ-O 3.31Å; R84-R89 PolarHBondContact NH1-O 3.46Å; R84-R89 PolarHBondContact NH2-O 3.2Å; R84-K91 WeakPolarHBondContact O-CE 3.28Å; R84-K91 PolarHBondContact O-NZ 3.09Å
85P77.6Confident79.2Confident37 Ų3760.2 Ų60.224%0.2434%0.338CS..  trans-67.5156.8174.627.8-34.6000111.9G87 Y297 Y298P85-G87 PolarHBondContact O-N 2.88Å; P85-Y297 HydrophobicContact CG-CD1 4.45Å; P85-Y297 HydrophobicContact CG-CE1 4.32Å; P85-Y298 HydrophobicContact CB-CD1 4.2Å; P85-Y298 HydrophobicContact CG-CD1 3.63Å; P85-Y298 HydrophobicContact CG-CE1 4.16Å; P85-Y298 HydrophobicContact CG-CG 4.32Å
86V71.8Confident79.2Confident119 Ų11960.4 Ų60.472%0.72134%0.339SS*.  trans-74.483.2174.6-174.10000108.2
87G72.3Confident79.3Confident25 Ų2566.1 Ų66.126%0.25835%0.354SS..  trans-87.5-145.9172.200000111.8P85 R89 Y298P85-G87 PolarHBondContact O-N 2.88Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 3.37Å; G87-Y298 WeakPolarHBondContact CA-O 3.48Å
88N71.3Confident79.3Confident116 Ų11667.8 Ų67.862%0.6236%0.36SS*.SBendtrans-66.7-26.8-176.3-62.8-15.6000114.3E302N88-E302 HydrophobicContact CB-CG 4.33Å
89R76.1Confident79.3Confident10 Ų1066.8 Ų66.84%0.03836%0.355CS..SBendtrans-99.8120.1176.2-176-171.292.8176.46.8111.5E81 R84 G87 W218 E225 L303E81-R89 IonicContact OE1-CZ 3.91Å; E81-R89 IonicContact OE1-NH2 2.84Å; E81-R89 PolarHBondContact OE1-NH2 3.05Å; E81-R89 IonicContact OE2-NH2 2.87Å; E81-R89 PolarHBondContact OE2-NH2 3.26Å; R84-R89 VanDerWaalsContact CZ-O 3.31Å; R84-R89 PolarHBondContact NH1-O 3.46Å; R84-R89 PolarHBondContact NH2-O 3.2Å; G87-R89 VanDerWaalsContact C-N 3.31Å; G87-R89 PolarHBondContact O-N 3.37Å; R89-W218 VanDerWaalsContact CZ-CZ2 3.5Å; R89-E225 IonicContact CZ-OE2 3.08Å; R89-E225 IonicContact NH1-OE1 3.68Å; R89-E225 PolarHBondContact NH1-OE1 2.93Å; R89-E225 VanDerWaalsContact NH1-OE1 3.17Å; R89-E225 IonicContact NH1-OE2 2.69Å; R89-E225 PolarHBondContact NH1-OE2 3.12Å; R89-E225 IonicContact NH2-OE2 3.79Å; R89-L303 HydrophobicContact CG-CD1 4.48Å
90S74Confident79.4Confident93 Ų9366.5 Ų66.565%0.6535%0.351SS*.PPolyproline II helixtrans-65155179.865.40000113.2
91K75.6Confident79.5Confident77 Ų7764.9 Ų64.934%0.33535%0.346SS..PPolyproline II helixtrans-89.3122.3175.8-68.3-173.5178-176.30109.9W82 R84 P93W82-K91 PolarHBondContact O-NZ 3.22Å; R84-K91 WeakPolarHBondContact O-CE 3.28Å; R84-K91 PolarHBondContact O-NZ 3.09Å; K91-P93 VanDerWaalsContact O-CD 3.31Å; K91-P93 WeakPolarHBondContact O-CD 3.42Å
92N79.4Confident79.6Confident61 Ų6164.8 Ų64.833%0.32635%0.347SS..  trans-90.8108.5172.2-170.9-22.3000110.3A94 V95 V96N92-A94 PolarHBondContact O-N 3.43Å; N92-A94 WeakPolarHBondContact OD1-CB 3.4Å; N92-A94 PolarHBondContact OD1-N 3.27Å; N92-V95 HydrophobicContact CB-CG2 4.09Å; N92-V95 PolarHBondContact O-N 2.79Å; N92-V96 PolarHBondContact O-N 3.5Å
93P80.7Confident79.9Confident86 Ų8656.9 Ų56.956%0.55832%0.318SS*.Hα-helixtrans-65.7-25.2-177.427.6-35.3000113.1K91 V95 K97K91-P93 VanDerWaalsContact O-CD 3.31Å; K91-P93 WeakPolarHBondContact O-CD 3.42Å; P93-V95 VanDerWaalsContact C-N 3.29Å; P93-V95 PolarHBondContact O-N 2.86Å; P93-K97 WeakPolarHBondContact O-CB 3.48Å; P93-K97 VanDerWaalsContact O-CG 3.3Å; P93-K97 WeakPolarHBondContact O-CG 3.29Å; P93-K97 PolarHBondContact O-N 3.48Å
94A81.4Confident80.2Confident45 Ų4553.1 Ų53.137%0.37230%0.3SS..Hα-helixtrans-64.6-37.2177.300000111.4N92 K97 Y98N92-A94 PolarHBondContact O-N 3.43Å; N92-A94 WeakPolarHBondContact OD1-CB 3.4Å; N92-A94 PolarHBondContact OD1-N 3.27Å; A94-K97 PolarHBondContact O-N 2.93Å; A94-Y98 WeakPolarHBondContact O-CB 3.29Å; A94-Y98 PolarHBondContact O-N 3.39Å
95V79.8Confident80.5Confident2 Ų259.9 Ų59.91%0.01233%0.332CS..Hα-helixtrans-77-36.4-178.2-173.40000111.5N92 P93 Y98 L99 T215 W218 L222N92-V95 HydrophobicContact CB-CG2 4.09Å; N92-V95 PolarHBondContact O-N 2.79Å; P93-V95 VanDerWaalsContact C-N 3.29Å; P93-V95 PolarHBondContact O-N 2.86Å; V95-Y98 WeakPolarHBondContact O-CB 3.43Å; V95-Y98 PolarHBondContact O-N 2.99Å; V95-L99 HydrophobicContact CG1-CD1 4.37Å; V95-L99 WeakPolarHBondContact O-CG 3.41Å; V95-L99 PolarHBondContact O-N 3.3Å; V95-T215 HydrophobicContact CG2-CG2 4.01Å; V95-W218 HydrophobicContact CB-CG 4.4Å; V95-W218 HydrophobicContact CG1-CB 4.16Å; V95-W218 HydrophobicContact CG1-CG 4.2Å; V95-W218 HydrophobicContact CG2-CB 3.78Å; V95-W218 VanDerWaalsContact CG2-CD1 3.41Å; V95-W218 HydrophobicContact CG2-CG 3.85Å; V95-L222 HydrophobicContact CG1-CD1 4.18Å
96V82.5Confident80.9Confident23 Ų2359.7 Ų59.714%0.13933%0.326CS..Hα-helixtrans-61.3-45.5171.4177.40000110.8W82 N92 Y98 L99 F100W82-V96 HydrophobicContact CE3-CG1 3.77Å; W82-V96 HydrophobicContact CZ3-CG1 4.01Å; N92-V96 PolarHBondContact O-N 3.5Å; V96-Y98 VanDerWaalsContact C-N 3.32Å; V96-Y98 PolarHBondContact O-N 2.74Å; V96-L99 PolarHBondContact O-N 3.37Å; V96-F100 WeakPolarHBondContact O-CB 3.35Å; V96-F100 PolarHBondContact O-N 3.48Å
97K84.1Confident81.9Confident153 Ų15354.1 Ų54.167%0.66529%0.292SS*.Hα-helixtrans-60.9-41.1174.8-73.8175.1-179.4-179.30112P93 A94 F100 S101P93-K97 WeakPolarHBondContact O-CB 3.48Å; P93-K97 VanDerWaalsContact O-CG 3.3Å; P93-K97 WeakPolarHBondContact O-CG 3.29Å; P93-K97 PolarHBondContact O-N 3.48Å; A94-K97 PolarHBondContact O-N 2.93Å; K97-F100 PolarHBondContact O-N 3.31Å; K97-S101 WeakPolarHBondContact O-CB 3.42Å; K97-S101 PolarHBondContact O-N 3.1Å; K97-S101 PolarHBondContact O-OG 3.27Å
98Y83Confident82.9Confident41 Ų4156 Ų5616%0.16130%0.297CS..Hα-helixtrans-61.6-50.2176179-95.2000111.4A94 V95 V96 F100 S101 A102 F212 T215A94-Y98 WeakPolarHBondContact O-CB 3.29Å; A94-Y98 PolarHBondContact O-N 3.39Å; V95-Y98 WeakPolarHBondContact O-CB 3.43Å; V95-Y98 PolarHBondContact O-N 2.99Å; V96-Y98 VanDerWaalsContact C-N 3.32Å; V96-Y98 PolarHBondContact O-N 2.74Å; Y98-F100 VanDerWaalsContact C-N 3.34Å; Y98-F100 PolarHBondContact O-N 3.14Å; Y98-S101 PolarHBondContact O-N 3.4Å; Y98-S101 PolarHBondContact O-OG 3.19Å; Y98-A102 WeakPolarHBondContact O-CB 3.38Å; Y98-A102 PolarHBondContact O-N 2.8Å; Y98-F212 HydrophobicContact CE2-CE2 4.02Å; Y98-T215 HydrophobicContact CD1-CG2 4.48Å; Y98-T215 HydrophobicContact CD2-CG2 4.24Å; Y98-T215 HydrophobicContact CG-CG2 3.88Å
99L83Confident83.9Confident0 Ų054 Ų540%029%0.285CS..Hα-helixtrans-57.5-44.8176.5-75.8168.9000111.9H74 M78 V95 V96 A102 M103 S219 L222H74-L99 HydrophobicContact CB-CD2 4.43Å; H74-L99 WeakPolarHBondContact ND1-CD2 3.36Å; M78-L99 HydrophobicContact CB-CB 4.46Å; V95-L99 HydrophobicContact CG1-CD1 4.37Å; V95-L99 WeakPolarHBondContact O-CG 3.41Å; V95-L99 PolarHBondContact O-N 3.3Å; V96-L99 PolarHBondContact O-N 3.37Å; L99-A102 PolarHBondContact O-N 2.76Å; L99-M103 VanDerWaalsContact O-CB 3.29Å; L99-M103 WeakPolarHBondContact O-CB 3.49Å; L99-M103 PolarHBondContact O-N 3.18Å; L99-S219 VanDerWaalsContact CD2-OG 3.23Å; L99-S219 WeakPolarHBondContact CD2-OG 3.42Å; L99-L222 HydrophobicContact CD1-CD1 4.05Å
100F85.9Confident84.7Confident102 Ų10253.6 Ų53.645%0.44728%0.284SS..Hα-helixtrans-62.6-45.9176.7-179.4-100.4000112.2M78 V96 K97 Y98 M103 L104M78-F100 HydrophobicContact CE-CD2 4.47Å; M78-F100 HydrophobicContact SD-CB 3.91Å; M78-F100 HydrophobicContact SD-CD2 3.74Å; M78-F100 HydrophobicContact SD-CG 4.33Å; V96-F100 WeakPolarHBondContact O-CB 3.35Å; V96-F100 PolarHBondContact O-N 3.48Å; K97-F100 PolarHBondContact O-N 3.31Å; Y98-F100 VanDerWaalsContact C-N 3.34Å; Y98-F100 PolarHBondContact O-N 3.14Å; F100-M103 HydrophobicContact CD2-CE 3.76Å; F100-M103 HydrophobicContact CE2-CE 3.76Å; F100-M103 WeakPolarHBondContact O-CB 3.49Å; F100-M103 PolarHBondContact O-N 3.22Å; F100-L104 HydrophobicContact CE1-CD2 4.47Å; F100-L104 WeakPolarHBondContact O-CB 3.23Å; F100-L104 PolarHBondContact O-N 2.9Å
101S84.4Confident85.8Confident47 Ų4749.6 Ų49.633%0.32926%0.256SS..Hα-helixtrans-64.8-40.7178.468.60000112.2K97 Y98 L104 Q105K97-S101 WeakPolarHBondContact O-CB 3.42Å; K97-S101 PolarHBondContact O-N 3.1Å; K97-S101 PolarHBondContact O-OG 3.27Å; Y98-S101 PolarHBondContact O-N 3.4Å; Y98-S101 PolarHBondContact O-OG 3.19Å; S101-L104 PolarHBondContact O-N 3.13Å; S101-Q105 WeakPolarHBondContact O-CB 3.43Å; S101-Q105 VanDerWaalsContact O-CG 3.25Å; S101-Q105 WeakPolarHBondContact O-CG 3.43Å; S101-Q105 PolarHBondContact O-N 3Å
102A82.5Confident86.7Confident9 Ų948.8 Ų48.87%0.07425%0.254CS..Hα-helixtrans-64.9-40.7175.300000111.5Y98 L99 R106Y98-A102 WeakPolarHBondContact O-CB 3.38Å; Y98-A102 PolarHBondContact O-N 2.8Å; L99-A102 PolarHBondContact O-N 2.76Å; A102-R106 WeakPolarHBondContact O-CG 3.34Å; A102-R106 PolarHBondContact O-N 2.86Å
103M87.9Confident87.5Confident9 Ų947.6 Ų47.64%0.04425%0.249CC..Hα-helixtrans-60.5-49.9174.3179.5-155.773.600111.1V69 N72 T75 M78 L99 F100 R106 A107V69-M103 HydrophobicContact CG1-SD 4.2Å; V69-M103 HydrophobicContact CG2-CE 4.44Å; N72-M103 HydrophobicContact CB-CG 4.49Å; N72-M103 WeakPolarHBondContact ND2-CA 3.44Å; T75-M103 HydrophobicContact CG2-SD 4.12Å; T75-M103 VanDerWaalsContact OG1-CG 3.24Å; T75-M103 WeakPolarHBondContact OG1-CG 3.31Å; T75-M103 PolarHBondContact OG1-SD 3.22Å; M78-M103 HydrophobicContact CE-SD 4.35Å; M78-M103 HydrophobicContact SD-SD 4.37Å; L99-M103 VanDerWaalsContact O-CB 3.29Å; L99-M103 WeakPolarHBondContact O-CB 3.49Å; L99-M103 PolarHBondContact O-N 3.18Å; F100-M103 HydrophobicContact CD2-CE 3.76Å; F100-M103 HydrophobicContact CE2-CE 3.76Å; F100-M103 WeakPolarHBondContact O-CB 3.49Å; F100-M103 PolarHBondContact O-N 3.22Å; M103-R106 PolarHBondContact O-N 3.42Å; M103-A107 WeakPolarHBondContact O-CB 3.49Å; M103-A107 PolarHBondContact O-N 3.5Å
104L89.9Confident88.2Confident55 Ų5544.1 Ų44.129%0.28823%0.225SC..Hα-helixtrans-63.5-44.7-177.2-169.573000111.8F65 F100 S101 R106 A107 L108F65-L104 HydrophobicContact CE2-CD1 3.63Å; F65-L104 HydrophobicContact CZ-CD1 3.79Å; F100-L104 HydrophobicContact CE1-CD2 4.47Å; F100-L104 WeakPolarHBondContact O-CB 3.23Å; F100-L104 PolarHBondContact O-N 2.9Å; S101-L104 PolarHBondContact O-N 3.13Å; L104-R106 VanDerWaalsContact C-N 3.27Å; L104-R106 PolarHBondContact O-N 3.26Å; L104-A107 PolarHBondContact O-N 2.85Å; L104-L108 HydrophobicContact CD1-CD1 4.18Å; L104-L108 HydrophobicContact CD1-CG 4.32Å; L104-L108 HydrophobicContact CD2-CD1 4.26Å; L104-L108 HydrophobicContact CG-CD1 3.74Å; L104-L108 HydrophobicContact CG-CG 4.25Å; L104-L108 WeakPolarHBondContact O-CB 3.39Å; L104-L108 VanDerWaalsContact O-CG 3.28Å; L104-L108 WeakPolarHBondContact O-CG 3.21Å; L104-L108 PolarHBondContact O-N 3.27Å
105Q86.5Confident88.9Confident147 Ų14743.7 Ų43.769%0.68722%0.216SC*.Hα-helixtrans-57.1-40.4177.5-77.2175.1-600112.3S101S101-Q105 WeakPolarHBondContact O-CB 3.43Å; S101-Q105 VanDerWaalsContact O-CG 3.25Å; S101-Q105 WeakPolarHBondContact O-CG 3.43Å; S101-Q105 PolarHBondContact O-N 3Å
106R87.3Confident89.7Confident34 Ų3444.6 Ų44.613%0.12822%0.22CC..Hα-helixtrans-74.1-45.2179-68.9-177.8-163.2172.78.6112E17 S20 N21 H74 A102 M103 L104 L108 L109E17-R106 IonicContact OE1-NH2 3.87Å; S20-R106 PolarHBondContact OG-NH1 2.97Å; N21-R106 WeakPolarHBondContact OD1-CD 3.26Å; N21-R106 PolarHBondContact OD1-NE 3.16Å; H74-R106 PolarHBondContact CD2-NH1 2.82Å; H74-R106 PolarHBondContact NE2-NH1 3.2Å; H74-R106 PolarHBondContact NE2-NH2 3.12Å; A102-R106 WeakPolarHBondContact O-CG 3.34Å; A102-R106 PolarHBondContact O-N 2.86Å; M103-R106 PolarHBondContact O-N 3.42Å; L104-R106 VanDerWaalsContact C-N 3.27Å; L104-R106 PolarHBondContact O-N 3.26Å; R106-L108 VanDerWaalsContact C-N 3.31Å; R106-L108 PolarHBondContact O-N 2.92Å; R106-L109 WeakPolarHBondContact O-CB 3.3Å; R106-L109 PolarHBondContact O-N 3.34Å
107A91.8Very high90.3Very high1 Ų145.2 Ų45.21%0.00822%0.224CC..Hα-helixtrans-67-29.7-178.900000113.3F65 V69 M103 L104 L109 P111F65-A107 HydrophobicContact CD2-CB 4.16Å; F65-A107 HydrophobicContact CE2-CB 4.12Å; V69-A107 HydrophobicContact CG2-CB 3.77Å; M103-A107 WeakPolarHBondContact O-CB 3.49Å; M103-A107 PolarHBondContact O-N 3.5Å; L104-A107 PolarHBondContact O-N 2.85Å; A107-L109 VanDerWaalsContact C-N 3.32Å; A107-L109 PolarHBondContact O-N 3.47Å; A107-P111 WeakPolarHBondContact O-CD 3.34Å; A107-P111 WeakPolarHBondContact O-CG 3.35Å
108L93.2Very high90.8Very high66 Ų6638 Ų3835%0.34619%0.193SC..THydrogen-bonded Turntrans-76.7-13.7178.6-74.6174.1000114.1F65 L104 R106 A110 P111 M112F65-L108 HydrophobicContact CD2-CD2 3.73Å; F65-L108 HydrophobicContact CD2-CG 4.27Å; F65-L108 HydrophobicContact CE2-CD2 3.88Å; F65-L108 HydrophobicContact CE2-CG 4.15Å; L104-L108 HydrophobicContact CD1-CD1 4.18Å; L104-L108 HydrophobicContact CD1-CG 4.32Å; L104-L108 HydrophobicContact CD2-CD1 4.26Å; L104-L108 HydrophobicContact CG-CD1 3.74Å; L104-L108 HydrophobicContact CG-CG 4.25Å; L104-L108 WeakPolarHBondContact O-CB 3.39Å; L104-L108 VanDerWaalsContact O-CG 3.28Å; L104-L108 WeakPolarHBondContact O-CG 3.21Å; L104-L108 PolarHBondContact O-N 3.27Å; R106-L108 VanDerWaalsContact C-N 3.31Å; R106-L108 PolarHBondContact O-N 2.92Å; L108-A110 PolarHBondContact O-N 2.9Å; L108-P111 WeakPolarHBondContact O-CD 3.32Å; L108-M112 HydrophobicContact CB-CG 4.49Å; L108-M112 WeakPolarHBondContact O-CB 3.43Å; L108-M112 WeakPolarHBondContact O-CG 3.26Å; L108-M112 PolarHBondContact O-N 3.3Å
109L92.2Very high91.5Very high73 Ų7336.4 Ų36.438%0.38219%0.187SC..Hα-helixtrans-58-54.7-175.6-177.265000112.7C24 A28 R106 A107 M112 V113C24-L109 HydrophobicContact CB-CD2 4.4Å; A28-L109 HydrophobicContact CB-CD2 4.43Å; A28-L109 HydrophobicContact CB-CG 4.3Å; R106-L109 WeakPolarHBondContact O-CB 3.3Å; R106-L109 PolarHBondContact O-N 3.34Å; A107-L109 VanDerWaalsContact C-N 3.32Å; A107-L109 PolarHBondContact O-N 3.47Å; L109-M112 PolarHBondContact O-N 3.22Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.09Å; L109-V113 PolarHBondContact O-N 3.47Å
110A94.3Very high92Very high2 Ų238.8 Ų38.82%0.01720%0.2CC..Hα-helixtrans-64.8-43.6-179.300000113.6L27 A28 F64 L108 M112 V113 W114L27-A110 HydrophobicContact CB-CB 4.16Å; L27-A110 HydrophobicContact CD2-CB 3.97Å; L27-A110 HydrophobicContact CG-CB 3.78Å; A28-A110 HydrophobicContact CB-CB 4.22Å; F64-A110 HydrophobicContact CB-CB 4.17Å; F64-A110 HydrophobicContact CG-CB 4.43Å; L108-A110 PolarHBondContact O-N 2.9Å; A110-M112 PolarHBondContact O-N 3.03Å; A110-V113 PolarHBondContact O-N 3.16Å; A110-W114 PolarHBondContact O-N 2.96Å
111P96.3Very high92.4Very high8 Ų836.3 Ų36.35%0.05219%0.191CC..Hα-helixtrans-52.7-47.4169.5-29.334.3000113.6P61 F64 F65 A107 L108 W114 I115P61-P111 HydrophobicContact CB-CB 3.94Å; P61-P111 WeakPolarHBondContact O-CG 3.42Å; F64-P111 HydrophobicContact CB-CG 4.11Å; F65-P111 HydrophobicContact CB-CG 3.8Å; A107-P111 WeakPolarHBondContact O-CD 3.34Å; A107-P111 WeakPolarHBondContact O-CG 3.35Å; L108-P111 WeakPolarHBondContact O-CD 3.32Å; P111-W114 WeakPolarHBondContact O-CB 3.08Å; P111-W114 PolarHBondContact O-N 2.56Å; P111-I115 WeakPolarHBondContact O-CG1 3.16Å; P111-I115 PolarHBondContact O-N 2.83Å
112M95.1Very high92.8Very high61 Ų6134 Ų3430%0.318%0.175SC..Hα-helixtrans-66.9-40.2-179-67.7-55.8-6800111.8L108 L109 A110 W114 I115 L116 I188 L192L108-M112 HydrophobicContact CB-CG 4.49Å; L108-M112 WeakPolarHBondContact O-CB 3.43Å; L108-M112 WeakPolarHBondContact O-CG 3.26Å; L108-M112 PolarHBondContact O-N 3.3Å; L109-M112 PolarHBondContact O-N 3.22Å; A110-M112 PolarHBondContact O-N 3.03Å; M112-W114 VanDerWaalsContact C-N 3.35Å; M112-W114 PolarHBondContact O-N 3.08Å; M112-I115 PolarHBondContact O-N 3.27Å; M112-L116 WeakPolarHBondContact O-CB 3.49Å; M112-L116 WeakPolarHBondContact O-CG 3.27Å; M112-L116 PolarHBondContact O-N 2.88Å; M112-I188 HydrophobicContact CE-CG2 4.16Å; M112-L192 HydrophobicContact CE-CD1 3.61Å; M112-L192 HydrophobicContact CE-CD2 3.89Å; M112-L192 HydrophobicContact CE-CG 4.23Å
113V95.1Very high93.3Very high36 Ų3638.6 Ų38.622%0.21819%0.193CC..Hα-helixtrans-61.2-43.6174.4170.80000111A28 V32 L109 A110 L116 V117A28-V113 HydrophobicContact CB-CG2 4.23Å; V32-V113 HydrophobicContact CG2-CG1 3.5Å; L109-V113 VanDerWaalsContact O-CG2 3.31Å; L109-V113 WeakPolarHBondContact O-CG2 3.09Å; L109-V113 PolarHBondContact O-N 3.47Å; A110-V113 PolarHBondContact O-N 3.16Å; V113-L116 PolarHBondContact O-N 3.44Å; V113-V117 HydrophobicContact CG1-CG2 4.26Å; V113-V117 WeakPolarHBondContact O-CB 3.43Å; V113-V117 VanDerWaalsContact O-CG2 3.26Å; V113-V117 WeakPolarHBondContact O-CG2 3.3Å; V113-V117 PolarHBondContact O-N 2.93Å
114W96.1Very high93.6Very high12 Ų1238.2 Ų38.25%0.04519%0.191CC..Hα-helixtrans-58.1-51.3176-179.2-83.1000111.5S31 L34 Y35 V56 P60 P61 F64 A110 P111 M112 L116 V117 T118S31-W114 WeakPolarHBondContact O-CZ3 3.46Å; L34-W114 HydrophobicContact CB-CZ3 4.14Å; Y35-W114 HydrophobicContact CD2-CH2 4.22Å; Y35-W114 HydrophobicContact CD2-CZ2 4.15Å; V56-W114 PolarHBondContact O-NE1 2.86Å; P60-W114 HydrophobicContact CB-CD2 3.98Å; P60-W114 HydrophobicContact CB-CE3 4.37Å; P60-W114 HydrophobicContact CB-CH2 3.99Å; P60-W114 HydrophobicContact CB-CZ2 3.57Å; P60-W114 HydrophobicContact CB-CZ3 4.36Å; P60-W114 HydrophobicContact CG-CH2 4.17Å; P60-W114 HydrophobicContact CG-CZ2 3.5Å; P61-W114 VanDerWaalsContact CD-CD1 3.42Å; P61-W114 HydrophobicContact CG-CB 4.15Å; P61-W114 HydrophobicContact CG-CG 3.87Å; F64-W114 HydrophobicContact CD2-CE3 4.42Å; F64-W114 HydrophobicContact CE2-CD2 4.25Å; F64-W114 AromaticContact CE2-CE3 3.61Å; F64-W114 HydrophobicContact CE2-CE3 3.61Å; F64-W114 AromaticContact CE2-CZ3 3.97Å; F64-W114 HydrophobicContact CE2-CZ3 3.97Å; F64-W114 HydrophobicContact CZ-CE3 4.44Å; A110-W114 PolarHBondContact O-N 2.96Å; P111-W114 WeakPolarHBondContact O-CB 3.08Å; P111-W114 PolarHBondContact O-N 2.56Å; M112-W114 VanDerWaalsContact C-N 3.35Å; M112-W114 PolarHBondContact O-N 3.08Å; W114-L116 PolarHBondContact O-N 3.22Å; W114-V117 PolarHBondContact O-N 3.04Å; W114-T118 HydrophobicContact CD2-CG2 4.42Å; W114-T118 HydrophobicContact CG-CG2 4.25Å; W114-T118 WeakPolarHBondContact O-CG2 3.14Å; W114-T118 PolarHBondContact O-N 3.4Å; W114-T118 PolarHBondContact O-OG1 3.18Å
115I96.4Very high93.8Very high37 Ų3736.6 Ų36.619%0.1918%0.182CC..Hα-helixtrans-57.3-49178.6-67.1-65.5000110.9M57 P61 P111 M112 V117 T118 L119M57-I115 HydrophobicContact CG-CD1 3.91Å; M57-I115 WeakPolarHBondContact O-CD1 3.38Å; P61-I115 HydrophobicContact CG-CD1 3.81Å; P61-I115 HydrophobicContact CG-CG1 4Å; P111-I115 WeakPolarHBondContact O-CG1 3.16Å; P111-I115 PolarHBondContact O-N 2.83Å; M112-I115 PolarHBondContact O-N 3.27Å; I115-V117 PolarHBondContact O-N 3.45Å; I115-T118 PolarHBondContact O-N 3.39Å; I115-T118 PolarHBondContact O-OG1 3.44Å; I115-L119 HydrophobicContact CG2-CD1 3.71Å; I115-L119 HydrophobicContact CG2-CG 4.34Å; I115-L119 WeakPolarHBondContact O-CB 3.4Å; I115-L119 WeakPolarHBondContact O-CG 3.13Å; I115-L119 PolarHBondContact O-N 2.88Å
116L96.4Very high94.1Very high20 Ų2029.9 Ų29.911%0.10515%0.151CC..Hα-helixtrans-58.3-48.1178.9-76.8170.2000112.2M112 V113 W114 T118 L119 L120 G185 I188 L189 L192M112-L116 WeakPolarHBondContact O-CB 3.49Å; M112-L116 WeakPolarHBondContact O-CG 3.27Å; M112-L116 PolarHBondContact O-N 2.88Å; V113-L116 PolarHBondContact O-N 3.44Å; W114-L116 PolarHBondContact O-N 3.22Å; L116-T118 VanDerWaalsContact C-N 3.34Å; L116-T118 PolarHBondContact O-N 2.97Å; L116-L119 PolarHBondContact O-N 3.45Å; L116-L120 WeakPolarHBondContact O-CB 3.35Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.4Å; L116-G185 VanDerWaalsContact CD2-O 3.3Å; L116-G185 WeakPolarHBondContact CD2-O 3.36Å; L116-I188 HydrophobicContact CD2-CB 4.11Å; L116-I188 HydrophobicContact CD2-CG2 3.9Å; L116-L189 HydrophobicContact CD1-CD1 4.09Å; L116-L189 HydrophobicContact CD2-CB 3.93Å; L116-L192 HydrophobicContact CD1-CD1 4.15Å
117V95.2Very high94.4Very high37 Ų3728.2 Ų28.222%0.22415%0.145CC..Hα-helixtrans-62.5-43.6179.4171.80000110.9V32 Y35 V113 W114 I115 L119 L120 D121V32-V117 HydrophobicContact CG2-CG2 4.23Å; Y35-V117 HydrophobicContact CD1-CG1 3.21Å; Y35-V117 HydrophobicContact CE1-CG1 3.51Å; Y35-V117 HydrophobicContact CG-CG1 3.78Å; V113-V117 HydrophobicContact CG1-CG2 4.26Å; V113-V117 WeakPolarHBondContact O-CB 3.43Å; V113-V117 VanDerWaalsContact O-CG2 3.26Å; V113-V117 WeakPolarHBondContact O-CG2 3.3Å; V113-V117 PolarHBondContact O-N 2.93Å; W114-V117 PolarHBondContact O-N 3.04Å; I115-V117 PolarHBondContact O-N 3.45Å; V117-L119 VanDerWaalsContact C-N 3.34Å; V117-L119 PolarHBondContact O-N 3.44Å; V117-L120 PolarHBondContact O-N 3.35Å; V117-D121 PolarHBondContact O-N 2.87Å
118T95.1Very high94.5Very high1 Ų128.4 Ų28.41%0.00615%0.146CC..Hα-helixtrans-64.2-37.4179.166.40000112.7Y35 W114 I115 L116 G122 I124Y35-T118 HydrophobicContact CD2-CG2 3.69Å; Y35-T118 HydrophobicContact CE2-CG2 3.44Å; Y35-T118 VanDerWaalsContact CE2-CG2 3.44Å; W114-T118 HydrophobicContact CD2-CG2 4.42Å; W114-T118 HydrophobicContact CG-CG2 4.25Å; W114-T118 WeakPolarHBondContact O-CG2 3.14Å; W114-T118 PolarHBondContact O-N 3.4Å; W114-T118 PolarHBondContact O-OG1 3.18Å; I115-T118 PolarHBondContact O-N 3.39Å; I115-T118 PolarHBondContact O-OG1 3.44Å; L116-T118 VanDerWaalsContact C-N 3.34Å; L116-T118 PolarHBondContact O-N 2.97Å; T118-G122 PolarHBondContact O-N 3.44Å; T118-I124 HydrophobicContact CG2-CD1 3.99Å
119L95.9Very high94.5Very high8 Ų828.1 Ų28.14%0.04214%0.142CC..Hα-helixtrans-72.4-39.3177.1-73172.2000112.1M57 I115 L116 V117 G122 F125 S181 V184 I188M57-L119 HydrophobicContact SD-CD2 4.45Å; I115-L119 HydrophobicContact CG2-CD1 3.71Å; I115-L119 HydrophobicContact CG2-CG 4.34Å; I115-L119 WeakPolarHBondContact O-CB 3.4Å; I115-L119 WeakPolarHBondContact O-CG 3.13Å; I115-L119 PolarHBondContact O-N 2.88Å; L116-L119 PolarHBondContact O-N 3.45Å; V117-L119 VanDerWaalsContact C-N 3.34Å; V117-L119 PolarHBondContact O-N 3.44Å; L119-G122 PolarHBondContact O-N 3.42Å; L119-F125 HydrophobicContact CD2-CD2 3.72Å; L119-F125 HydrophobicContact CD2-CE2 4.2Å; L119-S181 CarbonylContact O-C 3.54Å; L119-S181 WeakPolarHBondContact O-CB 3.32Å; L119-S181 PolarHBondContact O-OG 3.31Å; L119-V184 HydrophobicContact CD1-CG1 4.3Å; L119-I188 HydrophobicContact CD1-CD1 3.69Å
120L94.9Very high94.3Very high49 Ų4924.7 Ų24.726%0.25712%0.124SC..Hα-helixtrans-72.3-36.7-179.3-70.3173000112.6L116 V117 Q182 W186L116-L120 WeakPolarHBondContact O-CB 3.35Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.4Å; V117-L120 PolarHBondContact O-N 3.35Å; L120-Q182 WeakPolarHBondContact O-CG 3.06Å; L120-Q182 PolarHBondContact O-NE2 3.47Å; L120-W186 HydrophobicContact CD2-CD2 4.22Å; L120-W186 HydrophobicContact CD2-CG 4.14Å
121D93.8Very high94Very high50 Ų5026.6 Ų26.627%0.26714%0.136SC..Hα-helixtrans-71.3-37.8170.8-173.251.1000111.4Y35 V117 K123Y35-D121 HydrophobicContact CE1-CB 4.03Å; Y35-D121 WeakPolarHBondContact OH-CB 3.25Å; Y35-D121 PolarHBondContact OH-OD2 3.02Å; V117-D121 PolarHBondContact O-N 2.87Å; D121-K123 VanDerWaalsContact CG-NZ 3.31Å; D121-K123 PolarHBondContact O-N 3.26Å; D121-K123 VanDerWaalsContact O-N 3.11Å; D121-K123 WeakPolarHBondContact OD1-CE 3.41Å; D121-K123 IonicContact OD1-NZ 3.28Å; D121-K123 PolarHBondContact OD1-NZ 2.92Å; D121-K123 WeakPolarHBondContact OD2-CD 3.37Å; D121-K123 VanDerWaalsContact OD2-CE 3.24Å; D121-K123 WeakPolarHBondContact OD2-CE 3.32Å; D121-K123 VanDerWaalsContact OD2-CG 3.22Å; D121-K123 WeakPolarHBondContact OD2-CG 3.44Å; D121-K123 IonicContact OD2-NZ 3.76Å; D121-K123 PolarHBondContact OD2-NZ 3.21Å
122G93Very high93.5Very high0 Ų030.1 Ų30.10%016%0.161CC..  trans73.7-4169.400000115.7T118 L119 I124 F125 I126T118-G122 PolarHBondContact O-N 3.44Å; L119-G122 PolarHBondContact O-N 3.42Å; G122-I124 PolarHBondContact O-N 3.46Å; G122-F125 PolarHBondContact O-N 3.04Å; G122-I126 WeakPolarHBondContact O-CD1 3.16Å; G122-I126 WeakPolarHBondContact O-CG1 3.33Å; G122-I126 PolarHBondContact O-N 3.43Å
123K92.9Very high93.1Very high104 Ų10428.4 Ų28.445%0.45215%0.153SC..Hα-helixtrans-59.5-45.2179.5-64.2-178.9-162.6119.10112.6F40 D121 I126 C127F40-K123 HydrophobicContact CD1-CB 4.39Å; D121-K123 VanDerWaalsContact CG-NZ 3.31Å; D121-K123 PolarHBondContact O-N 3.26Å; D121-K123 VanDerWaalsContact O-N 3.11Å; D121-K123 WeakPolarHBondContact OD1-CE 3.41Å; D121-K123 IonicContact OD1-NZ 3.28Å; D121-K123 PolarHBondContact OD1-NZ 2.92Å; D121-K123 WeakPolarHBondContact OD2-CD 3.37Å; D121-K123 VanDerWaalsContact OD2-CE 3.24Å; D121-K123 WeakPolarHBondContact OD2-CE 3.32Å; D121-K123 VanDerWaalsContact OD2-CG 3.22Å; D121-K123 WeakPolarHBondContact OD2-CG 3.44Å; D121-K123 IonicContact OD2-NZ 3.76Å; D121-K123 PolarHBondContact OD2-NZ 3.21Å; K123-I126 PolarHBondContact O-N 2.82Å; K123-C127 PolarHBondContact O-N 3.45Å; K123-C127 VanDerWaalsContact O-N 3.12Å
124I93.9Very high92.5Very high1 Ų131.8 Ų31.81%0.00517%0.17CC..Hα-helixtrans-65.4-42.8177.7-62.6172.2000110.2Y35 F40 S53 V56 M57 T118 G122 I126 C127 A128Y35-I124 HydrophobicContact CE2-CD1 3.81Å; F40-I124 HydrophobicContact CD1-CG1 4.09Å; F40-I124 HydrophobicContact CD2-CD1 4.47Å; F40-I124 HydrophobicContact CD2-CG1 3.85Å; F40-I124 HydrophobicContact CE1-CG1 4.17Å; F40-I124 HydrophobicContact CE2-CG1 3.91Å; F40-I124 HydrophobicContact CG-CG1 3.92Å; F40-I124 HydrophobicContact CZ-CB 4.4Å; F40-I124 HydrophobicContact CZ-CG1 4.08Å; S53-I124 WeakPolarHBondContact CB-O 3.5Å; S53-I124 VanDerWaalsContact O-CG2 3.22Å; S53-I124 WeakPolarHBondContact O-CG2 3.35Å; V56-I124 HydrophobicContact CB-CD1 4.44Å; V56-I124 HydrophobicContact CG1-CD1 3.65Å; V56-I124 HydrophobicContact CG1-CG1 4.48Å; M57-I124 HydrophobicContact CB-CG2 4.24Å; T118-I124 HydrophobicContact CG2-CD1 3.99Å; G122-I124 PolarHBondContact O-N 3.46Å; I124-I126 PolarHBondContact O-N 3.41Å; I124-C127 PolarHBondContact O-N 3.22Å; I124-A128 PolarHBondContact O-N 3.27Å
125F94.8Very high91.6Very high21 Ų2133 Ų339%0.09218%0.179CC..Hα-helixtrans-64-41178.7-164.4-86000112.2L119 G122 A128 F129 V177 Y180 S181L119-F125 HydrophobicContact CD2-CD2 3.72Å; L119-F125 HydrophobicContact CD2-CE2 4.2Å; G122-F125 PolarHBondContact O-N 3.04Å; F125-A128 PolarHBondContact O-N 2.95Å; F125-F129 HydrophobicContact CD1-CB 4.47Å; F125-F129 AromaticContact CD1-CD2 3.82Å; F125-F129 HydrophobicContact CD1-CD2 3.82Å; F125-F129 AromaticContact CD2-CD2 3.73Å; F125-F129 HydrophobicContact CD2-CD2 3.73Å; F125-F129 AromaticContact CD2-CE2 3.75Å; F125-F129 HydrophobicContact CD2-CE2 3.75Å; F125-F129 HydrophobicContact CE1-CB 4.18Å; F125-F129 AromaticContact CE1-CD2 3.62Å; F125-F129 HydrophobicContact CE1-CD2 3.62Å; F125-F129 HydrophobicContact CE1-CE2 4.33Å; F125-F129 HydrophobicContact CE1-CG 4.1Å; F125-F129 AromaticContact CE2-CD2 3.53Å; F125-F129 HydrophobicContact CE2-CD2 3.53Å; F125-F129 AromaticContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CZ 4.35Å; F125-F129 AromaticContact CG-CD2 3.87Å; F125-F129 HydrophobicContact CG-CD2 3.87Å; F125-F129 HydrophobicContact CG-CE2 4.35Å; F125-F129 AromaticContact CZ-CD2 3.47Å; F125-F129 HydrophobicContact CZ-CD2 3.47Å; F125-F129 VanDerWaalsContact CZ-CD2 3.47Å; F125-F129 AromaticContact CZ-CE2 3.72Å; F125-F129 HydrophobicContact CZ-CE2 3.72Å; F125-F129 HydrophobicContact CZ-CG 4.12Å; F125-F129 WeakPolarHBondContact O-CD2 3.34Å; F125-F129 PolarHBondContact O-N 3.02Å; F125-V177 HydrophobicContact CD1-CG1 3.69Å; F125-V177 HydrophobicContact CE1-CG1 4.03Å; F125-Y180 AromaticContact CE1-CD1 3.8Å; F125-Y180 HydrophobicContact CE1-CD1 3.8Å; F125-Y180 HydrophobicContact CE1-CE1 4.5Å; F125-Y180 AromaticContact CZ-CD1 3.77Å; F125-Y180 HydrophobicContact CZ-CD1 3.77Å; F125-Y180 HydrophobicContact CZ-CE1 4.06Å; F125-S181 WeakPolarHBondContact CB-OG 3.37Å; F125-S181 WeakPolarHBondContact CG-OG 3.32Å
126I93.3Very high90.6Very high6 Ų634.1 Ų34.13%0.03120%0.201CC..Hα-helixtrans-60.4-46.7174.3-64.2157.9000110.7G122 K123 I124 A128 S130 P157 V177 R178G122-I126 WeakPolarHBondContact O-CD1 3.16Å; G122-I126 WeakPolarHBondContact O-CG1 3.33Å; G122-I126 PolarHBondContact O-N 3.43Å; K123-I126 PolarHBondContact O-N 2.82Å; I124-I126 PolarHBondContact O-N 3.41Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 3.3Å; I126-S130 WeakPolarHBondContact O-CB 3.46Å; I126-S130 PolarHBondContact O-N 2.97Å; I126-S130 PolarHBondContact O-OG 2.79Å; I126-P157 HydrophobicContact CG2-CB 4.29Å; I126-V177 HydrophobicContact CB-CG1 4.32Å; I126-V177 HydrophobicContact CG1-CB 4.19Å; I126-V177 HydrophobicContact CG1-CG1 3.94Å; I126-R178 HydrophobicContact CD1-CB 4.05Å; I126-R178 HydrophobicContact CG1-CB 4.49Å
127C93.5Very high89.8Confident0 Ų038.2 Ų38.20%022%0.222CC..Hα-helixtrans-62-40.4177.2-177.70000111.3F40 C42 N49 S53 K123 I124 P157F40-C127 HydrophobicContact CE1-CB 3.84Å; F40-C127 HydrophobicContact CZ-CB 3.72Å; C42-C127 HydrophobicContact CB-CB 3.82Å; C42-C127 WeakPolarHBondContact CB-SG 3.39Å; C42-C127 WeakPolarHBondContact SG-CB 3.35Å; C42-C127 CovalentContact SG-SG 2.03Å; C42-C127 PolarHBondContact SG-SG 3.49Å; N49-C127 WeakPolarHBondContact CB-O 3.28Å; S53-C127 WeakPolarHBondContact OG-CB 3.3Å; S53-C127 PolarHBondContact OG-SG 3.48Å; K123-C127 PolarHBondContact O-N 3.45Å; K123-C127 VanDerWaalsContact O-N 3.12Å; I124-C127 PolarHBondContact O-N 3.22Å; C127-P157 HydrophobicContact CB-CB 4.31Å; C127-P157 HydrophobicContact CB-CG 4.41Å
128A94.1Very high89.1Confident5 Ų537.8 Ų37.84%0.04122%0.217CC..Hα-helixtrans-67.2-42.818000000114.4S53 I124 F125 I126S53-A128 PolarHBondContact OG-N 3.15Å; I124-A128 PolarHBondContact O-N 3.27Å; F125-A128 PolarHBondContact O-N 2.95Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 3.3Å
129F92.3Very high88Confident60 Ų6042.7 Ų42.726%0.26325%0.252SS..Hα-helixtrans-113-6.2-165.1-68.7-76.1000114.9F125 V131 S132 V133F125-F129 HydrophobicContact CD1-CB 4.47Å; F125-F129 AromaticContact CD1-CD2 3.82Å; F125-F129 HydrophobicContact CD1-CD2 3.82Å; F125-F129 AromaticContact CD2-CD2 3.73Å; F125-F129 HydrophobicContact CD2-CD2 3.73Å; F125-F129 AromaticContact CD2-CE2 3.75Å; F125-F129 HydrophobicContact CD2-CE2 3.75Å; F125-F129 HydrophobicContact CE1-CB 4.18Å; F125-F129 AromaticContact CE1-CD2 3.62Å; F125-F129 HydrophobicContact CE1-CD2 3.62Å; F125-F129 HydrophobicContact CE1-CE2 4.33Å; F125-F129 HydrophobicContact CE1-CG 4.1Å; F125-F129 AromaticContact CE2-CD2 3.53Å; F125-F129 HydrophobicContact CE2-CD2 3.53Å; F125-F129 AromaticContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CZ 4.35Å; F125-F129 AromaticContact CG-CD2 3.87Å; F125-F129 HydrophobicContact CG-CD2 3.87Å; F125-F129 HydrophobicContact CG-CE2 4.35Å; F125-F129 AromaticContact CZ-CD2 3.47Å; F125-F129 HydrophobicContact CZ-CD2 3.47Å; F125-F129 VanDerWaalsContact CZ-CD2 3.47Å; F125-F129 AromaticContact CZ-CE2 3.72Å; F125-F129 HydrophobicContact CZ-CE2 3.72Å; F125-F129 HydrophobicContact CZ-CG 4.12Å; F125-F129 WeakPolarHBondContact O-CD2 3.34Å; F125-F129 PolarHBondContact O-N 3.02Å; F129-V131 PolarHBondContact O-N 3.29Å; F129-V131 VanDerWaalsContact O-N 3.16Å; F129-S132 PolarHBondContact O-N 3.42Å; F129-V133 PolarHBondContact O-N 2.76Å
130S88Confident86.7Confident0 Ų045.3 Ų45.30%028%0.28CS..G310 helixtrans-50.9-39.2177.246.40000113.8I126 S132 M153I126-S130 WeakPolarHBondContact O-CB 3.46Å; I126-S130 PolarHBondContact O-N 2.97Å; I126-S130 PolarHBondContact O-OG 2.79Å; S130-S132 VanDerWaalsContact C-N 3.35Å; S130-M153 PolarHBondContact OG-O 2.87Å
131V87.9Confident85.3Confident42 Ų4245.3 Ų45.326%0.25528%0.282SS..G310 helixtrans-73.2-25.2178.9-178.90000112.9F129 I150 A154F129-V131 PolarHBondContact O-N 3.29Å; F129-V131 VanDerWaalsContact O-N 3.16Å; V131-I150 HydrophobicContact CG1-CG2 3.97Å; V131-A154 HydrophobicContact CG2-CB 3.73Å
132S86.5Confident84Confident83 Ų8345 Ų4558%0.5828%0.283SS*.G310 helixtrans-88.3-6.3-175.9-57.40000113.9F129 S130F129-S132 PolarHBondContact O-N 3.42Å; S130-S132 VanDerWaalsContact C-N 3.35Å
133V85.6Confident82.3Confident24 Ų2453.1 Ų53.115%0.14533%0.326CS..SBendtrans-81.9138177.7177.10000110.1F129 P135 F138 M153 Y176 V177F129-V133 PolarHBondContact O-N 2.76Å; V133-P135 VanDerWaalsContact O-CD 3.27Å; V133-P135 WeakPolarHBondContact O-CD 3.38Å; V133-F138 HydrophobicContact CG1-CE2 3.76Å; V133-F138 HydrophobicContact CG1-CZ 4.37Å; V133-M153 HydrophobicContact CB-CE 4.34Å; V133-M153 VanDerWaalsContact O-CE 3.26Å; V133-M153 WeakPolarHBondContact O-CE 3.02Å; V133-Y176 HydrophobicContact CG1-CD1 4.27Å; V133-Y176 HydrophobicContact CG1-CE1 4.14Å; V133-V177 HydrophobicContact CG2-CG2 3.62Å
134D82.6Confident80.6Confident108 Ų10852.4 Ų52.458%0.57833%0.328SS*.  trans-64.9116.5174.1-176.47000110.6G136 L137D134-G136 PolarHBondContact O-N 3.05Å; D134-G136 PolarHBondContact OD1-N 3.32Å; D134-L137 PolarHBondContact O-N 3.39Å
135P77.9Confident78.9Confident36 Ų3657.4 Ų57.423%0.23436%0.358CS..G310 helixtrans-62.3-25.2176.625.7-35.2000113V133 L137 F138 V141 V149 M153 F169V133-P135 VanDerWaalsContact O-CD 3.27Å; V133-P135 WeakPolarHBondContact O-CD 3.38Å; P135-L137 PolarHBondContact O-N 3.45Å; P135-L137 VanDerWaalsContact O-N 3.13Å; P135-F138 PolarHBondContact O-N 2.87Å; P135-V141 HydrophobicContact CB-CG2 4.2Å; P135-V141 VanDerWaalsContact O-CG2 3.29Å; P135-V141 WeakPolarHBondContact O-CG2 3.37Å; P135-V149 HydrophobicContact CB-CG1 3.71Å; P135-V149 HydrophobicContact CG-CG1 3.66Å; P135-M153 HydrophobicContact CB-CE 3.86Å; P135-F169 HydrophobicContact CB-CZ 4.46Å
136G75.4Confident77.3Confident62 Ų6258.9 Ų58.964%0.63938%0.38SS*.G310 helixtrans-63.6-16.3-178.800000114.4D134 F138D134-G136 PolarHBondContact O-N 3.05Å; D134-G136 PolarHBondContact OD1-N 3.32Å; G136-F138 PolarHBondContact O-N 2.89Å
137L80.2Confident75.6Confident105 Ų10565.5 Ų65.555%0.5541%0.414SS..G310 helixtrans-71.8-14.2178-15388.4000113.4D134 P135 Y176D134-L137 PolarHBondContact O-N 3.39Å; P135-L137 PolarHBondContact O-N 3.45Å; P135-L137 VanDerWaalsContact O-N 3.13Å; L137-Y176 HydrophobicContact CD2-CD2 4.22Å; L137-Y176 HydrophobicContact CD2-CE1 4.41Å; L137-Y176 HydrophobicContact CD2-CE2 3.8Å
138F80.1Confident74.7Confident29 Ų2968.1 Ų68.113%0.12743%0.428CS..SBendtrans-124140.3-172.6-52.2-84.7000112.2V133 P135 G136 F169 A172 V173 Y176V133-F138 HydrophobicContact CG1-CE2 3.76Å; V133-F138 HydrophobicContact CG1-CZ 4.37Å; P135-F138 PolarHBondContact O-N 2.87Å; G136-F138 PolarHBondContact O-N 2.89Å; F138-F169 HydrophobicContact CB-CD2 3.63Å; F138-F169 HydrophobicContact CB-CE2 3.64Å; F138-F169 HydrophobicContact CD2-CE2 4.25Å; F138-F169 HydrophobicContact CG-CD2 4.49Å; F138-F169 HydrophobicContact CG-CE2 4.28Å; F138-A172 HydrophobicContact CD1-CB 3.74Å; F138-A172 HydrophobicContact CE1-CB 4.24Å; F138-V173 HydrophobicContact CD1-CG2 4.4Å; F138-V173 HydrophobicContact CD2-CG2 3.63Å; F138-V173 HydrophobicContact CE1-CG2 4.49Å; F138-V173 HydrophobicContact CE2-CB 4.45Å; F138-V173 HydrophobicContact CE2-CG2 3.76Å; F138-V173 HydrophobicContact CG-CG2 3.98Å; F138-V173 HydrophobicContact CZ-CG2 4.19Å; F138-Y176 HydrophobicContact CE1-CG 4.1Å; F138-Y176 AromaticContact CZ-CD1 3.77Å; F138-Y176 HydrophobicContact CZ-CD1 3.77Å; F138-Y176 HydrophobicContact CZ-CD2 4.29Å; F138-Y176 AromaticContact CZ-CG 3.62Å; F138-Y176 HydrophobicContact CZ-CG 3.62Å
139S71.6Confident74Confident104 Ų10468.7 Ų68.773%0.72743%0.431SS*.THydrogen-bonded Turntrans-77.6144.117456.10000111.7
140G67.7Low73.4Confident62 Ų6269.9 Ų69.964%0.63944%0.44SS*.THydrogen-bonded Turntrans88.726.5178.700000115.2
141V66.9Low73.1Confident49 Ų4977.3 Ų77.330%0.29747%0.467SS..  trans-62129.1167-179.10000108.8P135 N143 V149 F169P135-V141 HydrophobicContact CB-CG2 4.2Å; P135-V141 VanDerWaalsContact O-CG2 3.29Å; P135-V141 WeakPolarHBondContact O-CG2 3.37Å; V141-N143 PolarHBondContact O-N 3.29Å; V141-V149 HydrophobicContact CG1-CG2 4.42Å; V141-F169 HydrophobicContact CB-CE2 4.42Å; V141-F169 HydrophobicContact CG2-CD2 4.02Å; V141-F169 HydrophobicContact CG2-CE2 3.43Å; V141-F169 VanDerWaalsContact CG2-CE2 3.43Å; V141-F169 HydrophobicContact CG2-CZ 4.06Å
142P65.3Low72.8Confident44 Ų4475.9 Ų75.929%0.28646%0.458SS..  trans-59.1133.7173.2-23.535.3000110.3N144 I152P142-N144 PolarHBondContact O-N 3.47Å; P142-I152 HydrophobicContact CB-CD1 4.13Å; P142-I152 HydrophobicContact CG-CD1 4.02Å
143N58.6Low72.6Confident170 Ų17072 Ų7291%0.90943%0.431SS*.SBendtrans-77.553.8-166-141.524.1000113V141V141-N143 PolarHBondContact O-N 3.29Å
144N56.1Low72.6Confident90 Ų9070.9 Ų70.948%0.48142%0.424SS..  trans-124151.7-167.5-61.618.3000111.2P142 D148P142-N144 PolarHBondContact O-N 3.47Å; N144-D148 HydrophobicContact CB-CB 3.82Å
145T59.1Low72.8Confident105 Ų10568.2 Ų68.264%0.64441%0.408SS*.  trans-32.5133.9170.98.80000113L147 D148 V149T145-L147 PolarHBondContact O-N 2.83Å; T145-D148 WeakPolarHBondContact O-CA 3.25Å; T145-D148 VanDerWaalsContact O-CB 3.29Å; T145-D148 WeakPolarHBondContact O-CB 3.41Å; T145-D148 PolarHBondContact O-N 3.5Å; T145-D148 PolarHBondContact OG1-OD2 3.25Å; T145-V149 PolarHBondContact O-N 3.48Å
146G60.3Low73Confident53 Ų5366.8 Ų66.855%0.54640%0.398SS..Hα-helixtrans-54-22.4-172.900000116.3V149 I150G146-V149 WeakPolarHBondContact O-CB 3.49Å; G146-V149 PolarHBondContact O-N 2.86Å; G146-I150 PolarHBondContact O-N 3.13Å; G146-I150 VanDerWaalsContact O-N 3.15Å
147L58.8Low73.5Confident144 Ų14465.7 Ų65.775%0.75438%0.38SS*.Hα-helixtrans-69.6-32.1172.8-126149.5000112.6T145 R151T145-L147 PolarHBondContact O-N 2.83Å; L147-R151 PolarHBondContact O-N 2.83Å
148D73.9Confident73.7Confident55 Ų5562.4 Ų62.429%0.29437%0.365SS..Hα-helixtrans-70-36.7169.7-63.1-48.7000110.7N144 T145 R151 I152N144-D148 HydrophobicContact CB-CB 3.82Å; T145-D148 WeakPolarHBondContact O-CA 3.25Å; T145-D148 VanDerWaalsContact O-CB 3.29Å; T145-D148 WeakPolarHBondContact O-CB 3.41Å; T145-D148 PolarHBondContact O-N 3.5Å; T145-D148 PolarHBondContact OG1-OD2 3.25Å; D148-R151 PolarHBondContact O-N 3.32Å; D148-I152 HydrophobicContact CB-CD1 4.41Å; D148-I152 WeakPolarHBondContact O-CB 3.4Å; D148-I152 WeakPolarHBondContact O-CD1 3.43Å; D148-I152 WeakPolarHBondContact O-CG1 3.46Å; D148-I152 PolarHBondContact O-N 3.22Å
149V78.4Confident73.1Confident18 Ų1869.6 Ų69.611%0.10940%0.396CS..Hα-helixtrans-64.1-43.7179.5-175.40000111.5P135 V141 T145 G146 R151 I152 M153P135-V149 HydrophobicContact CB-CG1 3.71Å; P135-V149 HydrophobicContact CG-CG1 3.66Å; V141-V149 HydrophobicContact CG1-CG2 4.42Å; T145-V149 PolarHBondContact O-N 3.48Å; G146-V149 WeakPolarHBondContact O-CB 3.49Å; G146-V149 PolarHBondContact O-N 2.86Å; V149-R151 VanDerWaalsContact C-N 3.32Å; V149-R151 PolarHBondContact O-N 2.91Å; V149-I152 PolarHBondContact O-N 3.05Å; V149-M153 HydrophobicContact CG1-CG 4.28Å; V149-M153 WeakPolarHBondContact O-CB 3.26Å; V149-M153 VanDerWaalsContact O-CG 3.23Å; V149-M153 WeakPolarHBondContact O-CG 3.4Å; V149-M153 PolarHBondContact O-N 3.43Å
150I80.8Confident72.5Confident85 Ų8573.3 Ų73.344%0.43640%0.402SS..Hα-helixtrans-59.9-43174.9-69171.2000111.2P46 V131 G146 M153 A154P46-I150 HydrophobicContact CB-CG2 3.86Å; V131-I150 HydrophobicContact CG1-CG2 3.97Å; G146-I150 PolarHBondContact O-N 3.13Å; G146-I150 VanDerWaalsContact O-N 3.15Å; I150-M153 PolarHBondContact O-N 3.38Å; I150-A154 WeakPolarHBondContact O-CB 3.07Å; I150-A154 PolarHBondContact O-N 3.19Å
151R81.1Confident72.1Confident155 Ų15572.5 Ų72.559%0.58538%0.383SS*.Hα-helixtrans-67.3-37.9178.3-173.5-178-85.9168.6-7.9111.7L147 D148 V149 K155L147-R151 PolarHBondContact O-N 2.83Å; D148-R151 PolarHBondContact O-N 3.32Å; V149-R151 VanDerWaalsContact C-N 3.32Å; V149-R151 PolarHBondContact O-N 2.91Å; R151-K155 WeakPolarHBondContact O-CG 3.24Å; R151-K155 PolarHBondContact O-N 3.3Å
152I81.3Confident71.5Confident12 Ų1275.5 Ų75.56%0.06240%0.401CS..Hα-helixtrans-64.3-46.4173.9-70160.9000110.1P142 D148 V149 A154 K155 V156 F164P142-I152 HydrophobicContact CB-CD1 4.13Å; P142-I152 HydrophobicContact CG-CD1 4.02Å; D148-I152 HydrophobicContact CB-CD1 4.41Å; D148-I152 WeakPolarHBondContact O-CB 3.4Å; D148-I152 WeakPolarHBondContact O-CD1 3.43Å; D148-I152 WeakPolarHBondContact O-CG1 3.46Å; D148-I152 PolarHBondContact O-N 3.22Å; V149-I152 PolarHBondContact O-N 3.05Å; I152-A154 VanDerWaalsContact C-N 3.33Å; I152-A154 PolarHBondContact O-N 3.42Å; I152-K155 PolarHBondContact O-N 3.01Å; I152-K155 VanDerWaalsContact O-N 3.09Å; I152-V156 PolarHBondContact O-N 3.16Å; I152-F164 HydrophobicContact CG2-CE1 3.86Å; I152-F164 HydrophobicContact CG2-CZ 3.66Å
153M83.4Confident71.1Confident3 Ų378.3 Ų78.32%0.01541%0.413CS..Hα-helixtrans-62.7-38.7178.4-70-62.8-118.100112S130 V133 P135 V149 I150 K155 V156 F169 V173S130-M153 PolarHBondContact OG-O 2.87Å; V133-M153 HydrophobicContact CB-CE 4.34Å; V133-M153 VanDerWaalsContact O-CE 3.26Å; V133-M153 WeakPolarHBondContact O-CE 3.02Å; P135-M153 HydrophobicContact CB-CE 3.86Å; V149-M153 HydrophobicContact CG1-CG 4.28Å; V149-M153 WeakPolarHBondContact O-CB 3.26Å; V149-M153 VanDerWaalsContact O-CG 3.23Å; V149-M153 WeakPolarHBondContact O-CG 3.4Å; V149-M153 PolarHBondContact O-N 3.43Å; I150-M153 PolarHBondContact O-N 3.38Å; M153-K155 PolarHBondContact O-N 3.4Å; M153-V156 WeakPolarHBondContact O-CB 3.49Å; M153-V156 WeakPolarHBondContact O-CG2 3.41Å; M153-V156 PolarHBondContact O-N 3.43Å; M153-V156 HydrophobicContact SD-CG2 4.24Å; M153-F169 HydrophobicContact CE-CZ 4.26Å; M153-F169 HydrophobicContact SD-CE1 3.92Å; M153-F169 HydrophobicContact SD-CZ 3.75Å; M153-V173 HydrophobicContact CE-CG1 4.47Å; M153-V173 HydrophobicContact SD-CG1 4.44Å; M153-V173 HydrophobicContact SD-CG2 4.43Å
154A85.6Confident71.2Confident0 Ų070.6 Ų70.60%037%0.371CS..Hα-helixtrans-62.5-24.9175.700000113.5C44 P46 N49 V131 I150 I152 P157C44-A154 WeakPolarHBondContact CA-O 3.42Å; P46-A154 HydrophobicContact CB-CB 3.94Å; N49-A154 WeakPolarHBondContact ND2-CA 3.12Å; N49-A154 PolarHBondContact ND2-O 2.94Å; V131-A154 HydrophobicContact CG2-CB 3.73Å; I150-A154 WeakPolarHBondContact O-CB 3.07Å; I150-A154 PolarHBondContact O-N 3.19Å; I152-A154 VanDerWaalsContact C-N 3.33Å; I152-A154 PolarHBondContact O-N 3.42Å; A154-P157 WeakPolarHBondContact O-CD 3.44Å
155K85.5Confident71Confident52 Ų5274 Ų7423%0.22638%0.384CS..Hα-helixtrans-96.1-7.1-179.1-73.4170.5155.6-132.50113.9C44 R151 I152 M153 P157 C158 D161 F164C44-K155 HydrophobicContact CB-CG 4.21Å; R151-K155 WeakPolarHBondContact O-CG 3.24Å; R151-K155 PolarHBondContact O-N 3.3Å; I152-K155 PolarHBondContact O-N 3.01Å; I152-K155 VanDerWaalsContact O-N 3.09Å; M153-K155 PolarHBondContact O-N 3.4Å; K155-P157 VanDerWaalsContact C-CD 3.44Å; K155-P157 VanDerWaalsContact C-N 3.32Å; K155-C158 WeakPolarHBondContact O-CA 3.43Å; K155-C158 PolarHBondContact O-N 3.23Å; K155-C158 VanDerWaalsContact O-O 3.14Å; K155-D161 WeakPolarHBondContact CB-OD2 3.14Å; K155-D161 WeakPolarHBondContact CD-OD2 3.39Å; K155-D161 VanDerWaalsContact CE-OD2 3.31Å; K155-D161 WeakPolarHBondContact CE-OD2 3.11Å; K155-D161 VanDerWaalsContact CG-OD2 3.28Å; K155-D161 WeakPolarHBondContact CG-OD2 3.47Å; K155-D161 IonicContact NZ-OD1 2.78Å; K155-D161 PolarHBondContact NZ-OD1 3.14Å; K155-D161 IonicContact NZ-OD2 3.03Å; K155-D161 PolarHBondContact NZ-OD2 3.47Å; K155-F164 HydrophobicContact CB-CE2 4.07Å
156V83.8Confident70.8Confident5 Ų577 Ų773%0.0340%0.396CS..THydrogen-bonded Turntrans-48.3-43.6172.7169.50000113.9I152 M153 C158 R170 V173I152-V156 PolarHBondContact O-N 3.16Å; M153-V156 WeakPolarHBondContact O-CB 3.49Å; M153-V156 WeakPolarHBondContact O-CG2 3.41Å; M153-V156 PolarHBondContact O-N 3.43Å; M153-V156 HydrophobicContact SD-CG2 4.24Å; V156-C158 VanDerWaalsContact C-N 3.28Å; V156-C158 PolarHBondContact O-N 3.45Å; V156-R170 HydrophobicContact CB-CG 4.49Å; V156-R170 HydrophobicContact CG1-CG 4.09Å; V156-V173 HydrophobicContact CG1-CB 4.27Å; V156-V173 HydrophobicContact CG1-CG1 4.04Å; V156-V173 HydrophobicContact CG2-CG1 4.47Å
157P84.1Confident70.8Confident40 Ų4075.8 Ų75.826%0.2638%0.379SS..THydrogen-bonded Turntrans-69.8-19.2176.324.9-34.1000114.3C42 I126 C127 A154 K155C42-P157 HydrophobicContact CB-CB 4.15Å; C42-P157 HydrophobicContact CB-CG 4.29Å; C42-P157 WeakPolarHBondContact SG-CG 3.36Å; I126-P157 HydrophobicContact CG2-CB 4.29Å; C127-P157 HydrophobicContact CB-CB 4.31Å; C127-P157 HydrophobicContact CB-CG 4.41Å; A154-P157 WeakPolarHBondContact O-CD 3.44Å; K155-P157 VanDerWaalsContact C-CD 3.44Å; K155-P157 VanDerWaalsContact C-N 3.32Å
158C84.4Confident71.5Confident35 Ų3573.1 Ų73.124%0.23637%0.373CS..  trans-87.8133178.2-78.10000111.7C44 K155 V156C44-C158 HydrophobicContact CB-CB 4Å; C44-C158 WeakPolarHBondContact CB-SG 3.41Å; C44-C158 WeakPolarHBondContact SG-CB 3.38Å; C44-C158 CovalentContact SG-SG 2Å; C44-C158 PolarHBondContact SG-SG 3.4Å; K155-C158 WeakPolarHBondContact O-CA 3.43Å; K155-C158 PolarHBondContact O-N 3.23Å; K155-C158 VanDerWaalsContact O-O 3.14Å; V156-C158 VanDerWaalsContact C-N 3.28Å; V156-C158 PolarHBondContact O-N 3.45Å
159K68.4Low71.8Confident180 Ų18070.7 Ų70.778%0.78336%0.36SS*.SBendtrans-80.3-20.2-173.8-161.4175.3177.3-173.50113.3R170K159-R170 PolarHBondContact O-NH1 2.83Å
160E59.1Low71.9Confident183 Ų18372.1 Ų72.186%0.85536%0.363SS*.  trans-105-0.3-153.6-67.5174.4175.200116.4V162E160-V162 PolarHBondContact O-N 3.17Å
161D58.7Low72.1Confident44 Ų4474 Ų7424%0.23537%0.368CS..  trans-77.1127.9179.6-80.1-58.4000112.4K155 I163 F164K155-D161 WeakPolarHBondContact CB-OD2 3.14Å; K155-D161 WeakPolarHBondContact CD-OD2 3.39Å; K155-D161 VanDerWaalsContact CE-OD2 3.31Å; K155-D161 WeakPolarHBondContact CE-OD2 3.11Å; K155-D161 VanDerWaalsContact CG-OD2 3.28Å; K155-D161 WeakPolarHBondContact CG-OD2 3.47Å; K155-D161 IonicContact NZ-OD1 2.78Å; K155-D161 PolarHBondContact NZ-OD1 3.14Å; K155-D161 IonicContact NZ-OD2 3.03Å; K155-D161 PolarHBondContact NZ-OD2 3.47Å; D161-I163 PolarHBondContact O-N 3.47Å; D161-F164 HydrophobicContact CB-CD2 4.06Å; D161-F164 HydrophobicContact CB-CE2 4.46Å; D161-F164 PolarHBondContact O-N 2.88Å
162V53.9Low72.3Confident112 Ų11268.1 Ų68.168%0.67935%0.352SS*.G310 helixtrans-51.4-26.3178.6-1610000112.6E160 F164E160-V162 PolarHBondContact O-N 3.17Å; V162-F164 PolarHBondContact O-N 3.17Å; V162-F164 VanDerWaalsContact O-N 3.16Å
163I57Low72.6Confident104 Ų10467.5 Ų67.553%0.53335%0.35SS..G310 helixtrans-59.5-23.2176.8-55.8173.3000112.4D161D161-I163 PolarHBondContact O-N 3.47Å
164F60.6Low72.9Confident8 Ų868.7 Ų68.74%0.03536%0.358CS..G310 helixtrans-111.820.2-171.7-62.3-59.3000115.2I152 K155 D161 V162 N166 S167 R170I152-F164 HydrophobicContact CG2-CE1 3.86Å; I152-F164 HydrophobicContact CG2-CZ 3.66Å; K155-F164 HydrophobicContact CB-CE2 4.07Å; D161-F164 HydrophobicContact CB-CD2 4.06Å; D161-F164 HydrophobicContact CB-CE2 4.46Å; D161-F164 PolarHBondContact O-N 2.88Å; V162-F164 PolarHBondContact O-N 3.17Å; V162-F164 VanDerWaalsContact O-N 3.16Å; F164-N166 PolarHBondContact O-N 3.21Å; F164-S167 WeakPolarHBondContact CD1-OG 3.22Å; F164-S167 PolarHBondContact O-N 3.46Å; F164-R170 HydrophobicContact CD1-CB 4.1Å; F164-R170 HydrophobicContact CE1-CB 4.24Å
165Q53.7Low73.1Confident160 Ų16077 Ų7775%0.74839%0.389SS*.THydrogen-bonded Turntrans-53.8-19.8-178.1-90.6-177.5-13.700114.7
166N53.6Low73.4Confident168 Ų16879.7 Ų79.790%0.89840%0.399SS*.THydrogen-bonded Turntrans-144.519.9176.4-94-26.7000115.8F164 S168F164-N166 PolarHBondContact O-N 3.21Å; N166-S168 PolarHBondContact O-N 3.36Å
167S61.3Low73.8Confident28 Ų2879.6 Ų79.620%0.19640%0.398CS..  trans-80.6108.8-166.470.50000114.3F164 F169 R170F164-S167 WeakPolarHBondContact CD1-OG 3.22Å; F164-S167 PolarHBondContact O-N 3.46Å; S167-F169 PolarHBondContact O-N 2.98Å; S167-R170 VanDerWaalsContact OG-CB 3.28Å; S167-R170 WeakPolarHBondContact OG-CB 3.22Å
168S73.7Confident74.3Confident88 Ų8882.1 Ų82.162%0.61540%0.403SS*.Hα-helixtrans-52.5-38.3161.3179.10000111.2N166 R170 K171 A172N166-S168 PolarHBondContact O-N 3.36Å; S168-R170 PolarHBondContact O-N 3.34Å; S168-K171 PolarHBondContact O-N 3.15Å; S168-A172 WeakPolarHBondContact O-CB 3.43Å; S168-A172 PolarHBondContact O-N 3.45Å
169F78.6Confident74.8Confident5 Ų584.3 Ų84.32%0.02242%0.417CS..Hα-helixtrans-54.6-52.3-179.7178.5-99.3000113.7P135 F138 V141 M153 S167 K171 A172 V173P135-F169 HydrophobicContact CB-CZ 4.46Å; F138-F169 HydrophobicContact CB-CD2 3.63Å; F138-F169 HydrophobicContact CB-CE2 3.64Å; F138-F169 HydrophobicContact CD2-CE2 4.25Å; F138-F169 HydrophobicContact CG-CD2 4.49Å; F138-F169 HydrophobicContact CG-CE2 4.28Å; V141-F169 HydrophobicContact CB-CE2 4.42Å; V141-F169 HydrophobicContact CG2-CD2 4.02Å; V141-F169 HydrophobicContact CG2-CE2 3.43Å; V141-F169 VanDerWaalsContact CG2-CE2 3.43Å; V141-F169 HydrophobicContact CG2-CZ 4.06Å; M153-F169 HydrophobicContact CE-CZ 4.26Å; M153-F169 HydrophobicContact SD-CE1 3.92Å; M153-F169 HydrophobicContact SD-CZ 3.75Å; S167-F169 PolarHBondContact O-N 2.98Å; F169-K171 VanDerWaalsContact C-N 3.31Å; F169-K171 PolarHBondContact O-N 3.29Å; F169-A172 WeakPolarHBondContact O-CB 3.2Å; F169-A172 PolarHBondContact O-N 3.47Å; F169-A172 VanDerWaalsContact O-N 3.09Å; F169-V173 HydrophobicContact CD1-CG2 4.31Å; F169-V173 HydrophobicContact CD2-CG2 4.28Å; F169-V173 HydrophobicContact CE1-CG2 3.94Å; F169-V173 HydrophobicContact CE2-CG2 3.9Å; F169-V173 HydrophobicContact CG-CG2 4.47Å; F169-V173 HydrophobicContact CZ-CG2 3.72Å; F169-V173 WeakPolarHBondContact O-CG2 3.31Å; F169-V173 PolarHBondContact O-N 3.01Å
170R81.6Confident76Confident47 Ų4782.1 Ų82.118%0.17741%0.405CS..Hα-helixtrans-59.7-43.5179.9-178.5-174.363.3-176.8-5.9111.5V156 K159 F164 S167 S168 A172 S174V156-R170 HydrophobicContact CB-CG 4.49Å; V156-R170 HydrophobicContact CG1-CG 4.09Å; K159-R170 PolarHBondContact O-NH1 2.83Å; F164-R170 HydrophobicContact CD1-CB 4.1Å; F164-R170 HydrophobicContact CE1-CB 4.24Å; S167-R170 VanDerWaalsContact OG-CB 3.28Å; S167-R170 WeakPolarHBondContact OG-CB 3.22Å; S168-R170 PolarHBondContact O-N 3.34Å; R170-A172 VanDerWaalsContact C-N 3.32Å; R170-S174 VanDerWaalsContact O-CB 3.22Å; R170-S174 WeakPolarHBondContact O-CB 3.4Å; R170-S174 PolarHBondContact O-N 2.89Å
171K84.8Confident77.8Confident126 Ų12673.4 Ų73.455%0.54836%0.364SS..Hα-helixtrans-64.1-39.8177.5-69.8178.9-179.5173.30110.7S168 F169 R175S168-K171 PolarHBondContact O-N 3.15Å; F169-K171 VanDerWaalsContact C-N 3.31Å; F169-K171 PolarHBondContact O-N 3.29Å; K171-R175 WeakPolarHBondContact O-CB 3.38Å; K171-R175 WeakPolarHBondContact O-CG 3.05Å; K171-R175 PolarHBondContact O-N 3.35Å
172A86.1Confident79.6Confident30 Ų3074.8 Ų74.825%0.24837%0.369CS..Hα-helixtrans-65.1-50.9178.200000111.9F138 S168 F169 R170 S174 R175 Y176F138-A172 HydrophobicContact CD1-CB 3.74Å; F138-A172 HydrophobicContact CE1-CB 4.24Å; S168-A172 WeakPolarHBondContact O-CB 3.43Å; S168-A172 PolarHBondContact O-N 3.45Å; F169-A172 WeakPolarHBondContact O-CB 3.2Å; F169-A172 PolarHBondContact O-N 3.47Å; F169-A172 VanDerWaalsContact O-N 3.09Å; R170-A172 VanDerWaalsContact C-N 3.32Å; A172-S174 PolarHBondContact O-N 2.97Å; A172-R175 PolarHBondContact O-N 3.31Å; A172-Y176 WeakPolarHBondContact O-CB 3.49Å; A172-Y176 PolarHBondContact O-N 3.4Å
173V87.1Confident81.7Confident0 Ų071.9 Ų71.90%036%0.357CS..Hα-helixtrans-59.5-48.6177.2178.10000110.7F138 M153 V156 F169 R175 Y176 V177F138-V173 HydrophobicContact CD1-CG2 4.4Å; F138-V173 HydrophobicContact CD2-CG2 3.63Å; F138-V173 HydrophobicContact CE1-CG2 4.49Å; F138-V173 HydrophobicContact CE2-CB 4.45Å; F138-V173 HydrophobicContact CE2-CG2 3.76Å; F138-V173 HydrophobicContact CG-CG2 3.98Å; F138-V173 HydrophobicContact CZ-CG2 4.19Å; M153-V173 HydrophobicContact CE-CG1 4.47Å; M153-V173 HydrophobicContact SD-CG1 4.44Å; M153-V173 HydrophobicContact SD-CG2 4.43Å; V156-V173 HydrophobicContact CG1-CB 4.27Å; V156-V173 HydrophobicContact CG1-CG1 4.04Å; V156-V173 HydrophobicContact CG2-CG1 4.47Å; F169-V173 HydrophobicContact CD1-CG2 4.31Å; F169-V173 HydrophobicContact CD2-CG2 4.28Å; F169-V173 HydrophobicContact CE1-CG2 3.94Å; F169-V173 HydrophobicContact CE2-CG2 3.9Å; F169-V173 HydrophobicContact CG-CG2 4.47Å; F169-V173 HydrophobicContact CZ-CG2 3.72Å; F169-V173 WeakPolarHBondContact O-CG2 3.31Å; F169-V173 PolarHBondContact O-N 3.01Å; V173-R175 PolarHBondContact O-N 3.33Å; V173-Y176 PolarHBondContact O-N 3.08Å; V173-V177 HydrophobicContact CG1-CG2 4.35Å; V173-V177 WeakPolarHBondContact O-CG2 3.42Å; V173-V177 PolarHBondContact O-N 2.65Å
174S88.6Confident83.6Confident27 Ų2769.2 Ų69.219%0.18935%0.346CS..Hα-helixtrans-60.1-42.6178.9178.80000112.4R170 A172 R178R170-S174 VanDerWaalsContact O-CB 3.22Å; R170-S174 WeakPolarHBondContact O-CB 3.4Å; R170-S174 PolarHBondContact O-N 2.89Å; A172-S174 PolarHBondContact O-N 2.97Å; S174-R178 WeakPolarHBondContact O-CB 3.23Å; S174-R178 PolarHBondContact O-N 3.04Å
175R90.4Very high85.3Confident176 Ų17668.9 Ų68.966%0.66434%0.344SS*.Hα-helixtrans-65.3-43.7176.1-76.3175.2-164.4175.73.2112.1K171 A172 V173 R178 C179K171-R175 WeakPolarHBondContact O-CB 3.38Å; K171-R175 WeakPolarHBondContact O-CG 3.05Å; K171-R175 PolarHBondContact O-N 3.35Å; A172-R175 PolarHBondContact O-N 3.31Å; V173-R175 PolarHBondContact O-N 3.33Å; R175-R178 PolarHBondContact O-N 2.87Å; R175-C179 VanDerWaalsContact O-CB 3.31Å; R175-C179 WeakPolarHBondContact O-CB 3.28Å; R175-C179 PolarHBondContact O-N 3.28Å
176Y91.4Very high87.4Confident107 Ų10768.7 Ų68.742%0.4234%0.336SS..Hα-helixtrans-60.3-51.7178.8174.6-97000111.2V133 L137 F138 A172 V173 R178 C179 Y180V133-Y176 HydrophobicContact CG1-CD1 4.27Å; V133-Y176 HydrophobicContact CG1-CE1 4.14Å; L137-Y176 HydrophobicContact CD2-CD2 4.22Å; L137-Y176 HydrophobicContact CD2-CE1 4.41Å; L137-Y176 HydrophobicContact CD2-CE2 3.8Å; F138-Y176 HydrophobicContact CE1-CG 4.1Å; F138-Y176 AromaticContact CZ-CD1 3.77Å; F138-Y176 HydrophobicContact CZ-CD1 3.77Å; F138-Y176 HydrophobicContact CZ-CD2 4.29Å; F138-Y176 AromaticContact CZ-CG 3.62Å; F138-Y176 HydrophobicContact CZ-CG 3.62Å; A172-Y176 WeakPolarHBondContact O-CB 3.49Å; A172-Y176 PolarHBondContact O-N 3.4Å; V173-Y176 PolarHBondContact O-N 3.08Å; Y176-R178 VanDerWaalsContact C-N 3.33Å; Y176-R178 PolarHBondContact O-N 3.17Å; Y176-C179 WeakPolarHBondContact O-CB 3.42Å; Y176-C179 PolarHBondContact O-N 2.96Å; Y176-Y180 PolarHBondContact O-N 2.92Å
177V92.3Very high89.5Confident3 Ų364.4 Ų64.42%0.01832%0.32CS..Hα-helixtrans-65.3-37.6179.9179.90000111.6F125 I126 V133 V173 Y180 S181F125-V177 HydrophobicContact CD1-CG1 3.69Å; F125-V177 HydrophobicContact CE1-CG1 4.03Å; I126-V177 HydrophobicContact CB-CG1 4.32Å; I126-V177 HydrophobicContact CG1-CB 4.19Å; I126-V177 HydrophobicContact CG1-CG1 3.94Å; V133-V177 HydrophobicContact CG2-CG2 3.62Å; V173-V177 HydrophobicContact CG1-CG2 4.35Å; V173-V177 WeakPolarHBondContact O-CG2 3.42Å; V173-V177 PolarHBondContact O-N 2.65Å; V177-Y180 PolarHBondContact O-N 2.91Å; V177-S181 WeakPolarHBondContact O-CB 3.37Å; V177-S181 PolarHBondContact O-N 3.31Å
178R94.4Very high91.1Very high94 Ų9465.4 Ų65.436%0.35532%0.322SS..Hα-helixtrans-63.2-45.4174-173.4174.3-75.8155.60.7112I126 S174 R175 Y176 Y180 S181 Q182I126-R178 HydrophobicContact CD1-CB 4.05Å; I126-R178 HydrophobicContact CG1-CB 4.49Å; S174-R178 WeakPolarHBondContact O-CB 3.23Å; S174-R178 PolarHBondContact O-N 3.04Å; R175-R178 PolarHBondContact O-N 2.87Å; Y176-R178 VanDerWaalsContact C-N 3.33Å; Y176-R178 PolarHBondContact O-N 3.17Å; R178-Y180 VanDerWaalsContact C-N 3.29Å; R178-Y180 PolarHBondContact O-N 2.95Å; R178-S181 WeakPolarHBondContact O-CB 3.43Å; R178-S181 PolarHBondContact O-N 3.33Å; R178-Q182 HydrophobicContact CG-CG 4.41Å; R178-Q182 WeakPolarHBondContact O-CB 3.1Å; R178-Q182 WeakPolarHBondContact O-CG 3.17Å; R178-Q182 PolarHBondContact O-N 2.86Å
179C95Very high92.2Very high80 Ų8063.6 Ų63.654%0.54131%0.305SS..Hα-helixtrans-58.5-45.2177.2-178.20000110.6R175 Y176 S181 Q182 A183R175-C179 VanDerWaalsContact O-CB 3.31Å; R175-C179 WeakPolarHBondContact O-CB 3.28Å; R175-C179 PolarHBondContact O-N 3.28Å; Y176-C179 WeakPolarHBondContact O-CB 3.42Å; Y176-C179 PolarHBondContact O-N 2.96Å; C179-S181 PolarHBondContact O-N 2.94Å; C179-Q182 PolarHBondContact O-N 3.38Å; C179-A183 WeakPolarHBondContact O-CB 3.43Å; C179-A183 PolarHBondContact O-N 3.32Å
180Y94.6Very high93.1Very high135 Ų13568.2 Ų68.253%0.52933%0.33SS..Hα-helixtrans-60.6-46.6175.8-168.2-93.1000112.1F125 Y176 V177 R178 Q182 A183 V184F125-Y180 AromaticContact CE1-CD1 3.8Å; F125-Y180 HydrophobicContact CE1-CD1 3.8Å; F125-Y180 HydrophobicContact CE1-CE1 4.5Å; F125-Y180 AromaticContact CZ-CD1 3.77Å; F125-Y180 HydrophobicContact CZ-CD1 3.77Å; F125-Y180 HydrophobicContact CZ-CE1 4.06Å; Y176-Y180 PolarHBondContact O-N 2.92Å; V177-Y180 PolarHBondContact O-N 2.91Å; R178-Y180 VanDerWaalsContact C-N 3.29Å; R178-Y180 PolarHBondContact O-N 2.95Å; Y180-Q182 VanDerWaalsContact C-N 3.34Å; Y180-Q182 PolarHBondContact O-N 2.87Å; Y180-A183 PolarHBondContact O-N 3.3Å; Y180-V184 HydrophobicContact CD1-CG2 4.23Å; Y180-V184 HydrophobicContact CE1-CG2 3.97Å; Y180-V184 WeakPolarHBondContact O-CG2 3.31Å; Y180-V184 PolarHBondContact O-N 2.89Å
181S96.3Very high93.8Very high0 Ų071.8 Ų71.80%035%0.347CS..Hα-helixtrans-56.9-46.1175.1-171.40000112.4L119 F125 V177 R178 C179 V184 G185L119-S181 CarbonylContact O-C 3.54Å; L119-S181 WeakPolarHBondContact O-CB 3.32Å; L119-S181 PolarHBondContact O-OG 3.31Å; F125-S181 WeakPolarHBondContact CB-OG 3.37Å; F125-S181 WeakPolarHBondContact CG-OG 3.32Å; V177-S181 WeakPolarHBondContact O-CB 3.37Å; V177-S181 PolarHBondContact O-N 3.31Å; R178-S181 WeakPolarHBondContact O-CB 3.43Å; R178-S181 PolarHBondContact O-N 3.33Å; C179-S181 PolarHBondContact O-N 2.94Å; S181-V184 PolarHBondContact O-N 3.41Å; S181-G185 PolarHBondContact O-N 3.41Å
182Q97Very high94.1Very high73 Ų7368.5 Ų68.534%0.34134%0.335SS..Hα-helixtrans-67.7-41179.6-73.9178.6-12.800111.9L120 R178 C179 Y180 V184 G185 W186L120-Q182 WeakPolarHBondContact O-CG 3.06Å; L120-Q182 PolarHBondContact O-NE2 3.47Å; R178-Q182 HydrophobicContact CG-CG 4.41Å; R178-Q182 WeakPolarHBondContact O-CB 3.1Å; R178-Q182 WeakPolarHBondContact O-CG 3.17Å; R178-Q182 PolarHBondContact O-N 2.86Å; C179-Q182 PolarHBondContact O-N 3.38Å; Y180-Q182 VanDerWaalsContact C-N 3.34Å; Y180-Q182 PolarHBondContact O-N 2.87Å; Q182-V184 VanDerWaalsContact C-N 3.35Å; Q182-V184 PolarHBondContact O-N 3.26Å; Q182-G185 PolarHBondContact O-N 2.81Å; Q182-W186 PolarHBondContact O-N 2.9Å
183A97.3Very high94.4Very high51 Ų5172 Ų7242%0.42135%0.348SS..Hα-helixtrans-58.2-48.3174.700000110.7C179 Y180 G185 W186 S187C179-A183 WeakPolarHBondContact O-CB 3.43Å; C179-A183 PolarHBondContact O-N 3.32Å; Y180-A183 PolarHBondContact O-N 3.3Å; A183-G185 PolarHBondContact O-N 2.79Å; A183-W186 PolarHBondContact O-N 3.4Å; A183-S187 WeakPolarHBondContact O-CB 3.03Å; A183-S187 PolarHBondContact O-N 2.89Å; A183-S187 PolarHBondContact O-OG 3.23Å
184V96.6Very high94.8Very high48 Ų4876.4 Ų76.429%0.29137%0.371SS..Hα-helixtrans-59.2-45.6174.8174.20000111.2L119 Y180 S181 Q182 W186 S187 I188L119-V184 HydrophobicContact CD1-CG1 4.3Å; Y180-V184 HydrophobicContact CD1-CG2 4.23Å; Y180-V184 HydrophobicContact CE1-CG2 3.97Å; Y180-V184 WeakPolarHBondContact O-CG2 3.31Å; Y180-V184 PolarHBondContact O-N 2.89Å; S181-V184 PolarHBondContact O-N 3.41Å; Q182-V184 VanDerWaalsContact C-N 3.35Å; Q182-V184 PolarHBondContact O-N 3.26Å; V184-W186 PolarHBondContact O-N 2.97Å; V184-S187 PolarHBondContact O-N 2.83Å; V184-I188 HydrophobicContact CG1-CD1 3.9Å; V184-I188 WeakPolarHBondContact O-CG1 3.47Å; V184-I188 PolarHBondContact O-N 2.92Å
185G96.7Very high94.8Very high0 Ų078.5 Ų78.50%038%0.38CS..Hα-helixtrans-58.5-47.8177.300000113.1L116 S181 Q182 A183 I188 L189L116-G185 VanDerWaalsContact CD2-O 3.3Å; L116-G185 WeakPolarHBondContact CD2-O 3.36Å; S181-G185 PolarHBondContact O-N 3.41Å; Q182-G185 PolarHBondContact O-N 2.81Å; A183-G185 PolarHBondContact O-N 2.79Å; G185-I188 PolarHBondContact O-N 3.17Å; G185-L189 PolarHBondContact O-N 3.17Å
186W97.7Very high94.7Very high156 Ų15672.1 Ų72.159%0.59137%0.369SS*.Hα-helixtrans-66.4-38.1176.9-77.5113.9000112.6L120 Q182 A183 V184 L189 L190L120-W186 HydrophobicContact CD2-CD2 4.22Å; L120-W186 HydrophobicContact CD2-CG 4.14Å; Q182-W186 PolarHBondContact O-N 2.9Å; A183-W186 PolarHBondContact O-N 3.4Å; V184-W186 PolarHBondContact O-N 2.97Å; W186-L189 HydrophobicContact CE3-CD2 3.75Å; W186-L189 HydrophobicContact CZ3-CD2 3.56Å; W186-L189 PolarHBondContact O-N 3.34Å; W186-L190 WeakPolarHBondContact O-CB 3.38Å; W186-L190 PolarHBondContact O-N 2.93Å
187S97.7Very high94.5Very high79 Ų7969.2 Ų69.255%0.55237%0.367SS*.Hα-helixtrans-62-44.2174.3-64.50000111.8A183 V184 L190 F191A183-S187 WeakPolarHBondContact O-CB 3.03Å; A183-S187 PolarHBondContact O-N 2.89Å; A183-S187 PolarHBondContact O-OG 3.23Å; V184-S187 PolarHBondContact O-N 2.83Å; S187-L190 PolarHBondContact O-N 2.94Å; S187-F191 VanDerWaalsContact O-CB 3.3Å; S187-F191 WeakPolarHBondContact O-CB 3.05Å; S187-F191 PolarHBondContact O-N 2.91Å
188I96.3Very high94.3Very high48 Ų4873.2 Ų73.225%0.24639%0.387CS..Hα-helixtrans-63-45.6175.4-67.8168.1000110.2M112 L116 L119 V184 G185 L190 F191 L192M112-I188 HydrophobicContact CE-CG2 4.16Å; L116-I188 HydrophobicContact CD2-CB 4.11Å; L116-I188 HydrophobicContact CD2-CG2 3.9Å; L119-I188 HydrophobicContact CD1-CD1 3.69Å; V184-I188 HydrophobicContact CG1-CD1 3.9Å; V184-I188 WeakPolarHBondContact O-CG1 3.47Å; V184-I188 PolarHBondContact O-N 2.92Å; G185-I188 PolarHBondContact O-N 3.17Å; I188-L190 PolarHBondContact O-N 3.27Å; I188-F191 PolarHBondContact O-N 3.28Å; I188-L192 HydrophobicContact CG2-CD1 4.01Å; I188-L192 HydrophobicContact CG2-CG 4.36Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.28Å; I188-L192 PolarHBondContact O-N 3.2Å
189L95.6Very high93.5Very high50 Ų5070.8 Ų70.826%0.26239%0.391SS..Hα-helixtrans-59.6-48179179.259.8000111.7L116 G185 W186 F191 L192 I193L116-L189 HydrophobicContact CD1-CD1 4.09Å; L116-L189 HydrophobicContact CD2-CB 3.93Å; G185-L189 PolarHBondContact O-N 3.17Å; W186-L189 HydrophobicContact CE3-CD2 3.75Å; W186-L189 HydrophobicContact CZ3-CD2 3.56Å; W186-L189 PolarHBondContact O-N 3.34Å; L189-F191 VanDerWaalsContact C-N 3.33Å; L189-F191 PolarHBondContact O-N 2.99Å; L189-L192 PolarHBondContact O-N 2.98Å; L189-I193 HydrophobicContact CD1-CD1 4.23Å; L189-I193 HydrophobicContact CG-CD1 4.1Å; L189-I193 WeakPolarHBondContact O-CG1 3.24Å; L189-I193 PolarHBondContact O-N 3.33Å
190L97.1Very high92.7Very high103 Ų10376.6 Ų76.654%0.53940%0.402SS..Hα-helixtrans-60-44.9177.1179.763000111.2W186 S187 I188 L192 I193 I194W186-L190 WeakPolarHBondContact O-CB 3.38Å; W186-L190 PolarHBondContact O-N 2.93Å; S187-L190 PolarHBondContact O-N 2.94Å; I188-L190 PolarHBondContact O-N 3.27Å; L190-L192 VanDerWaalsContact C-N 3.35Å; L190-L192 PolarHBondContact O-N 3.5Å; L190-I193 PolarHBondContact O-N 3.27Å; L190-I194 HydrophobicContact CD1-CD1 4.17Å; L190-I194 HydrophobicContact CD1-CG1 4.43Å; L190-I194 HydrophobicContact CG-CD1 3.95Å; L190-I194 WeakPolarHBondContact O-CG1 3.31Å; L190-I194 PolarHBondContact O-N 2.88Å
191F96.1Very high92Very high121 Ų12176.1 Ų76.153%0.53141%0.408SS..Hα-helixtrans-58.9-44.1177.1176-105.6000112.1S187 I188 L189 I193 I194 L195S187-F191 VanDerWaalsContact O-CB 3.3Å; S187-F191 WeakPolarHBondContact O-CB 3.05Å; S187-F191 PolarHBondContact O-N 2.91Å; I188-F191 PolarHBondContact O-N 3.28Å; L189-F191 VanDerWaalsContact C-N 3.33Å; L189-F191 PolarHBondContact O-N 2.99Å; F191-I193 VanDerWaalsContact C-N 3.35Å; F191-I193 PolarHBondContact O-N 3.15Å; F191-I194 PolarHBondContact O-N 2.89Å; F191-L195 HydrophobicContact CD1-CD1 3.85Å; F191-L195 HydrophobicContact CD1-CG 4.29Å; F191-L195 HydrophobicContact CE1-CD1 3.24Å; F191-L195 HydrophobicContact CE1-CG 3.9Å; F191-L195 HydrophobicContact CE2-CD1 4.31Å; F191-L195 HydrophobicContact CE2-CD2 4.25Å; F191-L195 HydrophobicContact CE2-CG 4.11Å; F191-L195 HydrophobicContact CZ-CD1 3.51Å; F191-L195 HydrophobicContact CZ-CD2 4.01Å; F191-L195 HydrophobicContact CZ-CG 3.8Å; F191-L195 WeakPolarHBondContact O-CB 3.03Å; F191-L195 WeakPolarHBondContact O-CG 3.49Å; F191-L195 PolarHBondContact O-N 3.05Å
192L92Very high90.8Very high58 Ų5879.5 Ų79.530%0.30443%0.425SS..Hα-helixtrans-64.1-38.6176.8-67.5171.1000112.6M112 L116 I188 L189 L190 L195 G196M112-L192 HydrophobicContact CE-CD1 3.61Å; M112-L192 HydrophobicContact CE-CD2 3.89Å; M112-L192 HydrophobicContact CE-CG 4.23Å; L116-L192 HydrophobicContact CD1-CD1 4.15Å; I188-L192 HydrophobicContact CG2-CD1 4.01Å; I188-L192 HydrophobicContact CG2-CG 4.36Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.28Å; I188-L192 PolarHBondContact O-N 3.2Å; L189-L192 PolarHBondContact O-N 2.98Å; L190-L192 VanDerWaalsContact C-N 3.35Å; L190-L192 PolarHBondContact O-N 3.5Å; L192-L195 PolarHBondContact O-N 3.36Å; L192-G196 PolarHBondContact O-N 3.18Å
193I92.3Very high89.3Confident102 Ų10280.1 Ų80.152%0.52343%0.426SS..Hα-helixtrans-63.5-45.7175.3-68.1166.1000110.2L189 L190 F191 G196 A197L189-I193 HydrophobicContact CD1-CD1 4.23Å; L189-I193 HydrophobicContact CG-CD1 4.1Å; L189-I193 WeakPolarHBondContact O-CG1 3.24Å; L189-I193 PolarHBondContact O-N 3.33Å; L190-I193 PolarHBondContact O-N 3.27Å; F191-I193 VanDerWaalsContact C-N 3.35Å; F191-I193 PolarHBondContact O-N 3.15Å; I193-G196 PolarHBondContact O-N 2.87Å; I193-A197 WeakPolarHBondContact O-CB 3.43Å; I193-A197 PolarHBondContact O-N 2.95Å
194I94.8Very high87.8Confident94 Ų9482.1 Ų82.148%0.48244%0.435SS..Hα-helixtrans-62.8-45.8177.5-67.9169000110.6L190 F191 G196 A197 M198L190-I194 HydrophobicContact CD1-CD1 4.17Å; L190-I194 HydrophobicContact CD1-CG1 4.43Å; L190-I194 HydrophobicContact CG-CD1 3.95Å; L190-I194 WeakPolarHBondContact O-CG1 3.31Å; L190-I194 PolarHBondContact O-N 2.88Å; F191-I194 PolarHBondContact O-N 2.89Å; I194-G196 VanDerWaalsContact C-N 3.3Å; I194-G196 PolarHBondContact O-N 2.03Å; I194-A197 PolarHBondContact O-N 2.75Å; I194-M198 WeakPolarHBondContact O-CB 3.17Å; I194-M198 PolarHBondContact O-N 3.15Å
195L90.2Very high86.3Confident70 Ų7084.5 Ų84.537%0.36645%0.453SS..Hα-helixtrans-58.2-43.2175-77.5-175.8000111.9F191 L192 M198 G199F191-L195 HydrophobicContact CD1-CD1 3.85Å; F191-L195 HydrophobicContact CD1-CG 4.29Å; F191-L195 HydrophobicContact CE1-CD1 3.24Å; F191-L195 HydrophobicContact CE1-CG 3.9Å; F191-L195 HydrophobicContact CE2-CD1 4.31Å; F191-L195 HydrophobicContact CE2-CD2 4.25Å; F191-L195 HydrophobicContact CE2-CG 4.11Å; F191-L195 HydrophobicContact CZ-CD1 3.51Å; F191-L195 HydrophobicContact CZ-CD2 4.01Å; F191-L195 HydrophobicContact CZ-CG 3.8Å; F191-L195 WeakPolarHBondContact O-CB 3.03Å; F191-L195 WeakPolarHBondContact O-CG 3.49Å; F191-L195 PolarHBondContact O-N 3.05Å; L192-L195 PolarHBondContact O-N 3.36Å; L195-M198 HydrophobicContact CD2-CE 3.74Å; L195-G199 PolarHBondContact O-N 2.82Å
196G86.7Confident84.4Confident42 Ų4292.1 Ų92.143%0.43349%0.486SS..Hα-helixtrans-62.7-46.9176.200000112.2L192 I193 I194 G199 R200L192-G196 PolarHBondContact O-N 3.18Å; I193-G196 PolarHBondContact O-N 2.87Å; I194-G196 VanDerWaalsContact C-N 3.3Å; I194-G196 PolarHBondContact O-N 2.03Å; G196-G199 PolarHBondContact O-N 3.06Å; G196-R200 WeakPolarHBondContact O-CG 3.18Å; G196-R200 PolarHBondContact O-N 3.38Å; G196-R200 VanDerWaalsContact O-N 3.15Å
197A89Confident82.5Confident47 Ų4789.2 Ų89.239%0.38848%0.479SS..Hα-helixtrans-62.3-46.5176.900000111.4I193 I194 G199 R200 L201I193-A197 WeakPolarHBondContact O-CB 3.43Å; I193-A197 PolarHBondContact O-N 2.95Å; I194-A197 PolarHBondContact O-N 2.75Å; A197-G199 VanDerWaalsContact C-N 3.33Å; A197-G199 PolarHBondContact O-N 3.29Å; A197-R200 CarbonylContact O-C 3.59Å; A197-R200 WeakPolarHBondContact O-CA 3.49Å; A197-R200 WeakPolarHBondContact O-CB 3.49Å; A197-R200 PolarHBondContact O-N 3.49Å; A197-L201 WeakPolarHBondContact O-CG 3.22Å; A197-L201 PolarHBondContact O-N 3.37Å
198M86.4Confident80.9Confident87 Ų8792 Ų9243%0.42949%0.488SS..Hα-helixtrans-59.9-43.2176.2-174172.668.300111.2I194 L195 R200 L201 I202I194-M198 WeakPolarHBondContact O-CB 3.17Å; I194-M198 PolarHBondContact O-N 3.15Å; L195-M198 HydrophobicContact CD2-CE 3.74Å; M198-R200 PolarHBondContact O-N 3.05Å; M198-L201 PolarHBondContact O-N 3.3Å; M198-L201 VanDerWaalsContact O-N 3.14Å; M198-I202 HydrophobicContact CG-CD1 3.2Å; M198-I202 HydrophobicContact CG-CG1 3.69Å; M198-I202 VanDerWaalsContact O-CB 3.25Å; M198-I202 WeakPolarHBondContact O-CB 3.26Å; M198-I202 WeakPolarHBondContact O-CG1 3.44Å; M198-I202 PolarHBondContact O-N 2.92Å; M198-I202 HydrophobicContact SD-CD1 3.75Å
199G78.9Confident79.4Confident43 Ų4396.2 Ų96.244%0.44351%0.506SS..Hα-helixtrans-62.6-20173.200000114.2L195 G196 A197 K203L195-G199 PolarHBondContact O-N 2.82Å; G196-G199 PolarHBondContact O-N 3.06Å; A197-G199 VanDerWaalsContact C-N 3.33Å; A197-G199 PolarHBondContact O-N 3.29Å; G199-K203 WeakPolarHBondContact O-CB 3.44Å
200R77.9Confident78.2Confident202 Ų20297.2 Ų97.276%0.76252%0.522SS*.Hα-helixtrans-89.1-33.6171.7-62.5-64.4-178.381.71.7112.8G196 A197 M198 P204G196-R200 WeakPolarHBondContact O-CG 3.18Å; G196-R200 PolarHBondContact O-N 3.38Å; G196-R200 VanDerWaalsContact O-N 3.15Å; A197-R200 CarbonylContact O-C 3.59Å; A197-R200 WeakPolarHBondContact O-CA 3.49Å; A197-R200 WeakPolarHBondContact O-CB 3.49Å; A197-R200 PolarHBondContact O-N 3.49Å; M198-R200 PolarHBondContact O-N 3.05Å; R200-P204 VanDerWaalsContact O-CD 3.24Å; R200-P204 WeakPolarHBondContact O-CD 3.46Å
201L79.9Confident77Confident125 Ų12594.6 Ų94.665%0.65452%0.515SS*.Hα-helixtrans-84.7-33.4-177-65.4175.2000113.2A197 M198 P204 C205A197-L201 WeakPolarHBondContact O-CG 3.22Å; A197-L201 PolarHBondContact O-N 3.37Å; M198-L201 PolarHBondContact O-N 3.3Å; M198-L201 VanDerWaalsContact O-N 3.14Å; L201-P204 WeakPolarHBondContact O-CD 3.34Å; L201-C205 PolarHBondContact O-SG 3.42Å; L201-C205 VanDerWaalsContact O-SG 3.35Å
202I70.6Confident75.8Confident71 Ų7190.4 Ų90.436%0.36450%0.497SS..SBendtrans-79.5-33.1179.9-69.5-170000111.3M198 P204 C205 F206M198-I202 HydrophobicContact CG-CD1 3.2Å; M198-I202 HydrophobicContact CG-CG1 3.69Å; M198-I202 VanDerWaalsContact O-CB 3.25Å; M198-I202 WeakPolarHBondContact O-CB 3.26Å; M198-I202 WeakPolarHBondContact O-CG1 3.44Å; M198-I202 PolarHBondContact O-N 2.92Å; M198-I202 HydrophobicContact SD-CD1 3.75Å; I202-P204 VanDerWaalsContact C-N 3.34Å; I202-C205 PolarHBondContact O-N 3.31Å; I202-F206 HydrophobicContact CB-CD2 4.15Å; I202-F206 HydrophobicContact CG1-CD2 4.38Å; I202-F206 HydrophobicContact CG1-CE2 4.28Å; I202-F206 HydrophobicContact CG2-CB 4.22Å; I202-F206 HydrophobicContact CG2-CD2 3.48Å; I202-F206 VanDerWaalsContact CG2-CD2 3.48Å; I202-F206 HydrophobicContact CG2-CE2 4.14Å; I202-F206 HydrophobicContact CG2-CG 4.12Å; I202-F206 PolarHBondContact O-N 2.91Å; I202-F206 VanDerWaalsContact O-N 3.1Å
203K64.9Low74.9Confident85 Ų8591.7 Ų91.737%0.3750%0.504SS..Hα-helixtrans-54.3-39.8-176.3-160.1172.2-174.21630114.1G199 F212G199-K203 WeakPolarHBondContact O-CB 3.44Å; K203-F212 HydrophobicContact CD-CE2 4.47Å; K203-F212 HydrophobicContact CD-CZ 4.35Å
204P65.6Low74.2Confident93 Ų9392.9 Ų92.960%0.60451%0.507SS*.Hα-helixtrans-82.8-19174-12.531.3000114.1R200 L201 I202R200-P204 VanDerWaalsContact O-CD 3.24Å; R200-P204 WeakPolarHBondContact O-CD 3.46Å; L201-P204 WeakPolarHBondContact O-CD 3.34Å; I202-P204 VanDerWaalsContact C-N 3.34Å
205C64.9Low73.3Confident99 Ų9989.5 Ų89.567%0.66949%0.491SS*.Hα-helixtrans-94.3-22.8-169.6-69.40000114.6L201 I202L201-C205 PolarHBondContact O-SG 3.42Å; L201-C205 VanDerWaalsContact O-SG 3.35Å; I202-C205 PolarHBondContact O-N 3.31Å
206F58Low72.5Confident160 Ų16090.6 Ų90.670%0.70249%0.49SS*.Hα-helixtrans-122-16.1-171.4-73.2-89.2000115I202I202-F206 HydrophobicContact CB-CD2 4.15Å; I202-F206 HydrophobicContact CG1-CD2 4.38Å; I202-F206 HydrophobicContact CG1-CE2 4.28Å; I202-F206 HydrophobicContact CG2-CB 4.22Å; I202-F206 HydrophobicContact CG2-CD2 3.48Å; I202-F206 VanDerWaalsContact CG2-CD2 3.48Å; I202-F206 HydrophobicContact CG2-CE2 4.14Å; I202-F206 HydrophobicContact CG2-CG 4.12Å; I202-F206 PolarHBondContact O-N 2.91Å; I202-F206 VanDerWaalsContact O-N 3.1Å
207E57.1Low72Confident94 Ų9496 Ų9644%0.43950%0.498SS..SBendtrans-96.1126.6177-72.9173.6149.900109.1H209 F212E207-H209 PolarHBondContact O-N 3.3Å; E207-F212 HydrophobicContact CB-CB 4.03Å; E207-F212 WeakPolarHBondContact OE2-CD2 3.08Å; E207-F212 WeakPolarHBondContact OE2-CG 3.42Å
208D64.1Low71.4Confident137 Ų13795.3 Ų95.373%0.73349%0.486SS*.  trans-48.7109.1162.1-81.1-34.8000106.9A210 A211 F212D208-A210 CarbonylContact O-C 3.49Å; D208-A210 PolarHBondContact O-N 3.5Å; D208-A211 HydrophobicContact CB-CB 4.33Å; D208-A211 PolarHBondContact O-N 2.97Å; D208-F212 PolarHBondContact O-N 3.35Å
209H65.1Low71Confident137 Ų13791.2 Ų91.263%0.63447%0.466SS*.Hα-helixtrans-49.5-35.5-167.3-169.963.8000111.9E207 L213E207-H209 PolarHBondContact O-N 3.3Å; H209-L213 WeakPolarHBondContact CD2-CD1 3.46Å; H209-L213 WeakPolarHBondContact NE2-CD1 3.33Å; H209-L213 WeakPolarHBondContact O-CB 3.2Å; H209-L213 WeakPolarHBondContact O-CD1 3.15Å; H209-L213 VanDerWaalsContact O-CG 3.31Å; H209-L213 WeakPolarHBondContact O-CG 3.35Å; H209-L213 PolarHBondContact O-N 3.33Å
210A71.3Confident70.9Confident72 Ų7291.8 Ų91.860%0.59546%0.459SS*.Hα-helixtrans-62.1-44.8175.400000114.4D208 L213 Q214D208-A210 CarbonylContact O-C 3.49Å; D208-A210 PolarHBondContact O-N 3.5Å; A210-L213 PolarHBondContact O-N 2.97Å; A210-Q214 VanDerWaalsContact O-CB 3.24Å; A210-Q214 WeakPolarHBondContact O-CB 3.3Å; A210-Q214 PolarHBondContact O-N 3.49Å
211A71.1Confident71Confident48 Ų4885.2 Ų85.240%0.39743%0.434SS..Hα-helixtrans-70.4-37.5-177.700000112.1D208 T215D208-A211 HydrophobicContact CB-CB 4.33Å; D208-A211 PolarHBondContact O-N 2.97Å; A211-T215 WeakPolarHBondContact O-CB 3.32Å; A211-T215 PolarHBondContact O-N 3.09Å; A211-T215 PolarHBondContact O-OG1 2.94Å
212F70.9Confident70.9Confident33 Ų3379.5 Ų79.515%0.14540%0.404CS..Hα-helixtrans-66.9-47.5173.6175.5-97000111.7Y98 K203 E207 D208 Q214 T215 R216Y98-F212 HydrophobicContact CE2-CE2 4.02Å; K203-F212 HydrophobicContact CD-CE2 4.47Å; K203-F212 HydrophobicContact CD-CZ 4.35Å; E207-F212 HydrophobicContact CB-CB 4.03Å; E207-F212 WeakPolarHBondContact OE2-CD2 3.08Å; E207-F212 WeakPolarHBondContact OE2-CG 3.42Å; D208-F212 PolarHBondContact O-N 3.35Å; F212-Q214 VanDerWaalsContact C-N 3.3Å; F212-Q214 PolarHBondContact O-N 3Å; F212-T215 PolarHBondContact O-N 3.45Å; F212-R216 HydrophobicContact CE1-CB 4.44Å; F212-R216 HydrophobicContact CZ-CB 4.38Å; F212-R216 WeakPolarHBondContact O-CB 3.22Å; F212-R216 PolarHBondContact O-N 2.94Å
213L73.1Confident71.2Confident85 Ų8576.5 Ų76.545%0.44539%0.389SS..Hα-helixtrans-57.2-44.1175.5-83.5161.5000111.5H209 A210 R216 Y217H209-L213 WeakPolarHBondContact CD2-CD1 3.46Å; H209-L213 WeakPolarHBondContact NE2-CD1 3.33Å; H209-L213 WeakPolarHBondContact O-CB 3.2Å; H209-L213 WeakPolarHBondContact O-CD1 3.15Å; H209-L213 VanDerWaalsContact O-CG 3.31Å; H209-L213 WeakPolarHBondContact O-CG 3.35Å; H209-L213 PolarHBondContact O-N 3.33Å; A210-L213 PolarHBondContact O-N 2.97Å; L213-R216 PolarHBondContact O-N 3.48Å; L213-Y217 VanDerWaalsContact O-CB 3.26Å; L213-Y217 WeakPolarHBondContact O-CB 3.37Å; L213-Y217 PolarHBondContact O-N 3.05Å
214Q78.4Confident71.9Confident126 Ų12676.8 Ų76.859%0.58940%0.397SS*.Hα-helixtrans-61.9-43.4176.4-173.1-1796.400111.7A210 F212 Y217 W218A210-Q214 VanDerWaalsContact O-CB 3.24Å; A210-Q214 WeakPolarHBondContact O-CB 3.3Å; A210-Q214 PolarHBondContact O-N 3.49Å; F212-Q214 VanDerWaalsContact C-N 3.3Å; F212-Q214 PolarHBondContact O-N 3Å; Q214-Y217 PolarHBondContact O-N 3.36Å; Q214-W218 WeakPolarHBondContact O-CB 3.43Å; Q214-W218 PolarHBondContact O-N 2.81Å
215T74.5Confident72.7Confident23 Ų2373.1 Ų73.114%0.14137%0.373CS..Hα-helixtrans-64.6-43.9178.4-59.60000111.6V95 Y98 A211 F212 W218 S219V95-T215 HydrophobicContact CG2-CG2 4.01Å; Y98-T215 HydrophobicContact CD1-CG2 4.48Å; Y98-T215 HydrophobicContact CD2-CG2 4.24Å; Y98-T215 HydrophobicContact CG-CG2 3.88Å; A211-T215 WeakPolarHBondContact O-CB 3.32Å; A211-T215 PolarHBondContact O-N 3.09Å; A211-T215 PolarHBondContact O-OG1 2.94Å; F212-T215 PolarHBondContact O-N 3.45Å; T215-W218 PolarHBondContact O-N 2.9Å; T215-S219 WeakPolarHBondContact O-CB 3.44Å; T215-S219 PolarHBondContact O-N 3.44Å
216R73.5Confident73.4Confident94 Ų9470.2 Ų70.236%0.35535%0.349SS..Hα-helixtrans-63.7-45.1175.3-179.5179.9174.981.67.5111.6E17 F212 L213 S219 N220E17-R216 IonicContact OE2-NH2 2.79Å; F212-R216 HydrophobicContact CE1-CB 4.44Å; F212-R216 HydrophobicContact CZ-CB 4.38Å; F212-R216 WeakPolarHBondContact O-CB 3.22Å; F212-R216 PolarHBondContact O-N 2.94Å; L213-R216 PolarHBondContact O-N 3.48Å; R216-S219 PolarHBondContact O-N 3.01Å; R216-N220 PolarHBondContact O-N 3.03Å
217Y76.5Confident74.5Confident155 Ų15567 Ų6761%0.60834%0.335SS*.Hα-helixtrans-59.6-48176.5175.5-94.4000111L213 Q214 S219 N220 Y221L213-Y217 VanDerWaalsContact O-CB 3.26Å; L213-Y217 WeakPolarHBondContact O-CB 3.37Å; L213-Y217 PolarHBondContact O-N 3.05Å; Q214-Y217 PolarHBondContact O-N 3.36Å; Y217-S219 VanDerWaalsContact C-N 3.35Å; Y217-S219 PolarHBondContact O-N 2.79Å; Y217-N220 PolarHBondContact O-N 2.78Å; Y217-Y221 WeakPolarHBondContact O-CB 3.49Å; Y217-Y221 PolarHBondContact O-N 3.43Å
218W77.1Confident75.7Confident33 Ų3367.6 Ų67.613%0.12534%0.34CS..Hα-helixtrans-61.5-43.2178.9-164.5-108.9000112R89 V95 Q214 T215 N220 Y221 L222 L303R89-W218 VanDerWaalsContact CZ-CZ2 3.5Å; V95-W218 HydrophobicContact CB-CG 4.4Å; V95-W218 HydrophobicContact CG1-CB 4.16Å; V95-W218 HydrophobicContact CG1-CG 4.2Å; V95-W218 HydrophobicContact CG2-CB 3.78Å; V95-W218 VanDerWaalsContact CG2-CD1 3.41Å; V95-W218 HydrophobicContact CG2-CG 3.85Å; Q214-W218 WeakPolarHBondContact O-CB 3.43Å; Q214-W218 PolarHBondContact O-N 2.81Å; T215-W218 PolarHBondContact O-N 2.9Å; W218-N220 VanDerWaalsContact C-N 3.32Å; W218-N220 PolarHBondContact O-N 2.91Å; W218-Y221 HydrophobicContact CD2-CD1 4.49Å; W218-Y221 AromaticContact CE3-CD1 3.95Å; W218-Y221 HydrophobicContact CE3-CD1 3.95Å; W218-Y221 HydrophobicContact CE3-CG 4.43Å; W218-Y221 AromaticContact CH2-CD1 3.55Å; W218-Y221 HydrophobicContact CH2-CD1 3.55Å; W218-Y221 AromaticContact CH2-CE1 3.5Å; W218-Y221 HydrophobicContact CH2-CE1 3.5Å; W218-Y221 VanDerWaalsContact CH2-CE1 3.5Å; W218-Y221 HydrophobicContact CZ2-CD1 4.28Å; W218-Y221 HydrophobicContact CZ2-CE1 4.37Å; W218-Y221 AromaticContact CZ3-CD1 3.4Å; W218-Y221 HydrophobicContact CZ3-CD1 3.4Å; W218-Y221 VanDerWaalsContact CZ3-CD1 3.4Å; W218-Y221 AromaticContact CZ3-CE1 3.71Å; W218-Y221 HydrophobicContact CZ3-CE1 3.71Å; W218-Y221 HydrophobicContact CZ3-CG 4.09Å; W218-Y221 PolarHBondContact O-N 3.11Å; W218-L222 HydrophobicContact CZ2-CD2 4.3Å; W218-L222 VanDerWaalsContact O-CG 3.32Å; W218-L222 WeakPolarHBondContact O-CG 3.42Å; W218-L222 PolarHBondContact O-N 2.84Å; W218-L303 HydrophobicContact CE3-CD1 4.35Å; W218-L303 HydrophobicContact CH2-CD1 3.05Å; W218-L303 HydrophobicContact CH2-CD2 3.51Å; W218-L303 HydrophobicContact CH2-CG 3.68Å; W218-L303 HydrophobicContact CZ2-CD1 4.01Å; W218-L303 HydrophobicContact CZ3-CD1 3.24Å; W218-L303 HydrophobicContact CZ3-CD2 3.38Å; W218-L303 HydrophobicContact CZ3-CG 3.84Å
219S76.8Confident76.4Confident1 Ų163.7 Ų63.71%0.00732%0.317CS..Hα-helixtrans-57.4-44174.7179.90000112.2L99 T215 R216 Y217 D223L99-S219 VanDerWaalsContact CD2-OG 3.23Å; L99-S219 WeakPolarHBondContact CD2-OG 3.42Å; T215-S219 WeakPolarHBondContact O-CB 3.44Å; T215-S219 PolarHBondContact O-N 3.44Å; R216-S219 PolarHBondContact O-N 3.01Å; Y217-S219 VanDerWaalsContact C-N 3.35Å; Y217-S219 PolarHBondContact O-N 2.79Å; S219-D223 PolarHBondContact O-N 3Å
220N77.3Confident77.2Confident55 Ų5560.8 Ų60.829%0.29431%0.306SS..Hα-helixtrans-70-40.1177.9-76.6-3.7000112R216 Y217 W218 L222 D223 V224R216-N220 PolarHBondContact O-N 3.03Å; Y217-N220 PolarHBondContact O-N 2.78Å; W218-N220 VanDerWaalsContact C-N 3.32Å; W218-N220 PolarHBondContact O-N 2.91Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2Å; N220-D223 PolarHBondContact O-N 3.35Å; N220-V224 WeakPolarHBondContact O-CG2 3.33Å; N220-V224 PolarHBondContact O-N 3.21Å
221Y79.9Confident77.6Confident64 Ų6462 Ų6225%0.25130%0.3SS..Hα-helixtrans-58.4-45.2176.7170.5-95.3000111.4Y217 W218 D223 V224 E225 L303Y217-Y221 WeakPolarHBondContact O-CB 3.49Å; Y217-Y221 PolarHBondContact O-N 3.43Å; W218-Y221 HydrophobicContact CD2-CD1 4.49Å; W218-Y221 AromaticContact CE3-CD1 3.95Å; W218-Y221 HydrophobicContact CE3-CD1 3.95Å; W218-Y221 HydrophobicContact CE3-CG 4.43Å; W218-Y221 AromaticContact CH2-CD1 3.55Å; W218-Y221 HydrophobicContact CH2-CD1 3.55Å; W218-Y221 AromaticContact CH2-CE1 3.5Å; W218-Y221 HydrophobicContact CH2-CE1 3.5Å; W218-Y221 VanDerWaalsContact CH2-CE1 3.5Å; W218-Y221 HydrophobicContact CZ2-CD1 4.28Å; W218-Y221 HydrophobicContact CZ2-CE1 4.37Å; W218-Y221 AromaticContact CZ3-CD1 3.4Å; W218-Y221 HydrophobicContact CZ3-CD1 3.4Å; W218-Y221 VanDerWaalsContact CZ3-CD1 3.4Å; W218-Y221 AromaticContact CZ3-CE1 3.71Å; W218-Y221 HydrophobicContact CZ3-CE1 3.71Å; W218-Y221 HydrophobicContact CZ3-CG 4.09Å; W218-Y221 PolarHBondContact O-N 3.11Å; Y221-D223 VanDerWaalsContact C-N 3.31Å; Y221-D223 PolarHBondContact O-N 3.43Å; Y221-V224 PolarHBondContact O-N 3.09Å; Y221-E225 HydrophobicContact CE1-CB 4.35Å; Y221-E225 VanDerWaalsContact O-CB 3.29Å; Y221-E225 WeakPolarHBondContact O-CB 3.14Å; Y221-E225 PolarHBondContact O-N 3.47Å; Y221-E225 PolarHBondContact OH-OE1 3.27Å; Y221-L303 HydrophobicContact CD1-CD2 4.39Å; Y221-L303 HydrophobicContact CE1-CD2 3.7Å; Y221-L303 HydrophobicContact CE2-CD2 4.07Å; Y221-L303 WeakPolarHBondContact OH-CD2 3.3Å
222L78.6Confident78Confident4 Ų462.9 Ų62.92%0.02130%0.3CS..Hα-helixtrans-59.4-41.6177.8-68.6173.3000112.6V77 E81 V95 L99 W218 N220 Q226V77-L222 HydrophobicContact CG1-CB 3.97Å; E81-L222 HydrophobicContact CG-CD1 4.33Å; V95-L222 HydrophobicContact CG1-CD1 4.18Å; L99-L222 HydrophobicContact CD1-CD1 4.05Å; W218-L222 HydrophobicContact CZ2-CD2 4.3Å; W218-L222 VanDerWaalsContact O-CG 3.32Å; W218-L222 WeakPolarHBondContact O-CG 3.42Å; W218-L222 PolarHBondContact O-N 2.84Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2Å; L222-Q226 PolarHBondContact O-N 3.44Å; L222-Q226 VanDerWaalsContact O-N 3.15Å
223D76.4Confident78.3Confident8 Ų863.2 Ų63.24%0.04331%0.306CS..Hα-helixtrans-65.9-41.2178.6-172.948.3000112.2S16 R73 S219 N220 Y221 K227S16-D223 VanDerWaalsContact CB-OD2 3.27Å; S16-D223 WeakPolarHBondContact CB-OD2 3.49Å; S16-D223 PolarHBondContact OG-OD2 3.4Å; R73-D223 IonicContact CZ-OD1 3.77Å; R73-D223 VanDerWaalsContact CZ-OD1 3.28Å; R73-D223 IonicContact NE-OD1 3.12Å; R73-D223 PolarHBondContact NE-OD1 2.98Å; R73-D223 IonicContact NE-OD2 3.17Å; R73-D223 PolarHBondContact NH2-O 3.25Å; R73-D223 IonicContact NH2-OD1 3.01Å; R73-D223 PolarHBondContact NH2-OD1 2.83Å; R73-D223 VanDerWaalsContact NH2-OD1 3.08Å; S219-D223 PolarHBondContact O-N 3Å; N220-D223 PolarHBondContact O-N 3.35Å; Y221-D223 VanDerWaalsContact C-N 3.31Å; Y221-D223 PolarHBondContact O-N 3.43Å; D223-K227 PolarHBondContact O-N 2.89Å; D223-K227 VanDerWaalsContact O-N 3.16Å
224V80.6Confident78.6Confident91 Ų9163.9 Ų63.955%0.55231%0.313SS*.Hα-helixtrans-69.9-42.8177.1173.80000111.5N220 Y221 Q226 K227 L228N220-V224 WeakPolarHBondContact O-CG2 3.33Å; N220-V224 PolarHBondContact O-N 3.21Å; Y221-V224 PolarHBondContact O-N 3.09Å; V224-Q226 VanDerWaalsContact C-N 3.32Å; V224-Q226 PolarHBondContact O-N 3.22Å; V224-K227 PolarHBondContact O-N 2.94Å; V224-L228 WeakPolarHBondContact O-CB 3.35Å; V224-L228 PolarHBondContact O-N 3.43Å
225E81.8Confident78.7Confident17 Ų1762.1 Ų62.18%0.07931%0.308CS..Hα-helixtrans-55.1-48.2176.9178.3-176.7-132.900110.7R89 Y221 L228 F229 K300R89-E225 IonicContact CZ-OE2 3.08Å; R89-E225 IonicContact NH1-OE1 3.68Å; R89-E225 PolarHBondContact NH1-OE1 2.93Å; R89-E225 VanDerWaalsContact NH1-OE1 3.17Å; R89-E225 IonicContact NH1-OE2 2.69Å; R89-E225 PolarHBondContact NH1-OE2 3.12Å; R89-E225 IonicContact NH2-OE2 3.79Å; Y221-E225 HydrophobicContact CE1-CB 4.35Å; Y221-E225 VanDerWaalsContact O-CB 3.29Å; Y221-E225 WeakPolarHBondContact O-CB 3.14Å; Y221-E225 PolarHBondContact O-N 3.47Å; Y221-E225 PolarHBondContact OH-OE1 3.27Å; E225-L228 PolarHBondContact O-N 2.96Å; E225-F229 WeakPolarHBondContact O-CB 3.33Å; E225-F229 PolarHBondContact O-N 3.33Å; E225-K300 IonicContact OE2-NZ 2.77Å; E225-K300 PolarHBondContact OE2-NZ 2.87Å
226Q79.5Confident78.9Confident38 Ų3863.2 Ų63.218%0.17831%0.311CS..Hα-helixtrans-66.7-42.2179.6-174.4159.1-8.400112.3D80 L222 V224 L228 F229 D230D80-Q226 PolarHBondContact OD2-NE2 3.44Å; L222-Q226 PolarHBondContact O-N 3.44Å; L222-Q226 VanDerWaalsContact O-N 3.15Å; V224-Q226 VanDerWaalsContact C-N 3.32Å; V224-Q226 PolarHBondContact O-N 3.22Å; Q226-L228 PolarHBondContact O-N 2.97Å; Q226-F229 PolarHBondContact O-N 3.48Å; Q226-D230 PolarHBondContact O-N 2.76Å
227K80Confident79.1Confident93 Ų9361.3 Ų61.340%0.40432%0.315SS..Hα-helixtrans-60.4-45.6176.4-173.5178.1175.3-176.80111.9D223 V224 F229 D230 E231D223-K227 PolarHBondContact O-N 2.89Å; D223-K227 VanDerWaalsContact O-N 3.16Å; V224-K227 PolarHBondContact O-N 2.94Å; K227-F229 VanDerWaalsContact C-N 3.31Å; K227-F229 PolarHBondContact O-N 3.25Å; K227-D230 PolarHBondContact O-N 3.28Å; K227-E231 WeakPolarHBondContact CE-OE1 3.4Å; K227-E231 WeakPolarHBondContact O-CG 3.12Å; K227-E231 PolarHBondContact O-N 2.93Å
228L82.1Confident79.4Confident106 Ų10660.9 Ų60.956%0.55531%0.312SS*.Hα-helixtrans-66.2-36.9-179.8-171.665.6000111.6V224 E225 Q226 T232V224-L228 WeakPolarHBondContact O-CB 3.35Å; V224-L228 PolarHBondContact O-N 3.43Å; E225-L228 PolarHBondContact O-N 2.96Å; Q226-L228 PolarHBondContact O-N 2.97Å; L228-T232 WeakPolarHBondContact O-CB 3.35Å; L228-T232 PolarHBondContact O-N 3.37Å; L228-T232 PolarHBondContact O-OG1 2.77Å
229F80.6Confident79.5Confident55 Ų5561.1 Ų61.124%0.24132%0.316CS..Hα-helixtrans-62.1-50.3174.2-178.8-99.3000111.7E225 Q226 K227 E231 T232 C233 L293 W296E225-F229 WeakPolarHBondContact O-CB 3.33Å; E225-F229 PolarHBondContact O-N 3.33Å; Q226-F229 PolarHBondContact O-N 3.48Å; K227-F229 VanDerWaalsContact C-N 3.31Å; K227-F229 PolarHBondContact O-N 3.25Å; F229-E231 PolarHBondContact O-N 2.91Å; F229-T232 PolarHBondContact O-N 2.93Å; F229-T232 VanDerWaalsContact O-N 3.15Å; F229-C233 VanDerWaalsContact CE1-SG 3.59Å; F229-C233 VanDerWaalsContact CZ-SG 3.57Å; F229-C233 PolarHBondContact O-N 3.42Å; F229-L293 HydrophobicContact CZ-CD2 3.87Å; F229-W296 AromaticContact CD2-CD1 3.9Å; F229-W296 HydrophobicContact CD2-CD2 4.12Å; F229-W296 AromaticContact CD2-CE2 3.48Å; F229-W296 VanDerWaalsContact CD2-CE2 3.48Å; F229-W296 HydrophobicContact CD2-CG 4.36Å; F229-W296 AromaticContact CD2-CZ2 3.8Å; F229-W296 HydrophobicContact CD2-CZ2 3.8Å; F229-W296 AromaticContact CD2-NE1 3.32Å; F229-W296 VanDerWaalsContact CD2-NE1 3.32Å; F229-W296 AromaticContact CE2-CD1 3.32Å; F229-W296 AromaticContact CE2-CD2 3.88Å; F229-W296 HydrophobicContact CE2-CD2 3.88Å; F229-W296 AromaticContact CE2-CE2 3.66Å; F229-W296 AromaticContact CE2-CG 3.7Å; F229-W296 HydrophobicContact CE2-CG 3.7Å; F229-W296 HydrophobicContact CE2-CZ2 4.41Å; F229-W296 AromaticContact CE2-NE1 3.27Å; F229-W296 VanDerWaalsContact CE2-NE1 3.27Å; F229-W296 HydrophobicContact CG-CZ2 4.47Å; F229-W296 AromaticContact CG-NE1 3.86Å; F229-W296 AromaticContact CZ-CD1 3.58Å; F229-W296 HydrophobicContact CZ-CG 4.24Å; F229-W296 AromaticContact CZ-NE1 3.78Å
230D80.3Confident79.4Confident75 Ų7565 Ų6540%0.40133%0.333SS..Hα-helixtrans-59.1-45178.7-68.1-22.7000111.7Q226 K227 T232 C233 V234Q226-D230 PolarHBondContact O-N 2.76Å; K227-D230 PolarHBondContact O-N 3.28Å; D230-T232 VanDerWaalsContact C-N 3.32Å; D230-T232 PolarHBondContact O-N 3.46Å; D230-C233 PolarHBondContact O-N 3.43Å; D230-V234 WeakPolarHBondContact O-CG2 3.41Å; D230-V234 PolarHBondContact O-N 3.15Å
231E80.4Confident79.6Confident99 Ų9964.7 Ų64.746%0.46334%0.338SS..Hα-helixtrans-60.3-41.6176.5-74.4175.9-175.200111.8K227 F229 V234 L235K227-E231 WeakPolarHBondContact CE-OE1 3.4Å; K227-E231 WeakPolarHBondContact O-CG 3.12Å; K227-E231 PolarHBondContact O-N 2.93Å; F229-E231 PolarHBondContact O-N 2.91Å; E231-V234 PolarHBondContact O-N 2.95Å; E231-L235 WeakPolarHBondContact O-CG 3.46Å; E231-L235 PolarHBondContact O-N 2.96Å; E231-L235 VanDerWaalsContact O-N 3.13Å
232T79.4Confident79.6Confident66 Ų6668.1 Ų68.141%0.40535%0.351SS..Hα-helixtrans-66.6-41.8177.4-54.20000111.5L228 F229 D230 V234 L235 H236L228-T232 WeakPolarHBondContact O-CB 3.35Å; L228-T232 PolarHBondContact O-N 3.37Å; L228-T232 PolarHBondContact O-OG1 2.77Å; F229-T232 PolarHBondContact O-N 2.93Å; F229-T232 VanDerWaalsContact O-N 3.15Å; D230-T232 VanDerWaalsContact C-N 3.32Å; D230-T232 PolarHBondContact O-N 3.46Å; T232-V234 VanDerWaalsContact C-N 3.35Å; T232-V234 PolarHBondContact O-N 3.38Å; T232-L235 PolarHBondContact O-N 3.25Å; T232-H236 PolarHBondContact O-N 2.9Å
233C76.7Confident79.6Confident40 Ų4072.6 Ų72.627%0.2737%0.37SS..Hα-helixtrans-61.7-40.9175.4-76.40000112.2F229 D230 H236 A237F229-C233 VanDerWaalsContact CE1-SG 3.59Å; F229-C233 VanDerWaalsContact CZ-SG 3.57Å; F229-C233 PolarHBondContact O-N 3.42Å; D230-C233 PolarHBondContact O-N 3.43Å; C233-H236 PolarHBondContact O-N 3.41Å; C233-A237 VanDerWaalsContact O-CB 3.24Å; C233-A237 WeakPolarHBondContact O-CB 3.48Å; C233-A237 PolarHBondContact O-N 3.23Å
234V80.2Confident79.5Confident99 Ų9974.8 Ų74.860%0.639%0.386SS*.Hα-helixtrans-63.5-44177169.50000111.3D230 E231 T232 A237 R238D230-V234 WeakPolarHBondContact O-CG2 3.41Å; D230-V234 PolarHBondContact O-N 3.15Å; E231-V234 PolarHBondContact O-N 2.95Å; T232-V234 VanDerWaalsContact C-N 3.35Å; T232-V234 PolarHBondContact O-N 3.38Å; V234-A237 PolarHBondContact O-N 3.16Å; V234-R238 WeakPolarHBondContact O-CB 3.29Å; V234-R238 PolarHBondContact O-N 2.86Å
235L80.2Confident79.5Confident89 Ų8974.3 Ų74.347%0.46638%0.383SS..Hα-helixtrans-60.8-50.1176.2-71.5171.5000110.9E231 T232 A237 R238 D239E231-L235 WeakPolarHBondContact O-CG 3.46Å; E231-L235 PolarHBondContact O-N 2.96Å; E231-L235 VanDerWaalsContact O-N 3.13Å; T232-L235 PolarHBondContact O-N 3.25Å; L235-A237 VanDerWaalsContact C-N 3.35Å; L235-A237 PolarHBondContact O-N 2.86Å; L235-R238 WeakPolarHBondContact O-CB 3.23Å; L235-R238 PolarHBondContact O-N 3.16Å; L235-R238 VanDerWaalsContact O-N 3.16Å; L235-D239 PolarHBondContact O-N 2.97Å
236H79.3Confident79.4Confident45 Ų4576.7 Ų76.721%0.20840%0.398CS..Hα-helixtrans-59.7-42.9177.4-109.2-66000112.8T232 C233 R238 D239 F240 H281 M289T232-H236 PolarHBondContact O-N 2.9Å; C233-H236 PolarHBondContact O-N 3.41Å; H236-R238 VanDerWaalsContact C-N 3.31Å; H236-R238 PolarHBondContact O-N 2.94Å; H236-D239 PolarHBondContact O-N 3.01Å; H236-F240 WeakPolarHBondContact O-CB 3.44Å; H236-F240 PolarHBondContact O-N 3.42Å; H236-H281 PolarHBondContact CE1-O 3.33Å; H236-M289 HydrophobicContact CB-CE 4.28Å
237A77.5Confident79.3Confident54 Ų5480.3 Ų80.345%0.44642%0.415SS..Hα-helixtrans-63.8-37.9177.600000111.7C233 V234 L235 A241C233-A237 VanDerWaalsContact O-CB 3.24Å; C233-A237 WeakPolarHBondContact O-CB 3.48Å; C233-A237 PolarHBondContact O-N 3.23Å; V234-A237 PolarHBondContact O-N 3.16Å; L235-A237 VanDerWaalsContact C-N 3.35Å; L235-A237 PolarHBondContact O-N 2.86Å; A237-A241 VanDerWaalsContact O-CB 3.3Å; A237-A241 WeakPolarHBondContact O-CB 3.48Å; A237-A241 PolarHBondContact O-N 3.01Å
238R82.1Confident79.3Confident146 Ų14681.7 Ų81.755%0.55142%0.421SS*.Hα-helixtrans-64.5-44.6176.3-165.8-173.284.11715.5111.6V234 L235 H236 A241 R242V234-R238 WeakPolarHBondContact O-CB 3.29Å; V234-R238 PolarHBondContact O-N 2.86Å; L235-R238 WeakPolarHBondContact O-CB 3.23Å; L235-R238 PolarHBondContact O-N 3.16Å; L235-R238 VanDerWaalsContact O-N 3.16Å; H236-R238 VanDerWaalsContact C-N 3.31Å; H236-R238 PolarHBondContact O-N 2.94Å; R238-A241 PolarHBondContact O-N 3.22Å; R238-R242 WeakPolarHBondContact O-CB 3.26Å; R238-R242 PolarHBondContact O-N 2.64Å
239D79.1Confident79Confident39 Ų3982.6 Ų82.621%0.20942%0.421CS..Hα-helixtrans-69.7-39-179.2-65.3-20.3000111.2L235 H236 R242 K243L235-D239 PolarHBondContact O-N 2.97Å; H236-D239 PolarHBondContact O-N 3.01Å; D239-R242 PolarHBondContact O-N 3.42Å; D239-K243 WeakPolarHBondContact O-CG 3.36Å; D239-K243 PolarHBondContact O-N 3.29Å
240F75.2Confident78.8Confident82 Ų8285.2 Ų85.236%0.3643%0.434SS..Hα-helixtrans-59.7-49.2171.4-177.4-102.6000111.6H236 R242 K243 C244H236-F240 WeakPolarHBondContact O-CB 3.44Å; H236-F240 PolarHBondContact O-N 3.42Å; F240-R242 VanDerWaalsContact C-N 3.31Å; F240-R242 PolarHBondContact O-N 2.88Å; F240-K243 PolarHBondContact O-N 2.77Å; F240-C244 PolarHBondContact O-N 3.26Å; F240-C244 PolarHBondContact O-SG 3.01Å; F240-C244 VanDerWaalsContact O-SG 3.38Å
241A82.5Confident78.4Confident49 Ų4985.4 Ų85.441%0.40544%0.435SS..Hα-helixtrans-60.2-39.7177.200000112.2A237 R238 C244 V245A237-A241 VanDerWaalsContact O-CB 3.3Å; A237-A241 WeakPolarHBondContact O-CB 3.48Å; A237-A241 PolarHBondContact O-N 3.01Å; R238-A241 PolarHBondContact O-N 3.22Å; A241-C244 PolarHBondContact O-N 3.43Å; A241-V245 WeakPolarHBondContact O-CB 3.34Å; A241-V245 VanDerWaalsContact O-CG2 3.26Å; A241-V245 WeakPolarHBondContact O-CG2 3.34Å; A241-V245 PolarHBondContact O-N 3.44Å
242R80.3Confident77.7Confident135 Ų13585.4 Ų85.451%0.50944%0.436SS..Hα-helixtrans-58.7-48.9174.9173.1-179.4-89.7158-12.6111.2R238 D239 F240 C244 V245 V246R238-R242 WeakPolarHBondContact O-CB 3.26Å; R238-R242 PolarHBondContact O-N 2.64Å; D239-R242 PolarHBondContact O-N 3.42Å; F240-R242 VanDerWaalsContact C-N 3.31Å; F240-R242 PolarHBondContact O-N 2.88Å; R242-C244 PolarHBondContact O-N 3.41Å; R242-V245 PolarHBondContact O-N 2.94Å; R242-V246 HydrophobicContact CG-CG2 4.42Å; R242-V246 WeakPolarHBondContact O-CG2 3.43Å; R242-V246 PolarHBondContact O-N 2.93Å
243K78.6Confident76.8Confident98 Ų9886 Ų8643%0.42644%0.44SS..Hα-helixtrans-60.6-44.8179.5-70.6178-178.1-179.10111.7D239 F240 V245 V246 Q247D239-K243 WeakPolarHBondContact O-CG 3.36Å; D239-K243 PolarHBondContact O-N 3.29Å; F240-K243 PolarHBondContact O-N 2.77Å; K243-V245 PolarHBondContact O-N 2.82Å; K243-V246 PolarHBondContact O-N 3.49Å; K243-Q247 WeakPolarHBondContact O-CB 3.36Å; K243-Q247 PolarHBondContact O-N 3.41Å
244C73.8Confident75.9Confident55 Ų5590.3 Ų90.337%0.37246%0.456SS..Hα-helixtrans-61.8-40.7176.3-64.40000113F240 A241 R242 F248F240-C244 PolarHBondContact O-N 3.26Å; F240-C244 PolarHBondContact O-SG 3.01Å; F240-C244 VanDerWaalsContact O-SG 3.38Å; A241-C244 PolarHBondContact O-N 3.43Å; R242-C244 PolarHBondContact O-N 3.41Å; C244-F248 WeakPolarHBondContact O-CB 3.39Å; C244-F248 PolarHBondContact O-N 3.45Å
245V79.6Confident74.8Confident80 Ų8090.7 Ų90.749%0.48546%0.455SS..Hα-helixtrans-68-43.9178.7170.90000111.2A241 R242 K243 F248 F249A241-V245 WeakPolarHBondContact O-CB 3.34Å; A241-V245 VanDerWaalsContact O-CG2 3.26Å; A241-V245 WeakPolarHBondContact O-CG2 3.34Å; A241-V245 PolarHBondContact O-N 3.44Å; R242-V245 PolarHBondContact O-N 2.94Å; K243-V245 PolarHBondContact O-N 2.82Å; V245-F248 PolarHBondContact O-N 3.42Å; V245-F249 HydrophobicContact CG1-CD2 3.82Å; V245-F249 HydrophobicContact CG1-CE2 3.67Å; V245-F249 WeakPolarHBondContact O-CD2 3.42Å; V245-F249 PolarHBondContact O-N 3.31Å
246V79.9Confident73.4Confident68 Ų6890.5 Ų90.541%0.41246%0.461SS..Hα-helixtrans-60.9-49.7177.2170.70000110.4R242 K243 F248 F249 E250R242-V246 HydrophobicContact CG-CG2 4.42Å; R242-V246 WeakPolarHBondContact O-CG2 3.43Å; R242-V246 PolarHBondContact O-N 2.93Å; K243-V246 PolarHBondContact O-N 3.49Å; V246-F248 VanDerWaalsContact C-N 3.3Å; V246-F248 PolarHBondContact O-N 3Å; V246-F249 PolarHBondContact O-N 3.38Å; V246-E250 HydrophobicContact CG1-CG 4.28Å; V246-E250 WeakPolarHBondContact CG1-OE1 3.3Å; V246-E250 WeakPolarHBondContact O-CG 3.27Å; V246-E250 PolarHBondContact O-N 2.94Å
247Q77.6Confident72.1Confident113 Ų11393.8 Ų93.853%0.52848%0.479SS..Hα-helixtrans-56.8-43.1178-172.7178.6-3.500112K243 F249 E250 D251K243-Q247 WeakPolarHBondContact O-CB 3.36Å; K243-Q247 PolarHBondContact O-N 3.41Å; Q247-F249 VanDerWaalsContact C-N 3.32Å; Q247-F249 PolarHBondContact O-N 2.91Å; Q247-E250 PolarHBondContact O-N 3.5Å; Q247-D251 WeakPolarHBondContact O-CB 3.2Å; Q247-D251 VanDerWaalsContact O-CG 3.24Å; Q247-D251 PolarHBondContact O-N 3.35Å
248F79.3Confident70.6Confident122 Ų12298.3 Ų98.354%0.53550%0.495SS..Hα-helixtrans-59-41.3176.3174.1-95.8000113C244 V245 V246 M252C244-F248 WeakPolarHBondContact O-CB 3.39Å; C244-F248 PolarHBondContact O-N 3.45Å; V245-F248 PolarHBondContact O-N 3.42Å; V246-F248 VanDerWaalsContact C-N 3.3Å; V246-F248 PolarHBondContact O-N 3Å; F248-M252 HydrophobicContact CE1-CG 4.22Å; F248-M252 HydrophobicContact CE2-CG 4.46Å; F248-M252 HydrophobicContact CZ-CG 4.13Å; F248-M252 VanDerWaalsContact O-CG 3.26Å; F248-M252 WeakPolarHBondContact O-CG 3.44Å; F248-M252 PolarHBondContact O-N 2.97Å
249F75.8Confident68.8Low125 Ų12599.3 Ų99.355%0.54851%0.505SS..Hα-helixtrans-75.6-32.7178.9-77.9-67.8000112.8V245 V246 Q247 T253V245-F249 HydrophobicContact CG1-CD2 3.82Å; V245-F249 HydrophobicContact CG1-CE2 3.67Å; V245-F249 WeakPolarHBondContact O-CD2 3.42Å; V245-F249 PolarHBondContact O-N 3.31Å; V246-F249 PolarHBondContact O-N 3.38Å; Q247-F249 VanDerWaalsContact C-N 3.32Å; Q247-F249 PolarHBondContact O-N 2.91Å; F249-T253 WeakPolarHBondContact O-CB 3.25Å; F249-T253 PolarHBondContact O-N 2.93Å; F249-T253 PolarHBondContact O-OG1 3.48Å
250E76.6Confident66.8Low111 Ų111104 Ų10452%0.51953%0.529SS..Hα-helixtrans-64.3-48.5172.6-73.2173.9169.200110.8V246 Q247 M252 T253 E254V246-E250 HydrophobicContact CG1-CG 4.28Å; V246-E250 WeakPolarHBondContact CG1-OE1 3.3Å; V246-E250 WeakPolarHBondContact O-CG 3.27Å; V246-E250 PolarHBondContact O-N 2.94Å; Q247-E250 PolarHBondContact O-N 3.5Å; E250-M252 VanDerWaalsContact C-N 3.31Å; E250-M252 PolarHBondContact O-N 3.32Å; E250-T253 CarbonylContact O-C 3.6Å; E250-T253 WeakPolarHBondContact O-CA 3.36Å; E250-T253 WeakPolarHBondContact O-CB 3.33Å; E250-T253 PolarHBondContact O-N 3.44Å; E250-E254 PolarHBondContact O-N 2.89Å
251D71.6Confident64.9Low79 Ų79105.7 Ų105.742%0.42255%0.549SS..Hα-helixtrans-55.7-45175.9-69.5-13000111.3Q247 T253 E254 D255Q247-D251 WeakPolarHBondContact O-CB 3.2Å; Q247-D251 VanDerWaalsContact O-CG 3.24Å; Q247-D251 PolarHBondContact O-N 3.35Å; D251-T253 VanDerWaalsContact C-N 3.28Å; D251-T253 PolarHBondContact O-N 3.47Å; D251-E254 PolarHBondContact O-N 3.46Å; D251-D255 WeakPolarHBondContact O-CB 3.33Å; D251-D255 PolarHBondContact O-N 3.34Å
252M65.7Low62.5Low99 Ų99112 Ų11249%0.48857%0.57SS.*Hα-helixtrans-65.3-29.5176.2-72.8-68-59.900113.7F248 E250 S256F248-M252 HydrophobicContact CE1-CG 4.22Å; F248-M252 HydrophobicContact CE2-CG 4.46Å; F248-M252 HydrophobicContact CZ-CG 4.13Å; F248-M252 VanDerWaalsContact O-CG 3.26Å; F248-M252 WeakPolarHBondContact O-CG 3.44Å; F248-M252 PolarHBondContact O-N 2.97Å; E250-M252 VanDerWaalsContact C-N 3.31Å; E250-M252 PolarHBondContact O-N 3.32Å; M252-S256 WeakPolarHBondContact O-CB 3.24Å; M252-S256 PolarHBondContact O-N 3.29Å; M252-S256 PolarHBondContact O-OG 2.94Å
253T62.4Low60.4Low78 Ų78111.1 Ų111.148%0.47958%0.581SS.*Hα-helixtrans-78.6-40.5178.3-54.80000110.3F249 E250 D251 S256 I257F249-T253 WeakPolarHBondContact O-CB 3.25Å; F249-T253 PolarHBondContact O-N 2.93Å; F249-T253 PolarHBondContact O-OG1 3.48Å; E250-T253 CarbonylContact O-C 3.6Å; E250-T253 WeakPolarHBondContact O-CA 3.36Å; E250-T253 WeakPolarHBondContact O-CB 3.33Å; E250-T253 PolarHBondContact O-N 3.44Å; D251-T253 VanDerWaalsContact C-N 3.28Å; D251-T253 PolarHBondContact O-N 3.47Å; T253-S256 WeakPolarHBondContact O-CB 3.18Å; T253-S256 PolarHBondContact O-N 3.27Å; T253-I257 HydrophobicContact CG2-CD1 3.89Å; T253-I257 WeakPolarHBondContact O-CD1 3.28Å; T253-I257 WeakPolarHBondContact O-CG1 3.38Å; T253-I257 PolarHBondContact O-N 3.29Å
254E57.6Low58.7Low130 Ų130112 Ų11261%0.60760%0.597SS**Hα-helixtrans-64.4-42.4173-69.5-165.6164.300111.9E250 D251 S256 I257 L258E250-E254 PolarHBondContact O-N 2.89Å; D251-E254 PolarHBondContact O-N 3.46Å; E254-S256 VanDerWaalsContact C-N 3.25Å; E254-S256 PolarHBondContact O-N 3.04Å; E254-I257 PolarHBondContact O-N 3.27Å; E254-L258 PolarHBondContact O-N 2.85Å
255D55.8Low56.9Low107 Ų107118.6 Ų118.657%0.57262%0.62SS**Hα-helixtrans-61.6-33.2173-79.4-19.5000112.1D251D251-D255 WeakPolarHBondContact O-CB 3.33Å; D251-D255 PolarHBondContact O-N 3.34Å
256S51.5Low54.7Low85 Ų85121.9 Ų121.959%0.59463%0.633SS**Hα-helixtrans-74.5-31.1172.9-69.50000113.1M252 T253 E254M252-S256 WeakPolarHBondContact O-CB 3.24Å; M252-S256 PolarHBondContact O-N 3.29Å; M252-S256 PolarHBondContact O-OG 2.94Å; T253-S256 WeakPolarHBondContact O-CB 3.18Å; T253-S256 PolarHBondContact O-N 3.27Å; E254-S256 VanDerWaalsContact C-N 3.25Å; E254-S256 PolarHBondContact O-N 3.04Å
257I51.9Low52.5Low115 Ų115122.6 Ų122.659%0.5964%0.641SS**Hα-helixtrans-79.5-26.1179.3-68.9165.8000111.5T253 E254 H259 L260T253-I257 HydrophobicContact CG2-CD1 3.89Å; T253-I257 WeakPolarHBondContact O-CD1 3.28Å; T253-I257 WeakPolarHBondContact O-CG1 3.38Å; T253-I257 PolarHBondContact O-N 3.29Å; E254-I257 PolarHBondContact O-N 3.27Å; I257-H259 PolarHBondContact O-N 3.22Å; I257-L260 PolarHBondContact O-N 3.47Å
258L46Very low50.4Low148 Ų148124.4 Ų124.478%0.77565%0.654SS**THydrogen-bonded Turntrans-64.3-8.3177.8-137.295000114.4E254E254-L258 PolarHBondContact O-N 2.85Å
259H43.4Very low48.1Very low168 Ų168124.8 Ų124.878%0.77867%0.667SS**THydrogen-bonded Turntrans-99.66178-83.2-64.5000115.9I257I257-H259 PolarHBondContact O-N 3.22Å
260L38.5Very low46.1Very low136 Ų136123.3 Ų123.371%0.71267%0.672SS**SBendtrans-115.3133.4171.2-101.182.6000112.7I257 H262I257-L260 PolarHBondContact O-N 3.47Å; L260-H262 PolarHBondContact O-N 3.46Å
261P34.7Very low44.1Very low119 Ų119126.7 Ų126.777%0.77369%0.688SS**  trans-67.5131.2173.918.9-15.2000110.2
262H31.2Very low42.1Very low182 Ų182132.6 Ų132.684%0.84370%0.704SS**  trans-48.7151-179.1-81.536.2000114.4L260L260-H262 PolarHBondContact O-N 3.46Å
263P38Very low40.5Very low115 Ų115138.1 Ų138.175%0.74772%0.72SS**  trans-116.8155.6134.733.8-23.5000111.7
264P42.6Very low39.4Very low118 Ų118141.7 Ų141.777%0.76673%0.731SS**  trans-86.9146.4-167.833.9-32.5000113.5
265F35.4Very low38.3Very low193 Ų193142.4 Ų142.485%0.84673%0.734SS**  trans79115.7151.8-119.6-101.5000119.5
266I33.9Very low37.3Very low149 Ų149146.6 Ų146.676%0.76475%0.75SS**  178.1123.5102.8-82.8165.5000111.5
267S32.8Very low36.6Very low83 Ų83148.6 Ų148.658%0.5875%0.75SS**  trans20.1138.2147102.50000124.6
268N33.1Very low36Very low150 Ų150151.2 Ų151.280%0.80276%0.76SS**  trans67.678.5135.6-62.91.3000119.1
269V31.5Very low35.6Very low131 Ų131154.4 Ų154.479%0.79476%0.762SS**  trans-145.734.7160.2-158.30000113.2
270S34.7Very low35.4Very low94 Ų94151.5 Ų151.566%0.65775%0.751SS**SBendtrans-113.9-14179.3-159.70000115.9R272S270-R272 PolarHBondContact O-N 2.9Å
271E34.6Very low36Very low182 Ų182151.4 Ų151.485%0.8575%0.747SS**THydrogen-bonded Turntrans-88.26.7-171.4-76-174.4160.700115.4
272R29.4Very low36.7Very low203 Ų203149 Ų14977%0.76674%0.744SS**THydrogen-bonded Turntrans-109.7-7.2-171.7-160.358.5-179.3179.36.8116.2S270S270-R272 PolarHBondContact O-N 2.9Å
273W31.9Very low37.7Very low215 Ų215141.6 Ų141.681%0.81471%0.712SS**SBendtrans-104.9-7.5-176.3-63.587.8000114
274E38.8Very low38.6Very low153 Ų153140.6 Ų140.672%0.71570%0.703SS**SBendtrans-85.6-21.8-177.4-69.8-171152.800114.3
275E35.4Very low39.4Very low144 Ų144143.1 Ų143.167%0.67370%0.697SS**SBendtrans-84-13.4-167.1-72.9-172.8149.200116
276E35.1Very low40.7Very low195 Ų195140.7 Ų140.791%0.91169%0.689SS**SBendtrans-108.2-15.5-178-76.2-167.7159.300115.4
277E36.3Very low42.3Very low128 Ų128140.2 Ų140.260%0.59868%0.683SS**SBendtrans-88.4-5175.7-90.5-167.2164.200114.1R279E277-R279 PolarHBondContact O-N 3.27Å
278E38.7Very low44.1Very low170 Ų170140.3 Ų140.379%0.79468%0.675SS**THydrogen-bonded Turntrans-71.72.4-172-126-173-179.100115.6
279R37.4Very low45.9Very low214 Ų214135.4 Ų135.481%0.80865%0.647SS**THydrogen-bonded Turntrans-99.6-3-179.4-71.6-170.2176.5176.91.5116E277 H281E277-R279 PolarHBondContact O-N 3.27Å; R279-H281 PolarHBondContact O-ND1 3.15Å
280L40.6Very low47.8Very low107 Ų107132.6 Ų132.656%0.5663%0.628SS**SBendtrans-114.270.3168.3-77.7107.3000112.3
281H50.7Low49.8Very low134 Ų134134.5 Ų134.562%0.6263%0.626SS**  trans45.283.3146.5-66.755.3000117.1H236 R279 V283H236-H281 PolarHBondContact CE1-O 3.33Å; R279-H281 PolarHBondContact O-ND1 3.15Å; H281-V283 PolarHBondContact O-N 2.94Å
282G48.5Very low51.8Low69 Ų69130.4 Ų130.471%0.71161%0.61SS**  41.25.4124.500000124
283V52.9Low54.1Low27 Ų27123.7 Ų123.716%0.16459%0.589CS.*  trans-99.9100.8179.3-177.60000108.8H281 Q288 M289 L292H281-V283 PolarHBondContact O-N 2.94Å; V283-Q288 HydrophobicContact CG1-CB 4.16Å; V283-M289 HydrophobicContact CG1-CB 3.87Å; V283-L292 HydrophobicContact CG2-CD1 4.49Å
284T56.1Low56.2Low93 Ų93117.5 Ų117.557%0.57157%0.572SS**  trans-108.5-10.8-179.448.50000113
285R60.1Low58.2Low171 Ų171118.1 Ų118.165%0.64557%0.572SS**SBendtrans-124.1144.1-179.4-69.1-174.2178.7174.21.2112.6E287 Q288 M289R285-E287 VanDerWaalsContact C-N 3.3Å; R285-E287 PolarHBondContact O-N 2.85Å; R285-Q288 HydrophobicContact CB-CG 4.49Å; R285-Q288 PolarHBondContact O-N 3.41Å; R285-Q288 VanDerWaalsContact O-N 3.13Å; R285-M289 PolarHBondContact O-N 2.79Å
286Q63.2Low60.1Low142 Ų142115.2 Ų115.266%0.66456%0.555SS**Hα-helixtrans-53.3-43.6176.8-176.8178.5-15.800112.5Q288 M289 D290Q286-Q288 VanDerWaalsContact C-N 3.31Å; Q286-Q288 PolarHBondContact O-N 3.4Å; Q286-M289 WeakPolarHBondContact O-CB 3.45Å; Q286-M289 PolarHBondContact O-N 3.14Å; Q286-M289 VanDerWaalsContact O-N 3.13Å; Q286-D290 PolarHBondContact O-N 3.1Å
287E67.5Low62Low139 Ų139111 Ų11165%0.6553%0.532SS*.Hα-helixtrans-61.5-35.3-179.9-64.1179.3170.700113.4R285 D290 Q291R285-E287 VanDerWaalsContact C-N 3.3Å; R285-E287 PolarHBondContact O-N 2.85Å; E287-D290 PolarHBondContact O-N 2.93Å; E287-Q291 WeakPolarHBondContact O-CB 3.22Å; E287-Q291 VanDerWaalsContact O-CG 3.26Å; E287-Q291 WeakPolarHBondContact O-CG 3.39Å; E287-Q291 PolarHBondContact O-N 2.89Å
288Q69.4Low63.8Low85 Ų85111.8 Ų111.840%0.39753%0.53SS..Hα-helixtrans-71.1-36.2177.5-70.7177.9-18.400111.4V283 R285 Q286 L292V283-Q288 HydrophobicContact CG1-CB 4.16Å; R285-Q288 HydrophobicContact CB-CG 4.49Å; R285-Q288 PolarHBondContact O-N 3.41Å; R285-Q288 VanDerWaalsContact O-N 3.13Å; Q286-Q288 VanDerWaalsContact C-N 3.31Å; Q286-Q288 PolarHBondContact O-N 3.4Å; Q288-L292 WeakPolarHBondContact O-CB 3.4Å; Q288-L292 PolarHBondContact O-N 3.18Å
289M70.8Confident65.3Low47 Ų47104.8 Ų104.823%0.23250%0.503CS..Hα-helixtrans-64-48.4172.9-17762.1108.300110.6H236 V283 R285 Q286 Q291 L292 L293H236-M289 HydrophobicContact CB-CE 4.28Å; V283-M289 HydrophobicContact CG1-CB 3.87Å; R285-M289 PolarHBondContact O-N 2.79Å; Q286-M289 WeakPolarHBondContact O-CB 3.45Å; Q286-M289 PolarHBondContact O-N 3.14Å; Q286-M289 VanDerWaalsContact O-N 3.13Å; M289-Q291 VanDerWaalsContact C-N 3.3Å; M289-Q291 PolarHBondContact O-N 2.95Å; M289-L292 PolarHBondContact O-N 2.8Å; M289-L292 VanDerWaalsContact O-N 3.09Å; M289-L293 HydrophobicContact CG-CD1 3.9Å; M289-L293 HydrophobicContact CG-CG 4.31Å; M289-L293 WeakPolarHBondContact O-CG 3.31Å; M289-L293 PolarHBondContact O-N 3.35Å; M289-L293 HydrophobicContact SD-CD1 4.24Å; M289-L293 HydrophobicContact SD-CG 4.17Å
290D71.4Confident67Low72 Ų7296 Ų9639%0.38547%0.471SS..Hα-helixtrans-61.2-39.1179.7-70.1-20.2000111.6Q286 E287 N294Q286-D290 PolarHBondContact O-N 3.1Å; E287-D290 PolarHBondContact O-N 2.93Å; D290-N294 VanDerWaalsContact O-CB 3.25Å; D290-N294 WeakPolarHBondContact O-CB 3.22Å; D290-N294 PolarHBondContact O-N 3.43Å; D290-N294 PolarHBondContact O-ND2 3.25Å
291Q77.1Confident68.1Low134 Ų13493.7 Ų93.763%0.62646%0.463SS*.Hα-helixtrans-64.6-41.3173.4-75.1175.610.200112.5E287 M289 K295E287-Q291 WeakPolarHBondContact O-CB 3.22Å; E287-Q291 VanDerWaalsContact O-CG 3.26Å; E287-Q291 WeakPolarHBondContact O-CG 3.39Å; E287-Q291 PolarHBondContact O-N 2.89Å; M289-Q291 VanDerWaalsContact C-N 3.3Å; M289-Q291 PolarHBondContact O-N 2.95Å; Q291-K295 WeakPolarHBondContact O-CB 3.46Å; Q291-K295 PolarHBondContact O-N 3.33Å
292L76.9Confident68.9Low96 Ų9693.2 Ų93.250%0.50346%0.461SS..Hα-helixtrans-68.3-44-180-169.3144.8000111.7V283 Q288 M289 K295 W296V283-L292 HydrophobicContact CG2-CD1 4.49Å; Q288-L292 WeakPolarHBondContact O-CB 3.4Å; Q288-L292 PolarHBondContact O-N 3.18Å; M289-L292 PolarHBondContact O-N 2.8Å; M289-L292 VanDerWaalsContact O-N 3.09Å; L292-K295 PolarHBondContact O-N 3.47Å; L292-W296 PolarHBondContact O-N 2.9Å
293L77.8Confident69.3Low63 Ų6394.5 Ų94.533%0.3345%0.451SS..Hα-helixtrans-64-43.5175.5-68.3174.4000111.6F229 M289 K295 W296 Y297F229-L293 HydrophobicContact CZ-CD2 3.87Å; M289-L293 HydrophobicContact CG-CD1 3.9Å; M289-L293 HydrophobicContact CG-CG 4.31Å; M289-L293 WeakPolarHBondContact O-CG 3.31Å; M289-L293 PolarHBondContact O-N 3.35Å; M289-L293 HydrophobicContact SD-CD1 4.24Å; M289-L293 HydrophobicContact SD-CG 4.17Å; L293-K295 VanDerWaalsContact C-N 3.34Å; L293-K295 PolarHBondContact O-N 2.96Å; L293-W296 PolarHBondContact O-N 2.92Å; L293-Y297 WeakPolarHBondContact O-CB 3.37Å; L293-Y297 PolarHBondContact O-N 3.09Å
294N75.8Confident69.6Low85 Ų8596.6 Ų96.646%0.45546%0.461SS..Hα-helixtrans-60.3-45173.6-84.4-50.2000111.3D290 W296 Y297 Y298D290-N294 VanDerWaalsContact O-CB 3.25Å; D290-N294 WeakPolarHBondContact O-CB 3.22Å; D290-N294 PolarHBondContact O-N 3.43Å; D290-N294 PolarHBondContact O-ND2 3.25Å; N294-W296 VanDerWaalsContact C-N 3.31Å; N294-W296 PolarHBondContact O-N 3.35Å; N294-Y297 PolarHBondContact O-N 2.95Å; N294-Y298 HydrophobicContact CB-CD2 4.47Å; N294-Y298 VanDerWaalsContact O-CD2 3.25Å; N294-Y298 WeakPolarHBondContact O-CD2 3.36Å; N294-Y298 PolarHBondContact O-N 2.98Å
295K79.8Confident69.6Low165 Ų16597.2 Ų97.272%0.71746%0.464SS*.Hα-helixtrans-60.9-40.4177.6-171.2176.3-178.7178.10112Q291 L292 L293 G299Q291-K295 WeakPolarHBondContact O-CB 3.46Å; Q291-K295 PolarHBondContact O-N 3.33Å; L292-K295 PolarHBondContact O-N 3.47Å; L293-K295 VanDerWaalsContact C-N 3.34Å; L293-K295 PolarHBondContact O-N 2.96Å; K295-G299 WeakPolarHBondContact O-CA 3.29Å; K295-G299 PolarHBondContact O-N 3.26Å
296W75.7Confident69Low83 Ų8393.3 Ų93.331%0.31446%0.46SS..Hα-helixtrans-63.8-45.7174.5-178.5-99.3000112.2F229 L292 L293 N294 G299 K300 P301F229-W296 AromaticContact CD2-CD1 3.9Å; F229-W296 HydrophobicContact CD2-CD2 4.12Å; F229-W296 AromaticContact CD2-CE2 3.48Å; F229-W296 VanDerWaalsContact CD2-CE2 3.48Å; F229-W296 HydrophobicContact CD2-CG 4.36Å; F229-W296 AromaticContact CD2-CZ2 3.8Å; F229-W296 HydrophobicContact CD2-CZ2 3.8Å; F229-W296 AromaticContact CD2-NE1 3.32Å; F229-W296 VanDerWaalsContact CD2-NE1 3.32Å; F229-W296 AromaticContact CE2-CD1 3.32Å; F229-W296 AromaticContact CE2-CD2 3.88Å; F229-W296 HydrophobicContact CE2-CD2 3.88Å; F229-W296 AromaticContact CE2-CE2 3.66Å; F229-W296 AromaticContact CE2-CG 3.7Å; F229-W296 HydrophobicContact CE2-CG 3.7Å; F229-W296 HydrophobicContact CE2-CZ2 4.41Å; F229-W296 AromaticContact CE2-NE1 3.27Å; F229-W296 VanDerWaalsContact CE2-NE1 3.27Å; F229-W296 HydrophobicContact CG-CZ2 4.47Å; F229-W296 AromaticContact CG-NE1 3.86Å; F229-W296 AromaticContact CZ-CD1 3.58Å; F229-W296 HydrophobicContact CZ-CG 4.24Å; F229-W296 AromaticContact CZ-NE1 3.78Å; L292-W296 PolarHBondContact O-N 2.9Å; L293-W296 PolarHBondContact O-N 2.92Å; N294-W296 VanDerWaalsContact C-N 3.31Å; N294-W296 PolarHBondContact O-N 3.35Å; W296-G299 CarbonylContact O-C 3.57Å; W296-G299 PolarHBondContact O-N 2.89Å; W296-K300 PolarHBondContact O-N 3.29Å; W296-P301 HydrophobicContact CH2-CG 4.29Å; W296-P301 HydrophobicContact CZ3-CG 3.94Å
297Y75.8Confident68.4Low107 Ų10795.8 Ų95.842%0.4246%0.463SS..Hα-helixtrans-63.5-46.7-179.9-175.8-101.7000112.5P85 L293 N294P85-Y297 HydrophobicContact CG-CD1 4.45Å; P85-Y297 HydrophobicContact CG-CE1 4.32Å; L293-Y297 WeakPolarHBondContact O-CB 3.37Å; L293-Y297 PolarHBondContact O-N 3.09Å; N294-Y297 PolarHBondContact O-N 2.95Å
298Y74.1Confident67.5Low145 Ų14595 Ų9557%0.56946%0.462SS*.Hα-helixtrans-78.7-20.8-179.9-74.8-76.5000113.7P85 G87 N294P85-Y298 HydrophobicContact CB-CD1 4.2Å; P85-Y298 HydrophobicContact CG-CD1 3.63Å; P85-Y298 HydrophobicContact CG-CE1 4.16Å; P85-Y298 HydrophobicContact CG-CG 4.32Å; G87-Y298 WeakPolarHBondContact CA-O 3.48Å; N294-Y298 HydrophobicContact CB-CD2 4.47Å; N294-Y298 VanDerWaalsContact O-CD2 3.25Å; N294-Y298 WeakPolarHBondContact O-CD2 3.36Å; N294-Y298 PolarHBondContact O-N 2.98Å
299G69.8Low66.1Low22 Ų2295 Ų9523%0.22748%0.477CS..  trans-144.561.7-169.800000113.9K295 W296K295-G299 WeakPolarHBondContact O-CA 3.29Å; K295-G299 PolarHBondContact O-N 3.26Å; W296-G299 CarbonylContact O-C 3.57Å; W296-G299 PolarHBondContact O-N 2.89Å
300K73.3Confident64.7Low29 Ų29100.2 Ų100.213%0.12650%0.5CS..PPolyproline II helixtrans-50.7132.7167.7-77.7-163.3177.6-177.70109.9E81 E225 W296E81-K300 IonicContact OE2-NZ 3.55Å; E225-K300 IonicContact OE2-NZ 2.77Å; E225-K300 PolarHBondContact OE2-NZ 2.87Å; W296-K300 PolarHBondContact O-N 3.29Å
301P64.3Low63.1Low60 Ų60106.8 Ų106.839%0.3952%0.52SS..PPolyproline II helixtrans-65157.3-175.525.9-33.2000112.4W296W296-P301 HydrophobicContact CH2-CG 4.29Å; W296-P301 HydrophobicContact CZ3-CG 3.94Å
302E66.8Low61.3Low124 Ų124105.9 Ų105.958%0.57953%0.525SS*.PPolyproline II helixtrans-68153.4172.2-67.6177.217700110.9N88 D304N88-E302 HydrophobicContact CB-CG 4.33Å; E302-D304 PolarHBondContact O-N 3.42Å
303L57.1Low59.4Low96 Ų96110.1 Ų110.150%0.50354%0.535SS..SBendtrans-81.350.5-179.9-65.8141.3000111.7R89 W218 Y221R89-L303 HydrophobicContact CG-CD1 4.48Å; W218-L303 HydrophobicContact CE3-CD1 4.35Å; W218-L303 HydrophobicContact CH2-CD1 3.05Å; W218-L303 HydrophobicContact CH2-CD2 3.51Å; W218-L303 HydrophobicContact CH2-CG 3.68Å; W218-L303 HydrophobicContact CZ2-CD1 4.01Å; W218-L303 HydrophobicContact CZ3-CD1 3.24Å; W218-L303 HydrophobicContact CZ3-CD2 3.38Å; W218-L303 HydrophobicContact CZ3-CG 3.84Å; Y221-L303 HydrophobicContact CD1-CD2 4.39Å; Y221-L303 HydrophobicContact CE1-CD2 3.7Å; Y221-L303 HydrophobicContact CE2-CD2 4.07Å; Y221-L303 WeakPolarHBondContact OH-CD2 3.3Å
304D59Low57.6Low71 Ų71113 Ų11338%0.3856%0.557SS.*  trans-119.5105.2-179.8-172.95.2000110.6E302 T306E302-D304 PolarHBondContact O-N 3.42Å; D304-T306 VanDerWaalsContact C-N 3.33Å; D304-T306 VanDerWaalsContact OD1-CB 3.3Å; D304-T306 WeakPolarHBondContact OD1-CB 3.39Å; D304-T306 WeakPolarHBondContact OD1-CG2 3.38Å; D304-T306 PolarHBondContact OD1-N 3.45Å; D304-T306 PolarHBondContact OD1-OG1 3.4Å; D304-T306 PolarHBondContact OD2-OG1 2.95Å; D304-T306 VanDerWaalsContact OD2-OG1 3.12Å
305V56.4Low55.9Low105 Ų105112.1 Ų112.164%0.63656%0.557SS**  trans-84.1-12.1179.1-143.60000111.6R307 I308 A309V305-R307 VanDerWaalsContact C-N 3.26Å; V305-R307 PolarHBondContact O-N 3.23Å; V305-I308 HydrophobicContact CG1-CB 4.43Å; V305-I308 HydrophobicContact CG1-CD1 4.14Å; V305-I308 WeakPolarHBondContact O-CB 3.41Å; V305-I308 PolarHBondContact O-N 3.42Å; V305-A309 PolarHBondContact O-N 2.78Å
306T48.1Very low54.2Low90 Ų90108.3 Ų108.355%0.55255%0.547SS*.Hα-helixtrans-66.7-29.7-178.766.30000112D304 I308 A309 H310D304-T306 VanDerWaalsContact C-N 3.33Å; D304-T306 VanDerWaalsContact OD1-CB 3.3Å; D304-T306 WeakPolarHBondContact OD1-CB 3.39Å; D304-T306 WeakPolarHBondContact OD1-CG2 3.38Å; D304-T306 PolarHBondContact OD1-N 3.45Å; D304-T306 PolarHBondContact OD1-OG1 3.4Å; D304-T306 PolarHBondContact OD2-OG1 2.95Å; D304-T306 VanDerWaalsContact OD2-OG1 3.12Å; T306-I308 VanDerWaalsContact C-N 3.3Å; T306-I308 PolarHBondContact O-N 3.22Å; T306-A309 PolarHBondContact O-N 3.43Å; T306-H310 PolarHBondContact O-N 3.23Å; T306-H310 PolarHBondContact O-ND1 3.24Å
307R50.3Low52.5Low193 Ų193107.6 Ų107.673%0.72855%0.552SS**Hα-helixtrans-62.9-30.7169.7-90.7-173.5169.4-179.3-0.2113.8V305V305-R307 VanDerWaalsContact C-N 3.26Å; V305-R307 PolarHBondContact O-N 3.23Å
308I48.2Very low51.1Low123 Ų123111.2 Ų111.263%0.63157%0.565SS**Hα-helixtrans-79.8-37.6179.3-60.4173.3000110.2V305 T306 H310 R311V305-I308 HydrophobicContact CG1-CB 4.43Å; V305-I308 HydrophobicContact CG1-CD1 4.14Å; V305-I308 WeakPolarHBondContact O-CB 3.41Å; V305-I308 PolarHBondContact O-N 3.42Å; T306-I308 VanDerWaalsContact C-N 3.3Å; T306-I308 PolarHBondContact O-N 3.22Å; I308-H310 PolarHBondContact O-N 3.49Å; I308-R311 PolarHBondContact O-N 2.85Å
309A39.8Very low49.7Very low86 Ų86111.2 Ų111.271%0.71157%0.57SS**Hα-helixtrans-62.1-20.1172.900000113.1V305 T306V305-A309 PolarHBondContact O-N 2.78Å; T306-A309 PolarHBondContact O-N 3.43Å
310H41.3Very low48.7Very low156 Ų156114 Ų11472%0.72258%0.58SS**THydrogen-bonded Turntrans-107.416.9-179.8-78.672.1000114.3T306 I308 P312T306-H310 PolarHBondContact O-N 3.23Å; T306-H310 PolarHBondContact O-ND1 3.24Å; I308-H310 PolarHBondContact O-N 3.49Å; H310-P312 WeakPolarHBondContact O-CD 3.45Å; H310-P312 VanDerWaalsContact O-N 3.12Å
311R37.1Very low47.5Very low210 Ų210119.4 Ų119.479%0.79262%0.618SS**  trans-69.3106.8165.6-99.3-167-173.4-169.73.5107.8I308 R313I308-R311 PolarHBondContact O-N 2.85Å; R311-R313 PolarHBondContact O-N 3.13Å
312P39Very low46.9Very low115 Ų115120 Ų12075%0.74763%0.634SS**  trans-64.1136.2170.429.7-30.1000107H310H310-P312 WeakPolarHBondContact O-CD 3.45Å; H310-P312 VanDerWaalsContact O-N 3.12Å
313R38.5Very low46.1Very low185 Ų185116.4 Ų116.470%0.69863%0.631SS**  trans-51.9133.2165.2-71.1-175.8178.4-166.92.6107.1R311 C315 V330R311-R313 PolarHBondContact O-N 3.13Å; R313-C315 VanDerWaalsContact C-N 3.34Å; R313-C315 PolarHBondContact O-N 2.98Å; R313-V330 PolarHBondContact NH1-O 3.47Å; R313-V330 PolarHBondContact NH1-OXT 3.34Å
314P39.8Very low45.4Very low122 Ų122121 Ų12179%0.79264%0.642SS**  trans-64.898.9174.225.3-30.5000108.3V316P314-V316 PolarHBondContact O-N 2.85Å
315C40.4Very low44.7Very low67 Ų67120.8 Ų120.845%0.45364%0.643SS.*  trans-75.2109.8166.3-72.80000107.1R313 T317R313-C315 VanDerWaalsContact C-N 3.34Å; R313-C315 PolarHBondContact O-N 2.98Å; C315-T317 PolarHBondContact O-N 2.88Å
316V43.2Very low44.1Very low85 Ų85120.6 Ų120.652%0.51564%0.638SS.*  trans-70.9114.7168.2-177.60000106.9P314 W318P314-V316 PolarHBondContact O-N 2.85Å; V316-W318 HydrophobicContact CG1-CD2 4.36Å; V316-W318 HydrophobicContact CG1-CZ2 3.92Å
317T41.1Very low43.9Very low68 Ų68124.6 Ų124.642%0.41764%0.644SS.*EExtended strand (participates in β ladder)trans-97.8123.2172.347.60000109.1C315 T325 Y327C315-T317 PolarHBondContact O-N 2.88Å; T317-T325 HydrophobicContact CG2-CG2 3.91Å; T317-Y327 HydrophobicContact CG2-CD1 3.8Å; T317-Y327 HydrophobicContact CG2-CE1 3.65Å; T317-Y327 HydrophobicContact CG2-CG 4.4Å
318W46.5Very low43.5Very low184 Ų184118.4 Ų118.470%0.69763%0.631SS**EExtended strand (participates in β ladder)trans-96.3135.7171.1-60.396.1000108.4V316 L326V316-W318 HydrophobicContact CG1-CD2 4.36Å; V316-W318 HydrophobicContact CG1-CZ2 3.92Å; W318-L326 PolarHBondContact N-O 2.89Å; W318-L326 PolarHBondContact O-N 2.99Å
319Q42.9Very low42.7Very low144 Ų144119.8 Ų119.867%0.67364%0.639SS**EExtended strand (participates in β ladder)trans-100.8125.3169.5-83.6-1776.400109.2T325Q319-T325 HydrophobicContact CG-CG2 4.48Å
320D49.3Very low42.6Very low81 Ų81122.6 Ų122.643%0.43365%0.647SS.*PPolyproline II helixtrans-66.6158.6168.5-95.4-22000110.8G322 G323 R324D320-G322 PolarHBondContact O-N 3.28Å; D320-G323 PolarHBondContact O-N 3.4Å; D320-R324 PolarHBondContact N-O 2.97Å; D320-R324 VanDerWaalsContact N-O 3.1Å
321P49Very low42.7Very low143 Ų143120.9 Ų120.993%0.92964%0.643SS**THydrogen-bonded Turntrans-56.8-15.7175.5-23.332.7000114.6
322G51.1Low43Very low71 Ų71116.2 Ų116.273%0.73264%0.636SS**THydrogen-bonded Turntrans-92.810.6172.900000115.3D320 R324D320-G322 PolarHBondContact O-N 3.28Å; G322-R324 PolarHBondContact O-N 3.18Å
323G49.8Very low43.2Very low50 Ų50116.3 Ų116.352%0.51563%0.629SS.*SBendtrans76.417.1173.500000115.9D320D320-G323 PolarHBondContact O-N 3.4Å
324R41.8Very low43.5Very low191 Ų191112.2 Ų112.272%0.72163%0.625SS**PPolyproline II helixtrans-95.4128174.5-72.7-170.2-72.5-155.3-2.7110.8D320 G322D320-R324 PolarHBondContact N-O 2.97Å; D320-R324 VanDerWaalsContact N-O 3.1Å; G322-R324 PolarHBondContact O-N 3.18Å
325T45.6Very low43.7Very low67 Ų67111.6 Ų111.641%0.41162%0.615SS.*EExtended strand (participates in β ladder)trans-80.6118.2177.8-28.20000109.9T317 Q319T317-T325 HydrophobicContact CG2-CG2 3.91Å; Q319-T325 HydrophobicContact CG-CG2 4.48Å
326L44Very low44Very low101 Ų101114.6 Ų114.653%0.52963%0.626SS.*EExtended strand (participates in β ladder)trans-98.6125.6171.8-71.5166.7000109.1W318W318-L326 PolarHBondContact N-O 2.89Å; W318-L326 PolarHBondContact O-N 2.99Å
327Y43.5Very low44Very low175 Ų175116.7 Ų116.769%0.68663%0.634SS**EExtended strand (participates in β ladder)trans-90126.7172.8-75-89.6000109.2T317T317-Y327 HydrophobicContact CG2-CD1 3.8Å; T317-Y327 HydrophobicContact CG2-CE1 3.65Å; T317-Y327 HydrophobicContact CG2-CG 4.4Å
328S40.7Very low44.2Very low63 Ų63120.5 Ų120.544%0.44165%0.65SS.*  trans-106.9120.9165.3-174.50000108.4
329D32.4Very low44Very low151 Ų151115.2 Ų115.281%0.80765%0.646SS**  trans-75.1124.5169.1-75.1-29.3000108.9
330V38.4Very low44.1Very low145 Ų145112.5 Ų112.588%0.87964%0.644SS**  trans-116.80163.3-174.40000109.1R313R313-V330 PolarHBondContact NH1-O 3.47Å; R313-V330 PolarHBondContact NH1-OXT 3.34Å

Retrieved 330 of 330 residues in 186 ms (Link to these results)

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