A0A096NQS6_PAPAN Loading...

G protein-coupled receptor 153

AlphaFold DB , UniProt , Accession A0A096NQS6, Species PAPAN (Papio anubis, Olive baboon), Gene GPR153, Length 609 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
1M37.7Very low60.3Low188 Ų18896.8 Ų96.893%0.92649%0.488SS*.  0-550-66-16484.400114.9E4M1-E4 WeakPolarHBondContact CA-OE2 3.31Å; M1-E4 PolarHBondContact N-OE2 2.91Å
2S50Low62.8Low81 Ų8195.8 Ų95.857%0.56649%0.49SS*.  trans-71.9-41.1-18042.80000113.9
3D49.3Very low65Low101 Ų10189.9 Ų89.954%0.5447%0.468SS..Hα-helixtrans-78.2-33.7-173.3-59.7-54.4000113.3R5 R6 L7D3-R5 PolarHBondContact O-N 3.47Å; D3-R6 WeakPolarHBondContact O-CB 3.37Å; D3-R6 PolarHBondContact O-N 2.84Å; D3-L7 PolarHBondContact O-N 2.99Å
4E48.2Very low67.1Low134 Ų13483.6 Ų83.663%0.62644%0.435SS*.Hα-helixtrans-61.6-23.2174.5-67.2161.3111.700113.2M1 P8M1-E4 WeakPolarHBondContact CA-OE2 3.31Å; M1-E4 PolarHBondContact N-OE2 2.91Å; E4-P8 WeakPolarHBondContact O-CD 3.5Å; E4-P8 WeakPolarHBondContact O-CG 3.23Å
5R49.6Very low68.9Low210 Ų21082.3 Ų82.379%0.79243%0.428SS*.Hα-helixtrans-85.4-23.3171.1-72-172.1178.1-173.20.5113.4D3D3-R5 PolarHBondContact O-N 3.47Å
6R58Low70.6Confident176 Ų17681.2 Ų81.266%0.66444%0.435SS*.Hα-helixtrans-74-34.2176.6-68-179.3-177.8-131.13.6112.4D3 S10D3-R6 WeakPolarHBondContact O-CB 3.37Å; D3-R6 PolarHBondContact O-N 2.84Å; R6-S10 WeakPolarHBondContact O-CB 3.48Å; R6-S10 PolarHBondContact O-N 3.49Å; R6-S10 PolarHBondContact O-OG 2.98Å
7L59.9Low72Confident66 Ų6678.8 Ų78.835%0.34643%0.425SS..Hα-helixtrans-62.7-50.7-179.3-77.1149.5000113.1D3 G9 S10 A11D3-L7 PolarHBondContact O-N 2.99Å; L7-G9 PolarHBondContact O-N 2.84Å; L7-S10 PolarHBondContact O-N 3.03Å; L7-A11 PolarHBondContact O-N 3.21Å; L7-A11 VanDerWaalsContact O-N 3.07Å
8P63.3Low73.3Confident38 Ų3874.5 Ų74.525%0.24740%0.403CS..Hα-helixtrans-58.1-45.5172.6-28.736.3000114E4 S10 A11 V12E4-P8 WeakPolarHBondContact O-CD 3.5Å; E4-P8 WeakPolarHBondContact O-CG 3.23Å; P8-S10 VanDerWaalsContact C-N 3.27Å; P8-S10 PolarHBondContact O-N 3.17Å; P8-A11 PolarHBondContact O-N 3.27Å; P8-V12 PolarHBondContact O-N 3.42Å
9G75.8Confident74.4Confident50 Ų5072.3 Ų72.352%0.51540%0.4SS..Hα-helixtrans-61.6-37.4178.700000112.3L7 G13L7-G9 PolarHBondContact O-N 2.84Å; G9-G13 PolarHBondContact O-N 3.26Å
10S84.1Confident75.5Confident21 Ų2174.1 Ų74.115%0.14741%0.408CS..Hα-helixtrans-66.2-41.7174.6-55.30000112R6 L7 P8 G13 W14R6-S10 WeakPolarHBondContact O-CB 3.48Å; R6-S10 PolarHBondContact O-N 3.49Å; R6-S10 PolarHBondContact O-OG 2.98Å; L7-S10 PolarHBondContact O-N 3.03Å; P8-S10 VanDerWaalsContact C-N 3.27Å; P8-S10 PolarHBondContact O-N 3.17Å; S10-G13 WeakPolarHBondContact O-CA 3.2Å; S10-G13 PolarHBondContact O-N 3.37Å; S10-W14 VanDerWaalsContact O-CD2 3.28Å; S10-W14 PolarHBondContact O-N 2.93Å
11A87.2Confident76.5Confident0 Ų070.5 Ų70.50%039%0.388CS..Hα-helixtrans-64.7-42.1178.900000113.3L7 P8 G13 W14 L15 Q68 L69L7-A11 PolarHBondContact O-N 3.21Å; L7-A11 VanDerWaalsContact O-N 3.07Å; P8-A11 PolarHBondContact O-N 3.27Å; A11-G13 VanDerWaalsContact C-N 3.32Å; A11-W14 HydrophobicContact CB-CE3 4.32Å; A11-W14 HydrophobicContact CB-CZ3 4.36Å; A11-L15 WeakPolarHBondContact O-CG 3.37Å; A11-L15 PolarHBondContact O-N 2.8Å; A11-Q68 HydrophobicContact CB-CB 4.15Å; A11-L69 HydrophobicContact CB-CD2 4.09Å; A11-L69 HydrophobicContact CB-CG 3.95Å
12V90.4Very high79.3Confident84 Ų8464.1 Ų64.151%0.50936%0.357SS..Hα-helixtrans-64.6-39.9172.1179.40000110.7P8 L15 A16 L69P8-V12 PolarHBondContact O-N 3.42Å; V12-L15 PolarHBondContact O-N 2.68Å; V12-A16 WeakPolarHBondContact O-CB 3.33Å; V12-A16 PolarHBondContact O-N 2.97Å; V12-L69 HydrophobicContact CG2-CD2 4.07Å
13G92.1Very high81.5Confident20 Ų2066.4 Ų66.421%0.20636%0.363CS..Hα-helixtrans-58.7-49.1175.200000113.2G9 S10 A11 L15 A16 C17G9-G13 PolarHBondContact O-N 3.26Å; S10-G13 WeakPolarHBondContact O-CA 3.2Å; S10-G13 PolarHBondContact O-N 3.37Å; A11-G13 VanDerWaalsContact C-N 3.32Å; G13-L15 VanDerWaalsContact C-N 3.34Å; G13-L15 PolarHBondContact O-N 3Å; G13-A16 PolarHBondContact O-N 3.14Å; G13-C17 VanDerWaalsContact O-CB 3.28Å; G13-C17 WeakPolarHBondContact O-CB 3.48Å; G13-C17 PolarHBondContact O-N 3.45Å; G13-C17 PolarHBondContact O-SG 2.88Å; G13-C17 VanDerWaalsContact O-SG 3.42Å
14W94.3Very high83.7Confident1 Ų162.9 Ų62.90%0.00435%0.347CS..Hα-helixtrans-62.3-37.9176.8-64.2-40.4000112.8S10 A11 G18 I61 Y64 S65 L280 L283 W284S10-W14 VanDerWaalsContact O-CD2 3.28Å; S10-W14 PolarHBondContact O-N 2.93Å; A11-W14 HydrophobicContact CB-CE3 4.32Å; A11-W14 HydrophobicContact CB-CZ3 4.36Å; W14-G18 VanDerWaalsContact O-CA 3.3Å; W14-G18 WeakPolarHBondContact O-CA 2.76Å; W14-G18 PolarHBondContact O-N 3.43Å; W14-I61 HydrophobicContact CB-CG2 3.93Å; W14-Y64 HydrophobicContact CE3-CD1 4.19Å; W14-Y64 HydrophobicContact CH2-CD1 4.33Å; W14-Y64 AromaticContact CH2-CE1 3.88Å; W14-Y64 HydrophobicContact CH2-CE1 3.88Å; W14-Y64 AromaticContact CZ3-CD1 3.73Å; W14-Y64 HydrophobicContact CZ3-CD1 3.73Å; W14-Y64 AromaticContact CZ3-CE1 3.64Å; W14-Y64 HydrophobicContact CZ3-CE1 3.64Å; W14-S65 WeakPolarHBondContact CB-OG 3.48Å; W14-L280 HydrophobicContact CH2-CD2 3.44Å; W14-L280 VanDerWaalsContact CH2-CD2 3.44Å; W14-L280 HydrophobicContact CZ2-CD2 3.57Å; W14-L283 HydrophobicContact CH2-CD1 4.12Å; W14-L283 HydrophobicContact CZ2-CB 4.2Å; W14-L283 HydrophobicContact CZ2-CD1 4.13Å; W14-L283 HydrophobicContact CZ3-CD1 4.49Å; W14-W284 AromaticContact CD1-CD2 3.63Å; W14-W284 AromaticContact CD1-CE2 3.64Å; W14-W284 AromaticContact CD1-CE3 3.72Å; W14-W284 AromaticContact CD1-CH2 3.87Å; W14-W284 AromaticContact CD1-CZ2 3.77Å; W14-W284 AromaticContact CD1-CZ3 3.84Å; W14-W284 AromaticContact CE2-CE2 3.91Å; W14-W284 AromaticContact CE2-NE1 3.74Å; W14-W284 AromaticContact CZ2-NE1 3.83Å; W14-W284 AromaticContact NE1-CD1 3.48Å; W14-W284 AromaticContact NE1-CD2 3.21Å; W14-W284 AromaticContact NE1-CE2 3.11Å; W14-W284 AromaticContact NE1-CE3 3.82Å; W14-W284 AromaticContact NE1-CG 3.47Å; W14-W284 AromaticContact NE1-CZ2 3.66Å; W14-W284 AromaticContact NE1-NE1 3.27Å
15L94.2Very high86Confident64 Ų6456.5 Ų56.534%0.33532%0.317SS..Hα-helixtrans-67.5-43.4175.5-71.6172.4000112.2A11 V12 G13 G19 L69A11-L15 WeakPolarHBondContact O-CG 3.37Å; A11-L15 PolarHBondContact O-N 2.8Å; V12-L15 PolarHBondContact O-N 2.68Å; G13-L15 VanDerWaalsContact C-N 3.34Å; G13-L15 PolarHBondContact O-N 3Å; L15-G19 PolarHBondContact O-N 3.12Å; L15-L69 HydrophobicContact CD1-CD1 3.63Å
16A95.1Very high88.1Confident65 Ų6548 Ų4854%0.53729%0.293SS..Hα-helixtrans-67.8-50.5179.300000112V12 G13 G18 G19 L20V12-A16 WeakPolarHBondContact O-CB 3.33Å; V12-A16 PolarHBondContact O-N 2.97Å; G13-A16 PolarHBondContact O-N 3.14Å; A16-G18 VanDerWaalsContact C-N 3.29Å; A16-G18 PolarHBondContact O-N 3.28Å; A16-G19 PolarHBondContact O-N 2.98Å; A16-L20 PolarHBondContact O-N 3.03Å; A16-L20 VanDerWaalsContact O-N 3.08Å
17C95.4Very high89.8Confident40 Ų4043.3 Ų43.327%0.2728%0.275SS..Hα-helixtrans-63.6-35.8175.4-69.20000111.8G13 S21 V287 L291G13-C17 VanDerWaalsContact O-CB 3.28Å; G13-C17 WeakPolarHBondContact O-CB 3.48Å; G13-C17 PolarHBondContact O-N 3.45Å; G13-C17 PolarHBondContact O-SG 2.88Å; G13-C17 VanDerWaalsContact O-SG 3.42Å; C17-S21 VanDerWaalsContact O-CB 3.28Å; C17-S21 WeakPolarHBondContact O-CB 3.15Å; C17-S21 PolarHBondContact O-N 3.24Å; C17-V287 HydrophobicContact CB-CG1 3.52Å; C17-L291 HydrophobicContact CB-CD1 4.14Å
18G94.4Very high91.4Very high2 Ų240.4 Ų40.42%0.02126%0.261CS..Hα-helixtrans-64.3-51.217400000112.6W14 A16 L20 S21 L22 V57W14-G18 VanDerWaalsContact O-CA 3.3Å; W14-G18 WeakPolarHBondContact O-CA 2.76Å; W14-G18 PolarHBondContact O-N 3.43Å; A16-G18 VanDerWaalsContact C-N 3.29Å; A16-G18 PolarHBondContact O-N 3.28Å; G18-L20 VanDerWaalsContact C-N 3.3Å; G18-L20 PolarHBondContact O-N 3.42Å; G18-S21 CarbonylContact O-C 3.57Å; G18-S21 WeakPolarHBondContact O-CA 3.37Å; G18-S21 WeakPolarHBondContact O-CB 3.49Å; G18-S21 PolarHBondContact O-N 2.83Å; G18-L22 PolarHBondContact O-N 3.39Å; G18-V57 VanDerWaalsContact C-CG1 3.5Å; G18-V57 WeakPolarHBondContact O-CG1 3.31Å
19G95.1Very high92.8Very high33 Ų3341 Ų4134%0.3426%0.261SS..Hα-helixtrans-55.4-44.9175.900000112.5L15 A16 S21 L22 L23L15-G19 PolarHBondContact O-N 3.12Å; A16-G19 PolarHBondContact O-N 2.98Å; G19-S21 PolarHBondContact O-N 2.67Å; G19-L22 PolarHBondContact O-N 2.96Å; G19-L23 WeakPolarHBondContact O-CG 3.42Å; G19-L23 PolarHBondContact O-N 3.11Å
20L96.5Very high93.6Very high107 Ų10742.1 Ų42.156%0.5626%0.255SS*.Hα-helixtrans-60.7-44.2173179.261.2000112.1A16 G18 L22 L23 A24 L291A16-L20 PolarHBondContact O-N 3.03Å; A16-L20 VanDerWaalsContact O-N 3.08Å; G18-L20 VanDerWaalsContact C-N 3.3Å; G18-L20 PolarHBondContact O-N 3.42Å; L20-L22 PolarHBondContact O-N 2.85Å; L20-L23 PolarHBondContact O-N 2.97Å; L20-A24 VanDerWaalsContact O-CB 3.31Å; L20-A24 WeakPolarHBondContact O-CB 3.48Å; L20-A24 PolarHBondContact O-N 2.95Å; L20-L291 HydrophobicContact CB-CD2 4.39Å; L20-L291 HydrophobicContact CD2-CD2 4.14Å; L20-L291 HydrophobicContact CG-CD2 4.07Å
21S96.5Very high93.8Very high0 Ų041.5 Ų41.50%025%0.251CS..Hα-helixtrans-62.8-38.8178.4-172.50000113C17 G18 G19 A24 N25 A290 L291C17-S21 VanDerWaalsContact O-CB 3.28Å; C17-S21 WeakPolarHBondContact O-CB 3.15Å; C17-S21 PolarHBondContact O-N 3.24Å; G18-S21 CarbonylContact O-C 3.57Å; G18-S21 WeakPolarHBondContact O-CA 3.37Å; G18-S21 WeakPolarHBondContact O-CB 3.49Å; G18-S21 PolarHBondContact O-N 2.83Å; G19-S21 PolarHBondContact O-N 2.67Å; S21-A24 PolarHBondContact O-N 2.9Å; S21-N25 WeakPolarHBondContact O-CB 3.23Å; S21-N25 PolarHBondContact O-N 3.22Å; S21-N25 PolarHBondContact O-ND2 2.89Å; S21-N25 PolarHBondContact OG-ND2 3.15Å; S21-A290 WeakPolarHBondContact OG-CB 3.45Å; S21-A290 PolarHBondContact OG-O 2.68Å; S21-L291 PolarHBondContact OG-N 2.99Å
22L95.9Very high94Very high53 Ų5341.5 Ų41.528%0.27725%0.251SS..Hα-helixtrans-60.2-51176.3-76.4165.3000111G18 G19 L20 A24 N25 A26 M54 V57 A58G18-L22 PolarHBondContact O-N 3.39Å; G19-L22 PolarHBondContact O-N 2.96Å; L20-L22 PolarHBondContact O-N 2.85Å; L22-A24 PolarHBondContact O-N 2.85Å; L22-N25 PolarHBondContact O-N 3.27Å; L22-A26 WeakPolarHBondContact O-CB 3.42Å; L22-A26 PolarHBondContact O-N 3.15Å; L22-M54 HydrophobicContact CD2-CB 3.89Å; L22-M54 HydrophobicContact CD2-CG 4.2Å; L22-M54 WeakPolarHBondContact CD2-O 3.36Å; L22-V57 HydrophobicContact CD1-CG1 3.96Å; L22-V57 HydrophobicContact CD2-CB 4.34Å; L22-V57 HydrophobicContact CD2-CG1 4.36Å; L22-V57 HydrophobicContact CG-CB 4.26Å; L22-V57 HydrophobicContact CG-CG1 3.79Å; L22-A58 HydrophobicContact CD2-CB 4.17Å
23L95.6Very high93.8Very high130 Ų13038.2 Ų38.268%0.68123%0.234SC*.Hα-helixtrans-62.3-42.7178.1-64.2174.1000111.7G19 L20 A26 W27G19-L23 WeakPolarHBondContact O-CG 3.42Å; G19-L23 PolarHBondContact O-N 3.11Å; L20-L23 PolarHBondContact O-N 2.97Å; L23-A26 PolarHBondContact O-N 3.22Å; L23-W27 WeakPolarHBondContact O-CB 3.48Å; L23-W27 PolarHBondContact O-N 3Å
24A95.5Very high93.5Very high26 Ų2637.9 Ų37.922%0.21523%0.229CC..Hα-helixtrans-67.5-37.1-179.400000113L20 S21 L22 G28 P294L20-A24 VanDerWaalsContact O-CB 3.31Å; L20-A24 WeakPolarHBondContact O-CB 3.48Å; L20-A24 PolarHBondContact O-N 2.95Å; S21-A24 PolarHBondContact O-N 2.9Å; L22-A24 PolarHBondContact O-N 2.85Å; A24-G28 PolarHBondContact O-N 2.99Å; A24-P294 VanDerWaalsContact C-CG 3.43Å; A24-P294 HydrophobicContact CB-CB 3.83Å; A24-P294 HydrophobicContact CB-CG 3.66Å; A24-P294 WeakPolarHBondContact O-CB 3.42Å; A24-P294 WeakPolarHBondContact O-CG 3.38Å
25N96.5Very high92.9Very high0 Ų042.2 Ų42.20%025%0.248CC..Hα-helixtrans-73.9-39.7175.8-78.8-86.1000112.1S21 L22 W27 G28 I29 A50 M54 A290 P294S21-N25 WeakPolarHBondContact O-CB 3.23Å; S21-N25 PolarHBondContact O-N 3.22Å; S21-N25 PolarHBondContact O-ND2 2.89Å; S21-N25 PolarHBondContact OG-ND2 3.15Å; L22-N25 PolarHBondContact O-N 3.27Å; N25-W27 VanDerWaalsContact C-N 3.31Å; N25-W27 PolarHBondContact O-N 2.88Å; N25-G28 WeakPolarHBondContact O-CA 3.43Å; N25-G28 PolarHBondContact O-N 3.25Å; N25-G28 VanDerWaalsContact O-N 3.1Å; N25-I29 WeakPolarHBondContact O-CG1 3.44Å; N25-I29 PolarHBondContact O-N 3.46Å; N25-A50 HydrophobicContact CB-CB 4.28Å; N25-M54 HydrophobicContact CB-CG 3.55Å; N25-M54 HydrophobicContact CB-SD 3.96Å; N25-A290 PolarHBondContact ND2-O 2.91Å; N25-P294 HydrophobicContact CB-CG 4.45Å
26A95.1Very high92.3Very high33 Ų3340.6 Ų40.627%0.27324%0.239SC..Hα-helixtrans-58.3-45.3171.300000111.2L22 L23 G28 I29 L30 M54L22-A26 WeakPolarHBondContact O-CB 3.42Å; L22-A26 PolarHBondContact O-N 3.15Å; L23-A26 PolarHBondContact O-N 3.22Å; A26-G28 VanDerWaalsContact C-N 3.31Å; A26-G28 PolarHBondContact O-N 3.19Å; A26-I29 PolarHBondContact O-N 3.12Å; A26-L30 WeakPolarHBondContact O-CG 3.32Å; A26-L30 PolarHBondContact O-N 3.42Å; A26-M54 HydrophobicContact CB-CE 3.99Å; A26-M54 HydrophobicContact CB-SD 4.34Å
27W93.3Very high91.2Very high77 Ų7747.7 Ų47.729%0.29226%0.258SS..Hα-helixtrans-59.2-39.5172.7-177.6-98000112.9L23 N25 L30 S31 L307 V310L23-W27 WeakPolarHBondContact O-CB 3.48Å; L23-W27 PolarHBondContact O-N 3Å; N25-W27 VanDerWaalsContact C-N 3.31Å; N25-W27 PolarHBondContact O-N 2.88Å; W27-L30 PolarHBondContact O-N 2.92Å; W27-S31 PolarHBondContact NE1-OG 2.92Å; W27-S31 VanDerWaalsContact O-CB 3.27Å; W27-S31 WeakPolarHBondContact O-CB 3.5Å; W27-S31 PolarHBondContact O-N 3.47Å; W27-S31 PolarHBondContact O-OG 3.12Å; W27-L307 HydrophobicContact CH2-CB 4.47Å; W27-L307 HydrophobicContact CH2-CD1 3.55Å; W27-L307 HydrophobicContact CZ3-CD1 3.94Å; W27-V310 HydrophobicContact CH2-CB 3.77Å; W27-V310 HydrophobicContact CH2-CG1 3.94Å; W27-V310 HydrophobicContact CH2-CG2 3.74Å; W27-V310 HydrophobicContact CZ2-CB 4.48Å; W27-V310 HydrophobicContact CZ2-CG2 3.94Å; W27-V310 HydrophobicContact CZ3-CB 4.19Å; W27-V310 HydrophobicContact CZ3-CG1 3.82Å; W27-V310 HydrophobicContact CZ3-CG2 4.39Å
28G92.6Very high90.6Very high5 Ų553.1 Ų53.15%0.05228%0.277CS..Hα-helixtrans-60.3-47.7174.700000112.9A24 N25 A26 S31 V32A24-G28 PolarHBondContact O-N 2.99Å; N25-G28 WeakPolarHBondContact O-CA 3.43Å; N25-G28 PolarHBondContact O-N 3.25Å; N25-G28 VanDerWaalsContact O-N 3.1Å; A26-G28 VanDerWaalsContact C-N 3.31Å; A26-G28 PolarHBondContact O-N 3.19Å; G28-S31 PolarHBondContact O-N 3.5Å; G28-V32 WeakPolarHBondContact O-CG2 3.29Å; G28-V32 PolarHBondContact O-N 3.15Å
29I93.8Very high90Very high49 Ų4958.6 Ų58.625%0.25130%0.297SS..Hα-helixtrans-61.4-47.9177.2-65168000110.5N25 A26 S31 V32 G33 C47 A50 M54N25-I29 WeakPolarHBondContact O-CG1 3.44Å; N25-I29 PolarHBondContact O-N 3.46Å; A26-I29 PolarHBondContact O-N 3.12Å; I29-S31 VanDerWaalsContact C-N 3.34Å; I29-S31 PolarHBondContact O-N 3.01Å; I29-V32 PolarHBondContact O-N 2.98Å; I29-G33 PolarHBondContact O-N 3.48Å; I29-C47 HydrophobicContact CG1-CB 4.32Å; I29-A50 HydrophobicContact CD1-CB 3.96Å; I29-A50 HydrophobicContact CG1-CB 3.77Å; I29-M54 HydrophobicContact CD1-SD 3.86Å
30L91.3Very high89.7Confident75 Ų7561.1 Ų61.139%0.39330%0.298SS..Hα-helixtrans-61.3-40.1177-69.4173000112.1A26 W27 G33 A34 V310A26-L30 WeakPolarHBondContact O-CG 3.32Å; A26-L30 PolarHBondContact O-N 3.42Å; W27-L30 PolarHBondContact O-N 2.92Å; L30-G33 PolarHBondContact O-N 3.13Å; L30-A34 VanDerWaalsContact O-CB 3.23Å; L30-A34 WeakPolarHBondContact O-CB 3.25Å; L30-A34 PolarHBondContact O-N 3.36Å; L30-V310 HydrophobicContact CB-CG1 3.99Å
31S90Very high89.5Confident7 Ų756.5 Ų56.55%0.04928%0.275CS..Hα-helixtrans-63.3-43.5177.8-64.50000112.4W27 G28 I29 A34 K35W27-S31 PolarHBondContact NE1-OG 2.92Å; W27-S31 VanDerWaalsContact O-CB 3.27Å; W27-S31 WeakPolarHBondContact O-CB 3.5Å; W27-S31 PolarHBondContact O-N 3.47Å; W27-S31 PolarHBondContact O-OG 3.12Å; G28-S31 PolarHBondContact O-N 3.5Å; I29-S31 VanDerWaalsContact C-N 3.34Å; I29-S31 PolarHBondContact O-N 3.01Å; S31-A34 PolarHBondContact O-N 2.93Å; S31-K35 PolarHBondContact O-N 2.93Å
32V90.4Very high89.3Confident1 Ų156.8 Ų56.81%0.00628%0.276CS..Hα-helixtrans-64.8-47.3174.71760000110.3G28 I29 A34 K35 Q36 W39 E43 Y303G28-V32 WeakPolarHBondContact O-CG2 3.29Å; G28-V32 PolarHBondContact O-N 3.15Å; I29-V32 PolarHBondContact O-N 2.98Å; V32-A34 VanDerWaalsContact C-N 3.31Å; V32-A34 PolarHBondContact O-N 3.28Å; V32-K35 PolarHBondContact O-N 2.94Å; V32-Q36 WeakPolarHBondContact O-CG 3.18Å; V32-Q36 PolarHBondContact O-N 2.99Å; V32-W39 HydrophobicContact CG1-CZ3 3.87Å; V32-E43 HydrophobicContact CG1-CB 3.9Å; V32-E43 HydrophobicContact CG1-CG 3.99Å; V32-Y303 HydrophobicContact CG2-CD1 3.97Å; V32-Y303 HydrophobicContact CG2-CG 4.36Å
33G86.4Confident89.2Confident15 Ų1554.2 Ų54.216%0.15526%0.263CS..Hα-helixtrans-62.1-34.5177.700000113.7I29 L30 K313I29-G33 PolarHBondContact O-N 3.48Å; L30-G33 PolarHBondContact O-N 3.13Å; G33-K313 PolarHBondContact O-NZ 3.43Å
34A86.4Confident89.1Confident13 Ų1351 Ų5111%0.10724%0.243CC..Hα-helixtrans-68-45.4179.200000112.3L30 S31 V32 V310 K313L30-A34 VanDerWaalsContact O-CB 3.23Å; L30-A34 WeakPolarHBondContact O-CB 3.25Å; L30-A34 PolarHBondContact O-N 3.36Å; S31-A34 PolarHBondContact O-N 2.93Å; V32-A34 VanDerWaalsContact C-N 3.31Å; V32-A34 PolarHBondContact O-N 3.28Å; A34-V310 HydrophobicContact CB-CG2 3.95Å; A34-K313 HydrophobicContact CB-CB 4.16Å; A34-K313 HydrophobicContact CB-CG 4.07Å; A34-K313 WeakPolarHBondContact O-CE 3.47Å
35K81.3Confident89.1Confident91 Ų9150 Ų5040%0.39623%0.234SC..Hα-helixtrans-74.7-24.1-179.4-85-170.1160.7179.30114.6S31 V32 D301 R302 R304 A305S31-K35 PolarHBondContact O-N 2.93Å; V32-K35 PolarHBondContact O-N 2.94Å; K35-D301 PolarHBondContact NZ-O 2.91Å; K35-R302 WeakPolarHBondContact CD-O 3.22Å; K35-R304 WeakPolarHBondContact CE-O 3.47Å; K35-R304 PolarHBondContact NZ-O 2.98Å; K35-A305 HydrophobicContact CG-CB 4.4Å
36Q80.4Confident89Confident30 Ų3050 Ų5014%0.1424%0.235CC..  trans-92.2132-176.7-59.7-51.3-39.700113V32 E43 K313V32-Q36 WeakPolarHBondContact O-CG 3.18Å; V32-Q36 PolarHBondContact O-N 2.99Å; Q36-E43 HydrophobicContact CG-CG 4.4Å; Q36-E43 WeakPolarHBondContact CG-OE2 3.47Å; Q36-K313 PolarHBondContact O-NZ 3.49Å
37K73.3Confident89Confident214 Ų21449.1 Ų49.193%0.9323%0.226SC*.SBendtrans-88.8-21.6163.8-68.1-169.1176.6-170.10112.7
38K81.6Confident89.1Confident154 Ų15447.8 Ų47.867%0.6722%0.224SC*.SBendtrans-146.8105.9179.9-177.2170.9-175168.80109.7K40K38-K40 PolarHBondContact O-N 3.47Å
39W82.8Confident89.3Confident118 Ų11847.5 Ų47.545%0.44722%0.221SC..  trans-48.8122.6178.4-66.7101.7000112.7V32 E43 K124V32-W39 HydrophobicContact CG1-CZ3 3.87Å; W39-E43 HydrophobicContact CE3-CB 4.38Å; W39-K124 WeakPolarHBondContact O-CE 3.34Å; W39-K124 PolarHBondContact O-NZ 3.08Å
40K89.6Confident89.5Confident85 Ų8545.2 Ų45.237%0.3721%0.21SC..  trans-92.4156.8169.5-58.5176-171.5175.50110.5K38 L42 E43 F44 R302K38-K40 PolarHBondContact O-N 3.47Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.98Å; K40-E43 VanDerWaalsContact CB-OE2 3.23Å; K40-E43 WeakPolarHBondContact CB-OE2 3.23Å; K40-E43 WeakPolarHBondContact CG-OE2 3.19Å; K40-E43 PolarHBondContact N-OE2 2.99Å; K40-E43 WeakPolarHBondContact O-CB 3.36Å; K40-E43 PolarHBondContact O-N 3.45Å; K40-E43 VanDerWaalsContact O-N 3.08Å; K40-F44 PolarHBondContact O-N 2.86Å; K40-F44 VanDerWaalsContact O-N 3.09Å; K40-R302 VanDerWaalsContact CD-NH2 3.33Å
41P91.9Very high89.7Confident10 Ų1043.4 Ų43.47%0.06521%0.205CC..Hα-helixtrans-61.9-36-174.9-17.328000113.3E43 F44 L45 H107 A123 K124 A127P41-E43 PolarHBondContact O-N 2.88Å; P41-F44 WeakPolarHBondContact O-CB 3.34Å; P41-F44 PolarHBondContact O-N 3.07Å; P41-L45 WeakPolarHBondContact O-CG 3.36Å; P41-L45 PolarHBondContact O-N 2.98Å; P41-H107 WeakPolarHBondContact CB-NE2 3.46Å; P41-A123 HydrophobicContact CG-CB 3.93Å; P41-K124 HydrophobicContact CG-CB 4.49Å; P41-K124 HydrophobicContact CG-CG 3.9Å; P41-A127 HydrophobicContact CB-CB 3.78Å
42L92.1Very high90.1Very high6 Ų643 Ų433%0.03120%0.203CC..Hα-helixtrans-62.8-40174.6-174.272000112.8K40 L45 L46 L104 I242 V246K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.98Å; L42-L45 PolarHBondContact O-N 3.16Å; L42-L46 HydrophobicContact CG-CD1 4.35Å; L42-L46 WeakPolarHBondContact O-CG 3.17Å; L42-L46 PolarHBondContact O-N 3.22Å; L42-L104 HydrophobicContact CD1-CD2 3.71Å; L42-I242 HydrophobicContact CD2-CG2 3.42Å; L42-I242 VanDerWaalsContact CD2-CG2 3.42Å; L42-V246 HydrophobicContact CD1-CG2 4.3Å
43E93Very high90.4Very high0 Ų043 Ų430%020%0.203CC..Hα-helixtrans-66.6-39.9177.5-76.1137.4-158.300111V32 Q36 W39 K40 P41 L46 C47 R302 Y303V32-E43 HydrophobicContact CG1-CB 3.9Å; V32-E43 HydrophobicContact CG1-CG 3.99Å; Q36-E43 HydrophobicContact CG-CG 4.4Å; Q36-E43 WeakPolarHBondContact CG-OE2 3.47Å; W39-E43 HydrophobicContact CE3-CB 4.38Å; K40-E43 VanDerWaalsContact CB-OE2 3.23Å; K40-E43 WeakPolarHBondContact CB-OE2 3.23Å; K40-E43 WeakPolarHBondContact CG-OE2 3.19Å; K40-E43 PolarHBondContact N-OE2 2.99Å; K40-E43 WeakPolarHBondContact O-CB 3.36Å; K40-E43 PolarHBondContact O-N 3.45Å; K40-E43 VanDerWaalsContact O-N 3.08Å; P41-E43 PolarHBondContact O-N 2.88Å; E43-L46 PolarHBondContact O-N 2.95Å; E43-C47 PolarHBondContact O-N 2.84Å; E43-C47 PolarHBondContact O-SG 2.94Å; E43-C47 VanDerWaalsContact O-SG 3.41Å; E43-R302 IonicContact OE1-CZ 3.52Å; E43-R302 IonicContact OE1-NE 2.71Å; E43-R302 PolarHBondContact OE1-NE 2.81Å; E43-R302 IonicContact OE1-NH2 3.75Å; E43-R302 PolarHBondContact OE1-NH2 2.96Å; E43-Y303 HydrophobicContact CG-CE1 3.7Å
44F93.9Very high90.9Very high61 Ų6144.8 Ų44.827%0.26821%0.207SC..Hα-helixtrans-61-47.1172.8176.8-105.4000112K40 P41 L46 C47 M48 A127 V128 V131K40-F44 PolarHBondContact O-N 2.86Å; K40-F44 VanDerWaalsContact O-N 3.09Å; P41-F44 WeakPolarHBondContact O-CB 3.34Å; P41-F44 PolarHBondContact O-N 3.07Å; F44-L46 VanDerWaalsContact C-N 3.33Å; F44-L46 PolarHBondContact O-N 3.06Å; F44-C47 PolarHBondContact O-N 3Å; F44-M48 HydrophobicContact CD1-CG 4.4Å; F44-M48 HydrophobicContact CD2-CG 4.36Å; F44-M48 HydrophobicContact CE1-CG 4.02Å; F44-M48 HydrophobicContact CE2-CG 3.98Å; F44-M48 HydrophobicContact CE2-SD 4.1Å; F44-M48 HydrophobicContact CZ-CG 3.79Å; F44-M48 HydrophobicContact CZ-SD 4.1Å; F44-M48 WeakPolarHBondContact O-CG 3.41Å; F44-M48 PolarHBondContact O-N 3.47Å; F44-A127 HydrophobicContact CD1-CB 4.4Å; F44-V128 HydrophobicContact CD1-CG2 4.46Å; F44-V128 HydrophobicContact CE1-CB 4.48Å; F44-V128 HydrophobicContact CE1-CG2 3.9Å; F44-V128 HydrophobicContact CZ-CG2 4.03Å; F44-V131 HydrophobicContact CD1-CG2 4.33Å; F44-V131 HydrophobicContact CE1-CB 4.08Å; F44-V131 HydrophobicContact CE1-CG2 3.69Å; F44-V131 HydrophobicContact CZ-CG2 4.5Å
45L95.3Very high91.4Very high5 Ų547.6 Ų47.63%0.02622%0.22CC..Hα-helixtrans-60.4-39.3176.6-69.7171000112.7P41 L42 M48 L49 L104 H107 A127 V131P41-L45 WeakPolarHBondContact O-CG 3.36Å; P41-L45 PolarHBondContact O-N 2.98Å; L42-L45 PolarHBondContact O-N 3.16Å; L45-M48 PolarHBondContact O-N 3.23Å; L45-L49 PolarHBondContact O-N 3.44Å; L45-L104 HydrophobicContact CB-CD2 3.49Å; L45-L104 VanDerWaalsContact CB-CD2 3.49Å; L45-L104 HydrophobicContact CB-CG 4.22Å; L45-L104 HydrophobicContact CD1-CD2 4.22Å; L45-L104 HydrophobicContact CG-CD2 4.5Å; L45-H107 HydrophobicContact CD1-CB 3.95Å; L45-A127 HydrophobicContact CG-CB 4.5Å; L45-V131 HydrophobicContact CD2-CG2 3.6Å
46L95.1Very high92.1Very high1 Ų143.5 Ų43.51%0.00520%0.203CC..Hα-helixtrans-67.2-41.7175.9-71.4168.4000112.3L42 E43 F44 L49 A50 L104 I249 L293 L297 Y303L42-L46 HydrophobicContact CG-CD1 4.35Å; L42-L46 WeakPolarHBondContact O-CG 3.17Å; L42-L46 PolarHBondContact O-N 3.22Å; E43-L46 PolarHBondContact O-N 2.95Å; F44-L46 VanDerWaalsContact C-N 3.33Å; F44-L46 PolarHBondContact O-N 3.06Å; L46-L49 PolarHBondContact O-N 3.29Å; L46-A50 PolarHBondContact O-N 2.95Å; L46-L104 HydrophobicContact CD2-CD1 4.07Å; L46-L104 HydrophobicContact CD2-CD2 4.06Å; L46-L104 HydrophobicContact CG-CD2 4.09Å; L46-I249 HydrophobicContact CD2-CD1 3.95Å; L46-L293 HydrophobicContact CD2-CD1 4.4Å; L46-L297 HydrophobicContact CD1-CD2 4.18Å; L46-Y303 HydrophobicContact CD1-CE2 4.14Å
47C95.3Very high92.8Very high15 Ų1542.3 Ų42.310%0.10120%0.197CC..Hα-helixtrans-65.6-38174.5-70.70000112.2I29 E43 F44 A50 A51I29-C47 HydrophobicContact CG1-CB 4.32Å; E43-C47 PolarHBondContact O-N 2.84Å; E43-C47 PolarHBondContact O-SG 2.94Å; E43-C47 VanDerWaalsContact O-SG 3.41Å; F44-C47 PolarHBondContact O-N 3Å; C47-A50 PolarHBondContact O-N 3.39Å; C47-A51 PolarHBondContact O-N 2.88Å
48M95.6Very high93.9Very high48 Ų4834.5 Ų34.524%0.23617%0.173CC..Hα-helixtrans-65.8-38.8174.6-70.6-56-47.600111.9F44 L45 A51 T52 V131F44-M48 HydrophobicContact CD1-CG 4.4Å; F44-M48 HydrophobicContact CD2-CG 4.36Å; F44-M48 HydrophobicContact CE1-CG 4.02Å; F44-M48 HydrophobicContact CE2-CG 3.98Å; F44-M48 HydrophobicContact CE2-SD 4.1Å; F44-M48 HydrophobicContact CZ-CG 3.79Å; F44-M48 HydrophobicContact CZ-SD 4.1Å; F44-M48 WeakPolarHBondContact O-CG 3.41Å; F44-M48 PolarHBondContact O-N 3.47Å; L45-M48 PolarHBondContact O-N 3.23Å; M48-A51 PolarHBondContact O-N 3.46Å; M48-T52 PolarHBondContact O-N 3.19Å; M48-T52 PolarHBondContact O-OG1 2.89Å; M48-V131 HydrophobicContact CB-CG1 4.37Å; M48-V131 HydrophobicContact CB-CG2 4.36Å; M48-V131 HydrophobicContact CE-CG1 3.78Å; M48-V131 HydrophobicContact CG-CG1 3.92Å; M48-V131 HydrophobicContact CG-CG2 4.12Å; M48-V131 HydrophobicContact SD-CG1 4.29Å
49L96Very high94.5Very high0 Ų029.3 Ų29.30%015%0.154CC..Hα-helixtrans-62.9-41.8173-175.865000111.8L45 L46 A51 T52 H53 T97 V101 L104 Y253 L293L45-L49 PolarHBondContact O-N 3.44Å; L46-L49 PolarHBondContact O-N 3.29Å; L49-A51 PolarHBondContact O-N 3.25Å; L49-T52 WeakPolarHBondContact O-CB 3.32Å; L49-T52 PolarHBondContact O-N 3.09Å; L49-H53 PolarHBondContact O-CD2 3.16Å; L49-H53 PolarHBondContact O-N 3.25Å; L49-T97 HydrophobicContact CD1-CG2 4.2Å; L49-V101 HydrophobicContact CD1-CG2 4.42Å; L49-V101 HydrophobicContact CD2-CG2 4.43Å; L49-L104 HydrophobicContact CD2-CD1 3.81Å; L49-Y253 HydrophobicContact CD1-CE2 4.4Å; L49-Y253 HydrophobicContact CD2-CE2 4.2Å; L49-L293 HydrophobicContact CB-CD2 4.24Å; L49-L293 HydrophobicContact CD2-CD1 4.33Å; L49-L293 HydrophobicContact CD2-CD2 4.18Å; L49-L293 HydrophobicContact CG-CD2 4.02Å
50A97.1Very high95Very high1 Ų123.7 Ų23.71%0.00813%0.133CC..Hα-helixtrans-61.2-42173.500000112.1N25 I29 L46 C47 H53 M54 L293N25-A50 HydrophobicContact CB-CB 4.28Å; I29-A50 HydrophobicContact CD1-CB 3.96Å; I29-A50 HydrophobicContact CG1-CB 3.77Å; L46-A50 PolarHBondContact O-N 2.95Å; C47-A50 PolarHBondContact O-N 3.39Å; A50-H53 PolarHBondContact O-N 3.43Å; A50-M54 WeakPolarHBondContact O-CG 3.33Å; A50-M54 PolarHBondContact O-N 3.06Å; A50-L293 HydrophobicContact CB-CD2 3.71Å
51A97Very high95.2Very high36 Ų3619.8 Ų19.830%0.29812%0.116SC..Hα-helixtrans-63.5-40174.500000112.4C47 M48 L49 H53 M54 L55C47-A51 PolarHBondContact O-N 2.88Å; M48-A51 PolarHBondContact O-N 3.46Å; L49-A51 PolarHBondContact O-N 3.25Å; A51-H53 VanDerWaalsContact C-N 3.33Å; A51-H53 PolarHBondContact O-N 2.92Å; A51-M54 PolarHBondContact O-N 3.46Å; A51-L55 PolarHBondContact O-N 2.99Å
52T97Very high95.3Very high0 Ų020.6 Ų20.60%012%0.123CC..Hα-helixtrans-59.4-43.2172.6-540000111.4M48 L49 L55 N56 L93 A96 T97 W135M48-T52 PolarHBondContact O-N 3.19Å; M48-T52 PolarHBondContact O-OG1 2.89Å; L49-T52 WeakPolarHBondContact O-CB 3.32Å; L49-T52 PolarHBondContact O-N 3.09Å; T52-L55 PolarHBondContact O-N 3.35Å; T52-N56 WeakPolarHBondContact O-CB 3.05Å; T52-N56 PolarHBondContact O-N 2.87Å; T52-L93 HydrophobicContact CG2-CD2 4.05Å; T52-A96 HydrophobicContact CG2-CB 4.25Å; T52-T97 WeakPolarHBondContact CG2-OG1 3.42Å; T52-W135 HydrophobicContact CG2-CZ2 4.34Å; T52-W135 WeakPolarHBondContact OG1-CZ2 3.09Å
53H96.7Very high95.3Very high1 Ų122.3 Ų22.31%0.00513%0.134CC..Hα-helixtrans-65.6-40175.6-70.5-49.1000113L49 A50 A51 N56 V57 Y253 A290L49-H53 PolarHBondContact O-CD2 3.16Å; L49-H53 PolarHBondContact O-N 3.25Å; A50-H53 PolarHBondContact O-N 3.43Å; A51-H53 VanDerWaalsContact C-N 3.33Å; A51-H53 PolarHBondContact O-N 2.92Å; H53-N56 PolarHBondContact O-N 3.37Å; H53-V57 WeakPolarHBondContact O-CG2 3.31Å; H53-V57 PolarHBondContact O-N 3.44Å; H53-Y253 AromaticContact CE1-CE2 3.51Å; H53-Y253 AromaticContact CE1-CZ 3.9Å; H53-Y253 PolarHBondContact CE1-OH 3.29Å; H53-Y253 AromaticContact NE2-CE2 3.24Å; H53-Y253 WeakPolarHBondContact NE2-CE2 3.22Å; H53-Y253 AromaticContact NE2-CZ 3.41Å; H53-Y253 PolarHBondContact NE2-OH 2.95Å; H53-A290 HydrophobicContact CB-CB 3.89Å
54M97.6Very high95.2Very high51 Ų5123.4 Ų23.425%0.25114%0.138SC..Hα-helixtrans-59.6-47.9173.4-70.1171.966.200110.8L22 N25 A26 I29 A50 A51 N56 V57 A58L22-M54 HydrophobicContact CD2-CB 3.89Å; L22-M54 HydrophobicContact CD2-CG 4.2Å; L22-M54 WeakPolarHBondContact CD2-O 3.36Å; N25-M54 HydrophobicContact CB-CG 3.55Å; N25-M54 HydrophobicContact CB-SD 3.96Å; A26-M54 HydrophobicContact CB-CE 3.99Å; A26-M54 HydrophobicContact CB-SD 4.34Å; I29-M54 HydrophobicContact CD1-SD 3.86Å; A50-M54 WeakPolarHBondContact O-CG 3.33Å; A50-M54 PolarHBondContact O-N 3.06Å; A51-M54 PolarHBondContact O-N 3.46Å; M54-N56 VanDerWaalsContact C-N 3.33Å; M54-N56 PolarHBondContact O-N 3.32Å; M54-V57 PolarHBondContact O-N 3.48Å; M54-A58 VanDerWaalsContact O-CB 3.23Å; M54-A58 WeakPolarHBondContact O-CB 3.46Å; M54-A58 PolarHBondContact O-N 2.99Å
55L96.7Very high95Very high73 Ų7320.5 Ų20.538%0.38213%0.126SC..Hα-helixtrans-66-35.7179.5-166.560000112.3A51 T52 A58 V59 L93 W135A51-L55 PolarHBondContact O-N 2.99Å; T52-L55 PolarHBondContact O-N 3.35Å; L55-A58 PolarHBondContact O-N 2.69Å; L55-V59 HydrophobicContact CD1-CG2 3.74Å; L55-V59 HydrophobicContact CG-CG2 4.47Å; L55-V59 PolarHBondContact O-N 3.43Å; L55-L93 HydrophobicContact CB-CD1 4.3Å; L55-L93 HydrophobicContact CB-CD2 4.38Å; L55-L93 HydrophobicContact CD2-CD2 4.06Å; L55-L93 HydrophobicContact CG-CD1 4.11Å; L55-L93 HydrophobicContact CG-CD2 4.35Å; L55-W135 HydrophobicContact CD2-CH2 3.81Å; L55-W135 HydrophobicContact CD2-CZ3 4.01Å
56N95.3Very high94.7Very high4 Ų423.7 Ų23.72%0.02115%0.145CC..Hα-helixtrans-65-41177.1-169.950.8000111.8T52 H53 M54 P60 I61 L93T52-N56 WeakPolarHBondContact O-CB 3.05Å; T52-N56 PolarHBondContact O-N 2.87Å; H53-N56 PolarHBondContact O-N 3.37Å; M54-N56 VanDerWaalsContact C-N 3.33Å; M54-N56 PolarHBondContact O-N 3.32Å; N56-P60 WeakPolarHBondContact O-CD 3.31Å; N56-P60 VanDerWaalsContact O-CG 3.24Å; N56-P60 WeakPolarHBondContact O-CG 3.34Å; N56-P60 VanDerWaalsContact OD1-CG 3.32Å; N56-P60 WeakPolarHBondContact OD1-CG 3.5Å; N56-I61 WeakPolarHBondContact O-CG1 3.47Å; N56-I61 PolarHBondContact O-N 2.86Å; N56-L93 VanDerWaalsContact CA-CD1 3.46Å; N56-L93 HydrophobicContact CB-CB 4.25Å; N56-L93 HydrophobicContact CB-CD1 3.94Å
57V96.3Very high94.4Very high5 Ų524 Ų243%0.0315%0.147CC..Iπ-helixtrans-70.6-45.3175.1173.20000111.4G18 L22 H53 M54 V59 A62 A290G18-V57 VanDerWaalsContact C-CG1 3.5Å; G18-V57 WeakPolarHBondContact O-CG1 3.31Å; L22-V57 HydrophobicContact CD1-CG1 3.96Å; L22-V57 HydrophobicContact CD2-CB 4.34Å; L22-V57 HydrophobicContact CD2-CG1 4.36Å; L22-V57 HydrophobicContact CG-CB 4.26Å; L22-V57 HydrophobicContact CG-CG1 3.79Å; H53-V57 WeakPolarHBondContact O-CG2 3.31Å; H53-V57 PolarHBondContact O-N 3.44Å; M54-V57 PolarHBondContact O-N 3.48Å; V57-V59 PolarHBondContact O-N 3.04Å; V57-A62 WeakPolarHBondContact O-CB 3.37Å; V57-A62 PolarHBondContact O-N 2.95Å; V57-A62 VanDerWaalsContact O-N 3.11Å; V57-A290 HydrophobicContact CG2-CB 3.87Å
58A95.9Very high93.9Very high50 Ų5024.6 Ų24.641%0.41315%0.149SC..Iπ-helixtrans-68.8-32.1-174.700000114L22 M54 L55 A62L22-A58 HydrophobicContact CD2-CB 4.17Å; M54-A58 VanDerWaalsContact O-CB 3.23Å; M54-A58 WeakPolarHBondContact O-CB 3.46Å; M54-A58 PolarHBondContact O-N 2.99Å; L55-A58 PolarHBondContact O-N 2.69Å; A58-A62 WeakPolarHBondContact O-CB 3.31Å
59V94.6Very high93.4Very high46 Ų4625 Ų2528%0.27915%0.151SC..Iπ-helixtrans-103.1-84.7-178.6-176.60000111.1L55 V57 I61 A62 T63 T89L55-V59 HydrophobicContact CD1-CG2 3.74Å; L55-V59 HydrophobicContact CG-CG2 4.47Å; L55-V59 PolarHBondContact O-N 3.43Å; V57-V59 PolarHBondContact O-N 3.04Å; V59-I61 PolarHBondContact O-N 2.81Å; V59-A62 PolarHBondContact O-N 2.82Å; V59-T63 WeakPolarHBondContact O-CB 3.46Å; V59-T63 PolarHBondContact O-N 3.44Å; V59-T63 PolarHBondContact O-OG1 3.44Å; V59-T89 HydrophobicContact CB-CG2 4.2Å; V59-T89 HydrophobicContact CG1-CG2 3.85Å
60P94Very high92.9Very high0 Ų031 Ų310%017%0.174CC..Iπ-helixtrans-64.8-42.9-169.123.6-33000114N56 T63 Y64 F86 T89 F90 L93N56-P60 WeakPolarHBondContact O-CD 3.31Å; N56-P60 VanDerWaalsContact O-CG 3.24Å; N56-P60 WeakPolarHBondContact O-CG 3.34Å; N56-P60 VanDerWaalsContact OD1-CG 3.32Å; N56-P60 WeakPolarHBondContact OD1-CG 3.5Å; P60-T63 PolarHBondContact O-N 2.92Å; P60-Y64 WeakPolarHBondContact O-CB 3.5Å; P60-Y64 PolarHBondContact O-N 2.99Å; P60-F86 HydrophobicContact CB-CD2 3.77Å; P60-F86 HydrophobicContact CB-CE2 3.65Å; P60-F86 VanDerWaalsContact O-CE2 3.3Å; P60-F86 WeakPolarHBondContact O-CE2 3.37Å; P60-T89 HydrophobicContact CG-CG2 4.41Å; P60-F90 HydrophobicContact CB-CB 3.99Å; P60-F90 HydrophobicContact CB-CD2 4.21Å; P60-F90 HydrophobicContact CG-CB 4.49Å; P60-F90 HydrophobicContact CG-CD2 4.48Å; P60-L93 HydrophobicContact CG-CD1 4.18Å
61I93.6Very high92Very high2 Ų237.4 Ų37.41%0.0120%0.198CC..Iπ-helixtrans-64.8-45.7179.7-57.8-59.4000111.1W14 N56 V59 S65 L283 V287W14-I61 HydrophobicContact CB-CG2 3.93Å; N56-I61 WeakPolarHBondContact O-CG1 3.47Å; N56-I61 PolarHBondContact O-N 2.86Å; V59-I61 PolarHBondContact O-N 2.81Å; I61-S65 WeakPolarHBondContact O-CB 3.36Å; I61-S65 PolarHBondContact O-N 3.27Å; I61-S65 PolarHBondContact O-OG 2.96Å; I61-L283 HydrophobicContact CD1-CB 4.46Å; I61-L283 HydrophobicContact CD1-CD2 3.51Å; I61-V287 HydrophobicContact CD1-CG2 4.24Å; I61-V287 HydrophobicContact CG1-CG2 4.23Å; I61-V287 HydrophobicContact CG2-CG2 3.85Å
62A93.9Very high90.8Very high27 Ų2741.6 Ų41.622%0.22321%0.211CC..Hα-helixtrans-62.9-48.1176.800000112V57 A58 V59 Y64 S65 V66V57-A62 WeakPolarHBondContact O-CB 3.37Å; V57-A62 PolarHBondContact O-N 2.95Å; V57-A62 VanDerWaalsContact O-N 3.11Å; A58-A62 WeakPolarHBondContact O-CB 3.31Å; V59-A62 PolarHBondContact O-N 2.82Å; A62-Y64 PolarHBondContact O-N 3.25Å; A62-S65 PolarHBondContact O-N 3.31Å; A62-V66 WeakPolarHBondContact O-CB 3.39Å; A62-V66 VanDerWaalsContact O-CG2 3.31Å; A62-V66 WeakPolarHBondContact O-CG2 3.37Å; A62-V66 PolarHBondContact O-N 2.97Å
63T91.8Very high89.7Confident43 Ų4350 Ų5026%0.26424%0.243SC..Hα-helixtrans-56.9-50.3177.4-60.40000111.2V59 P60 S65 V66 V67 W78V59-T63 WeakPolarHBondContact O-CB 3.46Å; V59-T63 PolarHBondContact O-N 3.44Å; V59-T63 PolarHBondContact O-OG1 3.44Å; P60-T63 PolarHBondContact O-N 2.92Å; T63-S65 VanDerWaalsContact C-N 3.35Å; T63-S65 PolarHBondContact O-N 2.85Å; T63-V66 PolarHBondContact O-N 2.96Å; T63-V67 HydrophobicContact CG2-CG2 4.47Å; T63-V67 VanDerWaalsContact O-CG2 3.32Å; T63-V67 WeakPolarHBondContact O-CG2 3.4Å; T63-V67 PolarHBondContact O-N 3.49Å; T63-W78 HydrophobicContact CG2-CH2 4.35Å; T63-W78 HydrophobicContact CG2-CZ3 4.33Å
64Y89.6Confident88.3Confident22 Ų2255.7 Ų55.79%0.08628%0.28CS..Hα-helixtrans-61-44.2179.6-170.1-94.2000111.7W14 P60 A62 V67 Q68 W78 F86 F163 L283W14-Y64 HydrophobicContact CE3-CD1 4.19Å; W14-Y64 HydrophobicContact CH2-CD1 4.33Å; W14-Y64 AromaticContact CH2-CE1 3.88Å; W14-Y64 HydrophobicContact CH2-CE1 3.88Å; W14-Y64 AromaticContact CZ3-CD1 3.73Å; W14-Y64 HydrophobicContact CZ3-CD1 3.73Å; W14-Y64 AromaticContact CZ3-CE1 3.64Å; W14-Y64 HydrophobicContact CZ3-CE1 3.64Å; P60-Y64 WeakPolarHBondContact O-CB 3.5Å; P60-Y64 PolarHBondContact O-N 2.99Å; A62-Y64 PolarHBondContact O-N 3.25Å; Y64-V67 PolarHBondContact O-N 2.77Å; Y64-Q68 HydrophobicContact CD1-CG 3.91Å; Y64-Q68 HydrophobicContact CE1-CG 3.64Å; Y64-Q68 WeakPolarHBondContact O-CB 3.42Å; Y64-Q68 WeakPolarHBondContact O-CG 3.38Å; Y64-Q68 PolarHBondContact O-N 2.84Å; Y64-Q68 PolarHBondContact OH-NE2 2.91Å; Y64-W78 HydrophobicContact CD2-CH2 4.4Å; Y64-W78 AromaticContact CD2-CZ2 4Å; Y64-W78 HydrophobicContact CD2-CZ2 4Å; Y64-W78 HydrophobicContact CE2-CZ2 4.45Å; Y64-F86 HydrophobicContact CD2-CE1 4.1Å; Y64-F86 HydrophobicContact CD2-CE2 4.26Å; Y64-F86 AromaticContact CD2-CZ 3.65Å; Y64-F86 HydrophobicContact CD2-CZ 3.65Å; Y64-F86 HydrophobicContact CG-CE2 4.48Å; Y64-F86 HydrophobicContact CG-CZ 4.23Å; Y64-F163 HydrophobicContact CD2-CE1 4.28Å; Y64-F163 HydrophobicContact CE2-CD1 4.25Å; Y64-F163 AromaticContact CE2-CE1 3.8Å; Y64-F163 HydrophobicContact CE2-CE1 3.8Å; Y64-L283 HydrophobicContact CD1-CD1 3.43Å; Y64-L283 VanDerWaalsContact CD1-CD1 3.43Å; Y64-L283 HydrophobicContact CE1-CD1 3.28Å; Y64-L283 HydrophobicContact CE2-CD1 4.43Å; Y64-L283 HydrophobicContact CG-CD1 4.08Å
65S90.5Very high87.2Confident0 Ų060.3 Ų60.30%031%0.306CS..Hα-helixtrans-65-43.6179.9-53.50000112.4W14 I61 A62 T63 Q68 L69W14-S65 WeakPolarHBondContact CB-OG 3.48Å; I61-S65 WeakPolarHBondContact O-CB 3.36Å; I61-S65 PolarHBondContact O-N 3.27Å; I61-S65 PolarHBondContact O-OG 2.96Å; A62-S65 PolarHBondContact O-N 3.31Å; T63-S65 VanDerWaalsContact C-N 3.35Å; T63-S65 PolarHBondContact O-N 2.85Å; S65-Q68 PolarHBondContact O-N 3.41Å; S65-L69 WeakPolarHBondContact O-CG 3.31Å; S65-L69 PolarHBondContact O-N 2.96Å
66V90.1Very high86.1Confident72 Ų7259.7 Ų59.744%0.43630%0.3SS..Hα-helixtrans-63.5-44.6176.2170.20000110.8A62 T63 Q68 L69 R70A62-V66 WeakPolarHBondContact O-CB 3.39Å; A62-V66 VanDerWaalsContact O-CG2 3.31Å; A62-V66 WeakPolarHBondContact O-CG2 3.37Å; A62-V66 PolarHBondContact O-N 2.97Å; T63-V66 PolarHBondContact O-N 2.96Å; V66-Q68 PolarHBondContact O-N 3.2Å; V66-L69 PolarHBondContact O-N 3.37Å; V66-R70 HydrophobicContact CG1-CG 4.16Å; V66-R70 WeakPolarHBondContact O-CB 3.49Å; V66-R70 WeakPolarHBondContact O-CG 3.43Å; V66-R70 PolarHBondContact O-N 2.89Å
67V87Confident85.3Confident8 Ų866.5 Ų66.55%0.04833%0.332CS..Hα-helixtrans-62.8-42.9177.4173.20000111.2T63 Y64 L69 R70 R71 F76 W78T63-V67 HydrophobicContact CG2-CG2 4.47Å; T63-V67 VanDerWaalsContact O-CG2 3.32Å; T63-V67 WeakPolarHBondContact O-CG2 3.4Å; T63-V67 PolarHBondContact O-N 3.49Å; Y64-V67 PolarHBondContact O-N 2.77Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.33Å; V67-R70 PolarHBondContact O-N 3.46Å; V67-R70 VanDerWaalsContact O-N 3.15Å; V67-R71 WeakPolarHBondContact O-CB 3.45Å; V67-R71 PolarHBondContact O-N 2.97Å; V67-F76 HydrophobicContact CB-CE1 4.35Å; V67-F76 HydrophobicContact CG1-CE1 4.02Å; V67-F76 HydrophobicContact CG2-CE1 4.16Å; V67-W78 HydrophobicContact CB-CH2 4.27Å; V67-W78 HydrophobicContact CB-CZ2 3.86Å; V67-W78 HydrophobicContact CG1-CD2 3.92Å; V67-W78 HydrophobicContact CG1-CG 4.27Å; V67-W78 HydrophobicContact CG1-CH2 4.42Å; V67-W78 HydrophobicContact CG1-CZ2 3.67Å; V67-W78 HydrophobicContact CG2-CE3 4.44Å; V67-W78 HydrophobicContact CG2-CH2 4.04Å; V67-W78 HydrophobicContact CG2-CZ2 4.11Å; V67-W78 HydrophobicContact CG2-CZ3 4.21Å
68Q85.3Confident84.6Confident28 Ų2867.5 Ų67.513%0.13134%0.335CS..Hα-helixtrans-64.9-33177.8-68.1-75.46800113.1A11 Y64 S65 V66A11-Q68 HydrophobicContact CB-CB 4.15Å; Y64-Q68 HydrophobicContact CD1-CG 3.91Å; Y64-Q68 HydrophobicContact CE1-CG 3.64Å; Y64-Q68 WeakPolarHBondContact O-CB 3.42Å; Y64-Q68 WeakPolarHBondContact O-CG 3.38Å; Y64-Q68 PolarHBondContact O-N 2.84Å; Y64-Q68 PolarHBondContact OH-NE2 2.91Å; S65-Q68 PolarHBondContact O-N 3.41Å; V66-Q68 PolarHBondContact O-N 3.2Å
69L86.5Confident84Confident55 Ų5569.8 Ų69.829%0.28834%0.34SS..Hα-helixtrans-71-40.6170.6-70.5172000112.1A11 V12 L15 S65 V66 V67 Q72A11-L69 HydrophobicContact CB-CD2 4.09Å; A11-L69 HydrophobicContact CB-CG 3.95Å; V12-L69 HydrophobicContact CG2-CD2 4.07Å; L15-L69 HydrophobicContact CD1-CD1 3.63Å; S65-L69 WeakPolarHBondContact O-CG 3.31Å; S65-L69 PolarHBondContact O-N 2.96Å; V66-L69 PolarHBondContact O-N 3.37Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.33Å; L69-Q72 WeakPolarHBondContact O-CB 3.39Å; L69-Q72 WeakPolarHBondContact O-CG 3.48Å; L69-Q72 PolarHBondContact O-N 3.07Å
70R85.4Confident83.4Confident128 Ų12871.9 Ų71.948%0.48335%0.347SS..Hα-helixtrans-70.7-31.1-178.8-71-71.3-66.4-102.4-3.1113V66 V67 Q72 R73 F76V66-R70 HydrophobicContact CG1-CG 4.16Å; V66-R70 WeakPolarHBondContact O-CB 3.49Å; V66-R70 WeakPolarHBondContact O-CG 3.43Å; V66-R70 PolarHBondContact O-N 2.89Å; V67-R70 PolarHBondContact O-N 3.46Å; V67-R70 VanDerWaalsContact O-N 3.15Å; R70-Q72 PolarHBondContact O-N 2.83Å; R70-Q72 VanDerWaalsContact O-N 3.12Å; R70-R73 PolarHBondContact O-N 2.96Å; R70-F76 HydrophobicContact CB-CD1 3.4Å; R70-F76 HydrophobicContact CB-CD2 4.49Å; R70-F76 HydrophobicContact CB-CE1 3.59Å; R70-F76 HydrophobicContact CB-CG 3.89Å; R70-F76 HydrophobicContact CB-CZ 4.23Å; R70-F76 HydrophobicContact CG-CE1 4.4Å
71R78.2Confident82.9Confident134 Ų13473.5 Ų73.551%0.50636%0.364SS..THydrogen-bonded Turntrans-65.1-6.7174.8-159.4176.1-171.3175.95114.1V67 R73V67-R71 WeakPolarHBondContact O-CB 3.45Å; V67-R71 PolarHBondContact O-N 2.97Å; R71-R73 PolarHBondContact O-N 2.71Å
72Q70.8Confident82.5Confident124 Ų12477.6 Ų77.658%0.57939%0.385SS*.THydrogen-bonded Turntrans-66.3-17164.7-63.5179.619.100112.7L69 R70L69-Q72 WeakPolarHBondContact O-CB 3.39Å; L69-Q72 WeakPolarHBondContact O-CG 3.48Å; L69-Q72 PolarHBondContact O-N 3.07Å; R70-Q72 PolarHBondContact O-N 2.83Å; R70-Q72 VanDerWaalsContact O-N 3.12Å
73R74.7Confident82.2Confident178 Ų17876.4 Ų76.467%0.67238%0.375SS*.SBendtrans-93.7133.3167.1-60.2-167.4-178.2-165.70.8109.1R70 R71 D75 F76R70-R73 PolarHBondContact O-N 2.96Å; R71-R73 PolarHBondContact O-N 2.71Å; R73-D75 PolarHBondContact O-N 2.91Å; R73-F76 PolarHBondContact O-N 3.5Å
74P66.6Low81.9Confident120 Ų12077.1 Ų77.178%0.77937%0.374SS*.THydrogen-bonded Turntrans-63.8-25.9-17325.7-34.6000113.5F76P74-F76 PolarHBondContact O-N 3.49Å
75D73.9Confident81.9Confident148 Ų14880.2 Ų80.279%0.79140%0.395SS*.THydrogen-bonded Turntrans-87.73.9-173-36.4-64.1000114.3R73R73-D75 PolarHBondContact O-N 2.91Å
76F74.6Confident81.9Confident60 Ų6080.3 Ų80.326%0.26340%0.396SS..  trans-10999.6-174.6-168.5-96.1000113.1V67 R70 R73 P74V67-F76 HydrophobicContact CB-CE1 4.35Å; V67-F76 HydrophobicContact CG1-CE1 4.02Å; V67-F76 HydrophobicContact CG2-CE1 4.16Å; R70-F76 HydrophobicContact CB-CD1 3.4Å; R70-F76 HydrophobicContact CB-CD2 4.49Å; R70-F76 HydrophobicContact CB-CE1 3.59Å; R70-F76 HydrophobicContact CB-CG 3.89Å; R70-F76 HydrophobicContact CB-CZ 4.23Å; R70-F76 HydrophobicContact CG-CE1 4.4Å; R73-F76 PolarHBondContact O-N 3.5Å; P74-F76 PolarHBondContact O-N 3.49Å
77E77.9Confident81.8Confident146 Ų14677 Ų7768%0.68238%0.376SS*.PPolyproline II helixtrans-102.7167.7174.4-59.1-157.5127.200113N79E77-N79 PolarHBondContact O-N 3.4Å
78W82.1Confident82Confident26 Ų2677.2 Ų77.210%0.09838%0.378CS..PPolyproline II helixtrans-71125.9174.1-82.691.5000110.6T63 Y64 V67 C83 F86 C161T63-W78 HydrophobicContact CG2-CH2 4.35Å; T63-W78 HydrophobicContact CG2-CZ3 4.33Å; Y64-W78 HydrophobicContact CD2-CH2 4.4Å; Y64-W78 AromaticContact CD2-CZ2 4Å; Y64-W78 HydrophobicContact CD2-CZ2 4Å; Y64-W78 HydrophobicContact CE2-CZ2 4.45Å; V67-W78 HydrophobicContact CB-CH2 4.27Å; V67-W78 HydrophobicContact CB-CZ2 3.86Å; V67-W78 HydrophobicContact CG1-CD2 3.92Å; V67-W78 HydrophobicContact CG1-CG 4.27Å; V67-W78 HydrophobicContact CG1-CH2 4.42Å; V67-W78 HydrophobicContact CG1-CZ2 3.67Å; V67-W78 HydrophobicContact CG2-CE3 4.44Å; V67-W78 HydrophobicContact CG2-CH2 4.04Å; V67-W78 HydrophobicContact CG2-CZ2 4.11Å; V67-W78 HydrophobicContact CG2-CZ3 4.21Å; W78-C83 HydrophobicContact CE3-CB 4.12Å; W78-F86 HydrophobicContact CH2-CB 4.41Å; W78-F86 AromaticContact CH2-CD1 3.95Å; W78-F86 HydrophobicContact CH2-CD1 3.95Å; W78-F86 HydrophobicContact CH2-CD2 4.5Å; W78-F86 HydrophobicContact CH2-CE1 4.37Å; W78-F86 HydrophobicContact CH2-CG 4.02Å; W78-F86 HydrophobicContact CZ3-CB 4.11Å; W78-F86 HydrophobicContact CZ3-CD1 4.25Å; W78-F86 HydrophobicContact CZ3-CG 4.2Å; W78-C161 HydrophobicContact CB-CB 4.14Å; W78-C161 HydrophobicContact CD2-CB 3.23Å; W78-C161 VanDerWaalsContact CE2-CB 3.45Å; W78-C161 HydrophobicContact CE3-CB 3.58Å; W78-C161 HydrophobicContact CG-CB 3.5Å; W78-C161 HydrophobicContact CH2-CB 4.28Å; W78-C161 HydrophobicContact CZ2-CB 4Å; W78-C161 HydrophobicContact CZ3-CB 4.09Å
79N82.8Confident82.4Confident99 Ų9977.4 Ų77.453%0.52938%0.381SS..PPolyproline II helixtrans-73.6136.4166-176.9-58.4000109.8E77 G81 L82 C83E77-N79 PolarHBondContact O-N 3.4Å; N79-G81 VanDerWaalsContact C-N 3.31Å; N79-G81 PolarHBondContact O-N 3.1Å; N79-G81 PolarHBondContact OD1-N 3.45Å; N79-L82 HydrophobicContact CB-CB 4.17Å; N79-L82 HydrophobicContact CB-CD1 3.96Å; N79-L82 HydrophobicContact CB-CG 4Å; N79-L82 PolarHBondContact O-N 3.48Å; N79-L82 VanDerWaalsContact O-N 3.11Å; N79-C83 PolarHBondContact O-N 3.05Å
80E82.4Confident82.7Confident90 Ų9075 Ų7542%0.42137%0.368SS..Hα-helixtrans-50.6-47.1177.4166170.1-172.500112.7C83 K84 Y157E80-C83 PolarHBondContact O-N 3.35Å; E80-K84 HydrophobicContact CG-CD 4.23Å; E80-K84 WeakPolarHBondContact O-CG 3.4Å; E80-K84 PolarHBondContact O-N 2.75Å; E80-K84 VanDerWaalsContact OE1-CE 3.23Å; E80-K84 WeakPolarHBondContact OE1-CE 3.33Å; E80-K84 IonicContact OE1-NZ 2.63Å; E80-K84 PolarHBondContact OE1-NZ 2.84Å; E80-Y157 HydrophobicContact CG-CG 4.14Å
81G83.5Confident83.1Confident34 Ų3469.3 Ų69.335%0.35135%0.347SS..Hα-helixtrans-64.6-40.217900000112.7N79 K84 V85N79-G81 VanDerWaalsContact C-N 3.31Å; N79-G81 PolarHBondContact O-N 3.1Å; N79-G81 PolarHBondContact OD1-N 3.45Å; G81-K84 PolarHBondContact O-N 3.31Å; G81-V85 WeakPolarHBondContact O-CG2 3.23Å; G81-V85 PolarHBondContact O-N 3.44Å
82L85.3Confident84Confident88 Ų8863.2 Ų63.246%0.46133%0.325SS..Hα-helixtrans-65.2-39.2175.2-68.8178.9000111.6N79 F86N79-L82 HydrophobicContact CB-CB 4.17Å; N79-L82 HydrophobicContact CB-CD1 3.96Å; N79-L82 HydrophobicContact CB-CG 4Å; N79-L82 PolarHBondContact O-N 3.48Å; N79-L82 VanDerWaalsContact O-N 3.11Å; L82-F86 WeakPolarHBondContact O-CB 3.4Å; L82-F86 PolarHBondContact O-N 3.35Å
83C86.2Confident85.1Confident1 Ų157.4 Ų57.41%0.00730%0.298CS..Hα-helixtrans-66.7-44.1175.8-176.20000111.7W78 N79 E80 V85 F86 V87 Y157 C161W78-C83 HydrophobicContact CE3-CB 4.12Å; N79-C83 PolarHBondContact O-N 3.05Å; E80-C83 PolarHBondContact O-N 3.35Å; C83-V85 PolarHBondContact O-N 2.79Å; C83-F86 PolarHBondContact O-N 2.92Å; C83-V87 WeakPolarHBondContact O-CB 3.28Å; C83-V87 VanDerWaalsContact O-CG2 3.24Å; C83-V87 WeakPolarHBondContact O-CG2 3.28Å; C83-V87 PolarHBondContact O-N 3.25Å; C83-Y157 HydrophobicContact CB-CD1 3.83Å; C83-Y157 HydrophobicContact CB-CE1 4.34Å; C83-Y157 VanDerWaalsContact SG-CD1 3.55Å; C83-C161 WeakPolarHBondContact CA-SG 3.44Å; C83-C161 HydrophobicContact CB-CB 3.66Å; C83-C161 WeakPolarHBondContact CB-SG 3.48Å; C83-C161 WeakPolarHBondContact SG-CA 3.09Å; C83-C161 WeakPolarHBondContact SG-CB 3.4Å; C83-C161 CovalentContact SG-SG 2.03Å; C83-C161 PolarHBondContact SG-SG 3.45Å
84K87.1Confident86.1Confident58 Ų5849.1 Ų49.125%0.25227%0.267SS..Hα-helixtrans-56-48.9174.6-76.5176.8-175.31780112.2E80 G81 S88 A146 Y157E80-K84 HydrophobicContact CG-CD 4.23Å; E80-K84 WeakPolarHBondContact O-CG 3.4Å; E80-K84 PolarHBondContact O-N 2.75Å; E80-K84 VanDerWaalsContact OE1-CE 3.23Å; E80-K84 WeakPolarHBondContact OE1-CE 3.33Å; E80-K84 IonicContact OE1-NZ 2.63Å; E80-K84 PolarHBondContact OE1-NZ 2.84Å; G81-K84 PolarHBondContact O-N 3.31Å; K84-S88 VanDerWaalsContact O-CB 3.28Å; K84-S88 WeakPolarHBondContact O-CB 3.27Å; K84-S88 PolarHBondContact O-N 2.79Å; K84-A146 HydrophobicContact CB-CB 4.45Å; K84-A146 HydrophobicContact CG-CB 4.49Å; K84-Y157 HydrophobicContact CB-CE1 4.28Å; K84-Y157 HydrophobicContact CD-CD2 4.39Å; K84-Y157 HydrophobicContact CD-CE2 4.18Å; K84-Y157 HydrophobicContact CG-CD1 3.83Å; K84-Y157 HydrophobicContact CG-CD2 4.12Å; K84-Y157 HydrophobicContact CG-CE1 3.43Å; K84-Y157 VanDerWaalsContact CG-CE1 3.43Å; K84-Y157 HydrophobicContact CG-CE2 3.74Å; K84-Y157 HydrophobicContact CG-CG 4.16Å
85V88.3Confident87.4Confident87 Ų8743.5 Ų43.553%0.52723%0.23SC..Hα-helixtrans-64.6-45.1178.3172.50000111.5G81 C83 T89G81-V85 WeakPolarHBondContact O-CG2 3.23Å; G81-V85 PolarHBondContact O-N 3.44Å; C83-V85 PolarHBondContact O-N 2.79Å; V85-T89 VanDerWaalsContact O-CB 3.24Å; V85-T89 WeakPolarHBondContact O-CB 3.27Å; V85-T89 PolarHBondContact O-N 3.26Å; V85-T89 PolarHBondContact O-OG1 3.35Å
86F90.6Very high88.5Confident2 Ų236.5 Ų36.51%0.00919%0.193CC..Hα-helixtrans-59-52.6177.4167-107000112P60 Y64 W78 L82 C83 T89 F90 F163P60-F86 HydrophobicContact CB-CD2 3.77Å; P60-F86 HydrophobicContact CB-CE2 3.65Å; P60-F86 VanDerWaalsContact O-CE2 3.3Å; P60-F86 WeakPolarHBondContact O-CE2 3.37Å; Y64-F86 HydrophobicContact CD2-CE1 4.1Å; Y64-F86 HydrophobicContact CD2-CE2 4.26Å; Y64-F86 AromaticContact CD2-CZ 3.65Å; Y64-F86 HydrophobicContact CD2-CZ 3.65Å; Y64-F86 HydrophobicContact CG-CE2 4.48Å; Y64-F86 HydrophobicContact CG-CZ 4.23Å; W78-F86 HydrophobicContact CH2-CB 4.41Å; W78-F86 AromaticContact CH2-CD1 3.95Å; W78-F86 HydrophobicContact CH2-CD1 3.95Å; W78-F86 HydrophobicContact CH2-CD2 4.5Å; W78-F86 HydrophobicContact CH2-CE1 4.37Å; W78-F86 HydrophobicContact CH2-CG 4.02Å; W78-F86 HydrophobicContact CZ3-CB 4.11Å; W78-F86 HydrophobicContact CZ3-CD1 4.25Å; W78-F86 HydrophobicContact CZ3-CG 4.2Å; L82-F86 WeakPolarHBondContact O-CB 3.4Å; L82-F86 PolarHBondContact O-N 3.35Å; C83-F86 PolarHBondContact O-N 2.92Å; F86-T89 PolarHBondContact O-N 3.39Å; F86-F90 VanDerWaalsContact O-CB 3.22Å; F86-F90 WeakPolarHBondContact O-CB 3.3Å; F86-F90 PolarHBondContact O-N 3.01Å; F86-F163 HydrophobicContact CD1-CB 4.42Å; F86-F163 HydrophobicContact CE1-CB 3.75Å; F86-F163 AromaticContact CE1-CD1 3.59Å; F86-F163 HydrophobicContact CE1-CD1 3.59Å; F86-F163 HydrophobicContact CE1-CD2 4.48Å; F86-F163 HydrophobicContact CE1-CE1 4.29Å; F86-F163 AromaticContact CE1-CG 3.7Å; F86-F163 HydrophobicContact CE1-CG 3.7Å; F86-F163 AromaticContact CZ-CD1 3.94Å; F86-F163 HydrophobicContact CZ-CD1 3.94Å; F86-F163 HydrophobicContact CZ-CE1 4.19Å; F86-F163 HydrophobicContact CZ-CG 4.14Å
87V89.4Confident89.6Confident2 Ų233.8 Ų33.81%0.01218%0.181CC..Hα-helixtrans-58.7-54.1178.9170.50000110.2C83 T89 F90 Y91 F163 I168C83-V87 WeakPolarHBondContact O-CB 3.28Å; C83-V87 VanDerWaalsContact O-CG2 3.24Å; C83-V87 WeakPolarHBondContact O-CG2 3.28Å; C83-V87 PolarHBondContact O-N 3.25Å; V87-T89 VanDerWaalsContact C-N 3.33Å; V87-T89 PolarHBondContact O-N 3.48Å; V87-F90 PolarHBondContact O-N 3.21Å; V87-Y91 HydrophobicContact CG1-CD2 3.8Å; V87-Y91 HydrophobicContact CG1-CE2 3.95Å; V87-Y91 VanDerWaalsContact O-CD2 3.26Å; V87-Y91 WeakPolarHBondContact O-CD2 3.31Å; V87-Y91 PolarHBondContact O-N 2.71Å; V87-F163 HydrophobicContact CG2-CB 3.82Å; V87-I168 HydrophobicContact CG1-CD1 4.14Å
88S90.8Very high90.4Very high13 Ų1327.3 Ų27.39%0.09115%0.152CC..Hα-helixtrans-59.7-42.2-178.1177.10000112.2K84 T92 S142K84-S88 VanDerWaalsContact O-CB 3.28Å; K84-S88 WeakPolarHBondContact O-CB 3.27Å; K84-S88 PolarHBondContact O-N 2.79Å; S88-T92 VanDerWaalsContact O-CB 3.29Å; S88-T92 WeakPolarHBondContact O-CB 3.23Å; S88-T92 PolarHBondContact O-N 2.89Å; S88-T92 PolarHBondContact O-OG1 3.07Å; S88-S142 WeakPolarHBondContact O-CB 3.34Å; S88-S142 PolarHBondContact OG-O 3.27Å
89T93.6Very high91.1Very high33 Ų3328 Ų2820%0.20216%0.156CC..Hα-helixtrans-70.6-41.3179.4-56.10000111.6V59 P60 V85 F86 V87 Y91 T92 L93V59-T89 HydrophobicContact CB-CG2 4.2Å; V59-T89 HydrophobicContact CG1-CG2 3.85Å; P60-T89 HydrophobicContact CG-CG2 4.41Å; V85-T89 VanDerWaalsContact O-CB 3.24Å; V85-T89 WeakPolarHBondContact O-CB 3.27Å; V85-T89 PolarHBondContact O-N 3.26Å; V85-T89 PolarHBondContact O-OG1 3.35Å; F86-T89 PolarHBondContact O-N 3.39Å; V87-T89 VanDerWaalsContact C-N 3.33Å; V87-T89 PolarHBondContact O-N 3.48Å; T89-Y91 PolarHBondContact O-N 3.48Å; T89-T92 PolarHBondContact O-N 2.97Å; T89-L93 HydrophobicContact CG2-CD1 3.62Å; T89-L93 HydrophobicContact CG2-CG 4.18Å; T89-L93 WeakPolarHBondContact O-CB 3.39Å; T89-L93 VanDerWaalsContact O-CG 3.27Å; T89-L93 WeakPolarHBondContact O-CG 3.27Å; T89-L93 PolarHBondContact O-N 3.47Å
90F93.2Very high91.8Very high5 Ų523.6 Ų23.62%0.02213%0.132CC..Hα-helixtrans-59.6-46.8177177.4-95.7000112.1P60 F86 V87 T94 F163 V282P60-F90 HydrophobicContact CB-CB 3.99Å; P60-F90 HydrophobicContact CB-CD2 4.21Å; P60-F90 HydrophobicContact CG-CB 4.49Å; P60-F90 HydrophobicContact CG-CD2 4.48Å; F86-F90 VanDerWaalsContact O-CB 3.22Å; F86-F90 WeakPolarHBondContact O-CB 3.3Å; F86-F90 PolarHBondContact O-N 3.01Å; V87-F90 PolarHBondContact O-N 3.21Å; F90-T94 WeakPolarHBondContact O-CB 3.37Å; F90-T94 PolarHBondContact O-N 3.37Å; F90-T94 PolarHBondContact O-OG1 2.88Å; F90-F163 AromaticContact CD1-CD2 3.95Å; F90-F163 HydrophobicContact CD1-CD2 3.95Å; F90-F163 HydrophobicContact CD1-CE2 4.2Å; F90-F163 HydrophobicContact CE1-CD2 4.07Å; F90-F163 AromaticContact CE1-CE2 3.95Å; F90-F163 HydrophobicContact CE1-CE2 3.95Å; F90-F163 HydrophobicContact CZ-CE2 4.21Å; F90-V282 HydrophobicContact CE1-CG1 4.25Å; F90-V282 HydrophobicContact CE2-CG1 4.28Å; F90-V282 HydrophobicContact CZ-CG1 3.45Å; F90-V282 VanDerWaalsContact CZ-CG1 3.45Å
91Y93.4Very high92.4Very high7 Ų719.4 Ų19.43%0.02711%0.113CC..Hα-helixtrans-69.3-37.3176.3-77-71.6000112.4V87 T89 L93 T94 L95 S142 F163 V165 I168 F172 F176V87-Y91 HydrophobicContact CG1-CD2 3.8Å; V87-Y91 HydrophobicContact CG1-CE2 3.95Å; V87-Y91 VanDerWaalsContact O-CD2 3.26Å; V87-Y91 WeakPolarHBondContact O-CD2 3.31Å; V87-Y91 PolarHBondContact O-N 2.71Å; T89-Y91 PolarHBondContact O-N 3.48Å; Y91-L93 PolarHBondContact O-N 3.29Å; Y91-T94 WeakPolarHBondContact O-CB 3.16Å; Y91-T94 PolarHBondContact O-N 2.9Å; Y91-L95 PolarHBondContact O-N 3.45Å; Y91-S142 PolarHBondContact O-OG 3.15Å; Y91-F163 WeakPolarHBondContact CE2-O 3.29Å; Y91-F163 PolarHBondContact OH-O 3.41Å; Y91-V165 HydrophobicContact CE1-CG2 3.92Å; Y91-V165 WeakPolarHBondContact OH-CG2 3.47Å; Y91-V165 PolarHBondContact OH-N 2.81Å; Y91-I168 HydrophobicContact CD2-CD1 4.42Å; Y91-I168 HydrophobicContact CE2-CD1 3.55Å; Y91-F172 HydrophobicContact CD1-CE1 4.36Å; Y91-F172 HydrophobicContact CD1-CZ 4.29Å; Y91-F172 HydrophobicContact CD2-CE1 4.44Å; Y91-F172 HydrophobicContact CD2-CZ 4.46Å; Y91-F172 HydrophobicContact CE1-CE1 4.37Å; Y91-F172 HydrophobicContact CE2-CE1 4.48Å; Y91-F172 HydrophobicContact CG-CE1 4.41Å; Y91-F172 HydrophobicContact CG-CZ 4.16Å; Y91-F176 AromaticContact CD1-CD2 3.89Å; Y91-F176 HydrophobicContact CD1-CD2 3.89Å; Y91-F176 HydrophobicContact CD1-CE1 4.22Å; Y91-F176 AromaticContact CD1-CE2 3.51Å; Y91-F176 HydrophobicContact CD1-CE2 3.51Å; Y91-F176 HydrophobicContact CD1-CG 4.39Å; Y91-F176 AromaticContact CD1-CZ 3.69Å; Y91-F176 HydrophobicContact CD1-CZ 3.69Å; Y91-F176 HydrophobicContact CE1-CD1 4.19Å; Y91-F176 HydrophobicContact CE1-CD2 4.32Å; Y91-F176 AromaticContact CE1-CE1 3.83Å; Y91-F176 HydrophobicContact CE1-CE1 3.83Å; Y91-F176 HydrophobicContact CE1-CE2 4Å; Y91-F176 HydrophobicContact CE1-CG 4.41Å; Y91-F176 AromaticContact CE1-CZ 3.73Å; Y91-F176 HydrophobicContact CE1-CZ 3.73Å
92T96Very high93Very high7 Ų719 Ų194%0.04310%0.104CC..Hα-helixtrans-58.2-49.6175.8-62.90000110.7S88 T89 T94 L95 A96 S138 F139 S142S88-T92 VanDerWaalsContact O-CB 3.29Å; S88-T92 WeakPolarHBondContact O-CB 3.23Å; S88-T92 PolarHBondContact O-N 2.89Å; S88-T92 PolarHBondContact O-OG1 3.07Å; T89-T92 PolarHBondContact O-N 2.97Å; T92-T94 VanDerWaalsContact C-N 3.35Å; T92-L95 PolarHBondContact O-N 3.3Å; T92-A96 WeakPolarHBondContact O-CB 3.15Å; T92-A96 PolarHBondContact O-N 3.01Å; T92-S138 WeakPolarHBondContact O-CB 3.27Å; T92-F139 HydrophobicContact CG2-CB 4.1Å; T92-S142 VanDerWaalsContact CA-OG 3.29Å; T92-S142 WeakPolarHBondContact CA-OG 3.43Å; T92-S142 PolarHBondContact N-OG 3.31Å; T92-S142 VanDerWaalsContact OG1-CB 3.24Å; T92-S142 WeakPolarHBondContact OG1-CB 3.45Å
93L95.7Very high93.6Very high2 Ų215.4 Ų15.41%0.019%0.086CC..Hα-helixtrans-75-28.1-175.8-61.6175000112.1T52 L55 N56 P60 T89 Y91 T97 W135T52-L93 HydrophobicContact CG2-CD2 4.05Å; L55-L93 HydrophobicContact CB-CD1 4.3Å; L55-L93 HydrophobicContact CB-CD2 4.38Å; L55-L93 HydrophobicContact CD2-CD2 4.06Å; L55-L93 HydrophobicContact CG-CD1 4.11Å; L55-L93 HydrophobicContact CG-CD2 4.35Å; N56-L93 VanDerWaalsContact CA-CD1 3.46Å; N56-L93 HydrophobicContact CB-CB 4.25Å; N56-L93 HydrophobicContact CB-CD1 3.94Å; P60-L93 HydrophobicContact CG-CD1 4.18Å; T89-L93 HydrophobicContact CG2-CD1 3.62Å; T89-L93 HydrophobicContact CG2-CG 4.18Å; T89-L93 WeakPolarHBondContact O-CB 3.39Å; T89-L93 VanDerWaalsContact O-CG 3.27Å; T89-L93 WeakPolarHBondContact O-CG 3.27Å; T89-L93 PolarHBondContact O-N 3.47Å; Y91-L93 PolarHBondContact O-N 3.29Å; L93-T97 VanDerWaalsContact O-CB 3.25Å; L93-T97 WeakPolarHBondContact O-CB 3.47Å; L93-T97 PolarHBondContact O-N 3.49Å; L93-T97 PolarHBondContact O-OG1 3.41Å; L93-W135 HydrophobicContact CD2-CH2 3.47Å; L93-W135 VanDerWaalsContact CD2-CH2 3.47Å; L93-W135 HydrophobicContact CD2-CZ2 4.5Å; L93-W135 HydrophobicContact CD2-CZ3 3.65Å
94T94.3Very high94Very high4 Ų415.5 Ų15.53%0.0259%0.086CC..Hα-helixtrans-61.2-56.6167.9-68.80000111.2F90 Y91 T92 A96 T97 C98 F176 M257F90-T94 WeakPolarHBondContact O-CB 3.37Å; F90-T94 PolarHBondContact O-N 3.37Å; F90-T94 PolarHBondContact O-OG1 2.88Å; Y91-T94 WeakPolarHBondContact O-CB 3.16Å; Y91-T94 PolarHBondContact O-N 2.9Å; T92-T94 VanDerWaalsContact C-N 3.35Å; T94-A96 PolarHBondContact O-N 3.42Å; T94-T97 PolarHBondContact O-N 3.47Å; T94-C98 PolarHBondContact O-N 3.01Å; T94-C98 PolarHBondContact O-SG 3.11Å; T94-C98 VanDerWaalsContact O-SG 3.36Å; T94-F176 HydrophobicContact CG2-CE2 3.86Å; T94-F176 HydrophobicContact CG2-CZ 3.64Å; T94-M257 HydrophobicContact CG2-CE 3.63Å
95L95.3Very high94.5Very high2 Ų212.7 Ų12.71%0.017%0.074CC..Hα-helixtrans-61.7-43.4178.3-72178000112.1Y91 T92 T97 C98 F99 L141 F176 L179 V180Y91-L95 PolarHBondContact O-N 3.45Å; T92-L95 PolarHBondContact O-N 3.3Å; L95-T97 VanDerWaalsContact C-N 3.3Å; L95-T97 PolarHBondContact O-N 2.97Å; L95-C98 PolarHBondContact O-N 2.95Å; L95-F99 HydrophobicContact CB-CD2 4.44Å; L95-F99 HydrophobicContact CB-CE2 4.16Å; L95-F99 HydrophobicContact CD2-CE2 4.48Å; L95-F99 HydrophobicContact CD2-CZ 4.34Å; L95-F99 WeakPolarHBondContact O-CD2 3.36Å; L95-F99 WeakPolarHBondContact O-CG 3.48Å; L95-F99 PolarHBondContact O-N 3.36Å; L95-L141 HydrophobicContact CD1-CB 4.2Å; L95-F176 HydrophobicContact CD1-CD2 4.49Å; L95-F176 HydrophobicContact CD2-CD2 3.91Å; L95-F176 HydrophobicContact CD2-CE2 3.87Å; L95-F176 HydrophobicContact CG-CD2 4.2Å; L95-F176 HydrophobicContact CG-CE2 4.04Å; L95-L179 HydrophobicContact CD2-CB 4.03Å; L95-V180 HydrophobicContact CD2-CG2 3.94Å
96A96.9Very high94.9Very high0 Ų014 Ų140%07%0.071CC..Hα-helixtrans-62.8-36.3178.400000112T52 T92 T94 S100 I134 S138T52-A96 HydrophobicContact CG2-CB 4.25Å; T92-A96 WeakPolarHBondContact O-CB 3.15Å; T92-A96 PolarHBondContact O-N 3.01Å; T94-A96 PolarHBondContact O-N 3.42Å; A96-S100 WeakPolarHBondContact O-CB 3.39Å; A96-S100 PolarHBondContact O-N 3.43Å; A96-S100 PolarHBondContact O-OG 3.33Å; A96-I134 HydrophobicContact CB-CG2 4.27Å; A96-S138 WeakPolarHBondContact CA-OG 3.34Å; A96-S138 PolarHBondContact N-OG 3.14Å
97T96Very high95.1Very high4 Ų414.4 Ų14.43%0.0257%0.072CC..Hα-helixtrans-65-52.9173.1-61.10000110.5L49 T52 L93 T94 L95 F99 S100 V101 Y253 M257L49-T97 HydrophobicContact CD1-CG2 4.2Å; T52-T97 WeakPolarHBondContact CG2-OG1 3.42Å; L93-T97 VanDerWaalsContact O-CB 3.25Å; L93-T97 WeakPolarHBondContact O-CB 3.47Å; L93-T97 PolarHBondContact O-N 3.49Å; L93-T97 PolarHBondContact O-OG1 3.41Å; T94-T97 PolarHBondContact O-N 3.47Å; L95-T97 VanDerWaalsContact C-N 3.3Å; L95-T97 PolarHBondContact O-N 2.97Å; T97-F99 PolarHBondContact O-N 2.96Å; T97-S100 PolarHBondContact O-N 3.35Å; T97-V101 WeakPolarHBondContact O-CG2 3.36Å; T97-V101 PolarHBondContact O-N 2.84Å; T97-Y253 HydrophobicContact CG2-CD2 4.12Å; T97-Y253 HydrophobicContact CG2-CE2 4.14Å; T97-M257 HydrophobicContact CG2-CE 4.34Å
98C95.4Very high95.4Very high10 Ų1014.4 Ų14.47%0.0687%0.072CC..Hα-helixtrans-56.3-53.2179.6-65.40000111.7T94 L95 S100 V101 T102 S183T94-C98 PolarHBondContact O-N 3.01Å; T94-C98 PolarHBondContact O-SG 3.11Å; T94-C98 VanDerWaalsContact O-SG 3.36Å; L95-C98 PolarHBondContact O-N 2.95Å; C98-S100 VanDerWaalsContact C-N 3.31Å; C98-S100 PolarHBondContact O-N 2.94Å; C98-V101 PolarHBondContact O-N 3.46Å; C98-T102 PolarHBondContact O-N 2.89Å; C98-T102 PolarHBondContact O-OG1 2.9Å; C98-S183 WeakPolarHBondContact CB-OG 3.49Å
99F96.7Very high95.6Very high40 Ų4015.3 Ų15.318%0.1758%0.076CC..Hα-helixtrans-65.4-31.3179.6-62.4-35.3000113.3L95 T97 T102 S103 I134 V137 L179L95-F99 HydrophobicContact CB-CD2 4.44Å; L95-F99 HydrophobicContact CB-CE2 4.16Å; L95-F99 HydrophobicContact CD2-CE2 4.48Å; L95-F99 HydrophobicContact CD2-CZ 4.34Å; L95-F99 WeakPolarHBondContact O-CD2 3.36Å; L95-F99 WeakPolarHBondContact O-CG 3.48Å; L95-F99 PolarHBondContact O-N 3.36Å; T97-F99 PolarHBondContact O-N 2.96Å; F99-T102 PolarHBondContact O-N 3.31Å; F99-S103 VanDerWaalsContact O-CB 3.24Å; F99-S103 WeakPolarHBondContact O-CB 3.25Å; F99-S103 PolarHBondContact O-N 3.12Å; F99-I134 HydrophobicContact CB-CB 4.45Å; F99-I134 HydrophobicContact CB-CD1 4.22Å; F99-I134 HydrophobicContact CB-CG1 3.91Å; F99-I134 HydrophobicContact CB-CG2 3.83Å; F99-I134 HydrophobicContact CD2-CG2 4.47Å; F99-V137 HydrophobicContact CE2-CG1 4.34Å; F99-L179 HydrophobicContact CZ-CB 4.23Å; F99-L179 HydrophobicContact CZ-CD2 4.17Å
100S96.8Very high95.6Very high6 Ų615.2 Ų15.24%0.0427%0.071CC..Hα-helixtrans-68.5-37.8174.3-63.90000112A96 T97 C98 S103 L104A96-S100 WeakPolarHBondContact O-CB 3.39Å; A96-S100 PolarHBondContact O-N 3.43Å; A96-S100 PolarHBondContact O-OG 3.33Å; T97-S100 PolarHBondContact O-N 3.35Å; C98-S100 VanDerWaalsContact C-N 3.31Å; C98-S100 PolarHBondContact O-N 2.94Å; S100-S103 WeakPolarHBondContact O-CB 3.23Å; S100-S103 PolarHBondContact O-N 3.41Å; S100-L104 WeakPolarHBondContact O-CG 3.27Å; S100-L104 PolarHBondContact O-N 3.14Å
101V96.4Very high95.5Very high3 Ų316.3 Ų16.32%0.0188%0.077CC..Hα-helixtrans-66.6-43.4173.1173.90000111.3L49 T97 C98 S103 L104 S105 V250 Y253L49-V101 HydrophobicContact CD1-CG2 4.42Å; L49-V101 HydrophobicContact CD2-CG2 4.43Å; T97-V101 WeakPolarHBondContact O-CG2 3.36Å; T97-V101 PolarHBondContact O-N 2.84Å; C98-V101 PolarHBondContact O-N 3.46Å; V101-S103 VanDerWaalsContact C-N 3.3Å; V101-S103 PolarHBondContact O-N 3.15Å; V101-L104 PolarHBondContact O-N 3.13Å; V101-S105 PolarHBondContact O-N 3.13Å; V101-S105 PolarHBondContact O-OG 3.33Å; V101-V250 HydrophobicContact CG1-CB 4.11Å; V101-V250 HydrophobicContact CG1-CG1 4.18Å; V101-V250 HydrophobicContact CG1-CG2 3.71Å; V101-Y253 HydrophobicContact CG2-CD2 3.56Å; V101-Y253 HydrophobicContact CG2-CE2 4.19Å; V101-Y253 HydrophobicContact CG2-CG 4.2Å
102T96.4Very high95.4Very high24 Ų2417.4 Ų17.415%0.1478%0.084CC..Hα-helixtrans-60.1-40.6171.6-470000111.4C98 F99 S105 Y106 S183 M186C98-T102 PolarHBondContact O-N 2.89Å; C98-T102 PolarHBondContact O-OG1 2.9Å; F99-T102 PolarHBondContact O-N 3.31Å; T102-S105 WeakPolarHBondContact O-CB 3.49Å; T102-S105 PolarHBondContact O-N 3.2Å; T102-Y106 WeakPolarHBondContact O-CB 3.45Å; T102-Y106 PolarHBondContact O-N 2.99Å; T102-S183 VanDerWaalsContact OG1-C 3.31Å; T102-S183 WeakPolarHBondContact OG1-CA 3.33Å; T102-S183 WeakPolarHBondContact OG1-CB 3.47Å; T102-S183 PolarHBondContact OG1-O 3.34Å; T102-M186 HydrophobicContact CG2-CB 3.81Å
103S96.7Very high95.2Very high14 Ų1419 Ų1910%0.09810%0.096CC..Hα-helixtrans-64.6-42.7177.6-171.10000112.4F99 S100 V101 S105 Y106 H107 T130F99-S103 VanDerWaalsContact O-CB 3.24Å; F99-S103 WeakPolarHBondContact O-CB 3.25Å; F99-S103 PolarHBondContact O-N 3.12Å; S100-S103 WeakPolarHBondContact O-CB 3.23Å; S100-S103 PolarHBondContact O-N 3.41Å; V101-S103 VanDerWaalsContact C-N 3.3Å; V101-S103 PolarHBondContact O-N 3.15Å; S103-S105 VanDerWaalsContact C-N 3.32Å; S103-S105 PolarHBondContact O-N 3.42Å; S103-Y106 PolarHBondContact O-N 3.31Å; S103-H107 WeakPolarHBondContact O-CB 3.35Å; S103-H107 PolarHBondContact O-N 3.47Å; S103-T130 WeakPolarHBondContact OG-CG2 3.45Å
104L95.9Very high94.9Very high2 Ų226.4 Ų26.41%0.0112%0.123CC..Hα-helixtrans-58.7-43.6172.2-75.2167.2000111.7L42 L45 L46 L49 S100 V101 R108L42-L104 HydrophobicContact CD1-CD2 3.71Å; L45-L104 HydrophobicContact CB-CD2 3.49Å; L45-L104 VanDerWaalsContact CB-CD2 3.49Å; L45-L104 HydrophobicContact CB-CG 4.22Å; L45-L104 HydrophobicContact CD1-CD2 4.22Å; L45-L104 HydrophobicContact CG-CD2 4.5Å; L46-L104 HydrophobicContact CD2-CD1 4.07Å; L46-L104 HydrophobicContact CD2-CD2 4.06Å; L46-L104 HydrophobicContact CG-CD2 4.09Å; L49-L104 HydrophobicContact CD2-CD1 3.81Å; S100-L104 WeakPolarHBondContact O-CG 3.27Å; S100-L104 PolarHBondContact O-N 3.14Å; V101-L104 PolarHBondContact O-N 3.13Å; L104-R108 WeakPolarHBondContact O-CB 3.35Å; L104-R108 PolarHBondContact O-N 3.21Å
105S96.9Very high94.6Very high0 Ų029.5 Ų29.50%014%0.143CC..Hα-helixtrans-60.8-52.8176.5-51.40000111.7V101 T102 S103 H107 R108 M109 G187 T191 V250V101-S105 PolarHBondContact O-N 3.13Å; V101-S105 PolarHBondContact O-OG 3.33Å; T102-S105 WeakPolarHBondContact O-CB 3.49Å; T102-S105 PolarHBondContact O-N 3.2Å; S103-S105 VanDerWaalsContact C-N 3.32Å; S103-S105 PolarHBondContact O-N 3.42Å; S105-H107 PolarHBondContact O-N 3.43Å; S105-R108 PolarHBondContact O-N 2.88Å; S105-M109 WeakPolarHBondContact O-CB 3.29Å; S105-M109 PolarHBondContact O-N 3.04Å; S105-G187 WeakPolarHBondContact CB-O 3.38Å; S105-G187 PolarHBondContact OG-O 3.27Å; S105-T191 WeakPolarHBondContact CB-OG1 3.47Å; S105-T191 PolarHBondContact OG-OG1 2.97Å; S105-T191 VanDerWaalsContact OG-OG1 3.13Å; S105-V250 WeakPolarHBondContact OG-CG2 3.49Å
106Y96.1Very high94.2Very high115 Ų11534.3 Ų34.345%0.45117%0.173SC..Hα-helixtrans-60.5-45.8178.6174.3-95.8000111.7T102 S103 R108 M109 W110T102-Y106 WeakPolarHBondContact O-CB 3.45Å; T102-Y106 PolarHBondContact O-N 2.99Å; S103-Y106 PolarHBondContact O-N 3.31Å; Y106-R108 VanDerWaalsContact C-N 3.33Å; Y106-R108 PolarHBondContact O-N 3.24Å; Y106-M109 HydrophobicContact CD2-CE 3.64Å; Y106-M109 HydrophobicContact CE2-CE 3.83Å; Y106-M109 WeakPolarHBondContact O-CB 3.45Å; Y106-M109 PolarHBondContact O-N 3.4Å; Y106-W110 HydrophobicContact CE1-CE3 4.5Å; Y106-W110 WeakPolarHBondContact O-CB 3.28Å; Y106-W110 PolarHBondContact O-N 3.13Å
107H95Very high93.9Very high9 Ų938.2 Ų38.24%0.04219%0.193CC..Hα-helixtrans-60.3-42.3178.4180-81.4000111.7P41 L45 S103 S105 M111 Y118P41-H107 WeakPolarHBondContact CB-NE2 3.46Å; L45-H107 HydrophobicContact CD1-CB 3.95Å; S103-H107 WeakPolarHBondContact O-CB 3.35Å; S103-H107 PolarHBondContact O-N 3.47Å; S105-H107 PolarHBondContact O-N 3.43Å; H107-M111 PolarHBondContact O-N 3.43Å; H107-Y118 AromaticContact CE1-CE2 3.84Å; H107-Y118 AromaticContact CE1-CZ 3.9Å; H107-Y118 PolarHBondContact CE1-OH 2.78Å; H107-Y118 VanDerWaalsContact CE1-OH 3.29Å; H107-Y118 AromaticContact NE2-CE2 3.44Å; H107-Y118 WeakPolarHBondContact NE2-CE2 3.41Å; H107-Y118 AromaticContact NE2-CZ 3.73Å; H107-Y118 PolarHBondContact NE2-OH 3.44Å; H107-Y118 VanDerWaalsContact NE2-OH 3.17Å
108R95.1Very high93.5Very high2 Ų239.3 Ų39.31%0.00820%0.197CC..Hα-helixtrans-69.1-41.8176.8-170.265.5-168.815611.8111.8L104 S105 Y106 M111 V112 A194 E234 S239 T243 V246L104-R108 WeakPolarHBondContact O-CB 3.35Å; L104-R108 PolarHBondContact O-N 3.21Å; S105-R108 PolarHBondContact O-N 2.88Å; Y106-R108 VanDerWaalsContact C-N 3.33Å; Y106-R108 PolarHBondContact O-N 3.24Å; R108-M111 PolarHBondContact NH1-SD 2.95Å; R108-V112 WeakPolarHBondContact O-CB 3.45Å; R108-V112 VanDerWaalsContact O-CG2 3.25Å; R108-V112 WeakPolarHBondContact O-CG2 3.28Å; R108-V112 PolarHBondContact O-N 3.01Å; R108-V112 VanDerWaalsContact O-N 3.12Å; R108-A194 HydrophobicContact CG-CB 4.36Å; R108-E234 IonicContact NH1-OE2 3.5Å; R108-E234 PolarHBondContact NH1-OE2 3.39Å; R108-E234 VanDerWaalsContact NH1-OE2 3.13Å; R108-S239 PolarHBondContact NH2-O 2.92Å; R108-S239 PolarHBondContact NH2-OG 2.93Å; R108-T243 HydrophobicContact CG-CG2 4.45Å; R108-T243 PolarHBondContact NE-OG1 3Å; R108-T243 PolarHBondContact NH2-OG1 3.11Å; R108-V246 HydrophobicContact CB-CG1 4.18Å; R108-V246 HydrophobicContact CG-CG2 4.5Å
109M95.2Very high93.1Very high33 Ų3347.8 Ų47.816%0.16323%0.228CC..Hα-helixtrans-57.1-50.5173.5-177.6-165.869.600111.6S105 Y106 M111 V112 C113 C190 I193 A194S105-M109 WeakPolarHBondContact O-CB 3.29Å; S105-M109 PolarHBondContact O-N 3.04Å; Y106-M109 HydrophobicContact CD2-CE 3.64Å; Y106-M109 HydrophobicContact CE2-CE 3.83Å; Y106-M109 WeakPolarHBondContact O-CB 3.45Å; Y106-M109 PolarHBondContact O-N 3.4Å; M109-M111 PolarHBondContact O-N 3.08Å; M109-V112 PolarHBondContact O-N 3.41Å; M109-V112 VanDerWaalsContact O-N 3.16Å; M109-C113 WeakPolarHBondContact O-CB 3.36Å; M109-C113 PolarHBondContact O-N 3.5Å; M109-C113 PolarHBondContact O-SG 3.34Å; M109-C113 VanDerWaalsContact O-SG 3.35Å; M109-C190 HydrophobicContact CB-CB 4.21Å; M109-C190 HydrophobicContact SD-CB 3.96Å; M109-I193 HydrophobicContact CG-CB 4.16Å; M109-I193 HydrophobicContact CG-CG2 3.84Å; M109-I193 HydrophobicContact SD-CB 4.23Å; M109-I193 HydrophobicContact SD-CD1 3.97Å; M109-I193 HydrophobicContact SD-CG2 4.17Å; M109-A194 HydrophobicContact CB-CB 4.22Å
110W94.3Very high92.6Very high31 Ų3152.7 Ų52.712%0.11726%0.255CS..Hα-helixtrans-60.1-45.2-178.4178.530.7000112.5Y106 V112 W114 N117 Y118 S121 A123Y106-W110 HydrophobicContact CE1-CE3 4.5Å; Y106-W110 WeakPolarHBondContact O-CB 3.28Å; Y106-W110 PolarHBondContact O-N 3.13Å; W110-V112 VanDerWaalsContact C-N 3.31Å; W110-V112 PolarHBondContact O-N 2.92Å; W110-W114 AromaticContact CD1-CE3 3.72Å; W110-W114 PolarHBondContact O-N 2.85Å; W110-N117 PolarHBondContact NE1-ND2 2.8Å; W110-Y118 AromaticContact CD2-CD2 3.82Å; W110-Y118 HydrophobicContact CD2-CD2 3.82Å; W110-Y118 AromaticContact CE3-CD2 3.71Å; W110-Y118 HydrophobicContact CE3-CD2 3.71Å; W110-Y118 HydrophobicContact CE3-CE2 4.14Å; W110-Y118 HydrophobicContact CG-CD2 4.35Å; W110-Y118 HydrophobicContact CH2-CD2 4.41Å; W110-Y118 HydrophobicContact CZ2-CD2 4.5Å; W110-Y118 HydrophobicContact CZ3-CD2 4.02Å; W110-Y118 HydrophobicContact CZ3-CE2 4.3Å; W110-S121 WeakPolarHBondContact CH2-OG 3.37Å; W110-S121 VanDerWaalsContact CZ2-OG 3.27Å; W110-S121 WeakPolarHBondContact CZ2-OG 3.46Å; W110-A123 HydrophobicContact CH2-CB 4.33Å; W110-A123 HydrophobicContact CZ3-CB 4.2Å
111M91.1Very high92.1Very high28 Ų2854 Ų5414%0.13826%0.264CS..Hα-helixtrans-60.7-38.3175.7-177.8-169.2-71.300112.8H107 R108 M109 P115 Y118H107-M111 PolarHBondContact O-N 3.43Å; R108-M111 PolarHBondContact NH1-SD 2.95Å; M109-M111 PolarHBondContact O-N 3.08Å; M111-P115 WeakPolarHBondContact O-CA 3.49Å; M111-Y118 HydrophobicContact CB-CD1 4.27Å; M111-Y118 HydrophobicContact CB-CD2 4.04Å; M111-Y118 HydrophobicContact CB-CE1 4.43Å; M111-Y118 HydrophobicContact CB-CE2 4.18Å; M111-Y118 HydrophobicContact CB-CG 4.1Å; M111-Y118 HydrophobicContact CE-CD1 4.49Å; M111-Y118 HydrophobicContact CE-CE1 3.62Å; M111-Y118 HydrophobicContact CE-CE2 4.19Å; M111-Y118 VanDerWaalsContact CE-CZ 3.44Å; M111-Y118 VanDerWaalsContact CE-OH 3.29Å; M111-Y118 WeakPolarHBondContact CE-OH 3.35Å; M111-Y118 HydrophobicContact CG-CD1 3.96Å; M111-Y118 HydrophobicContact CG-CE1 4.02Å; M111-Y118 HydrophobicContact CG-CG 4.28Å
112V90.7Very high91.7Very high30 Ų3060.1 Ų60.118%0.18230%0.297CS..Hα-helixtrans-78.5-46.6-177.5169.30000111.7R108 M109 W110 Q197 T198R108-V112 WeakPolarHBondContact O-CB 3.45Å; R108-V112 VanDerWaalsContact O-CG2 3.25Å; R108-V112 WeakPolarHBondContact O-CG2 3.28Å; R108-V112 PolarHBondContact O-N 3.01Å; R108-V112 VanDerWaalsContact O-N 3.12Å; M109-V112 PolarHBondContact O-N 3.41Å; M109-V112 VanDerWaalsContact O-N 3.16Å; W110-V112 VanDerWaalsContact C-N 3.31Å; W110-V112 PolarHBondContact O-N 2.92Å; V112-Q197 HydrophobicContact CG1-CB 3.55Å; V112-T198 HydrophobicContact CB-CG2 4.3Å; V112-T198 HydrophobicContact CG1-CG2 3.64Å; V112-T198 HydrophobicContact CG2-CG2 3.57Å
113C91.6Very high91.4Very high41 Ų4159.4 Ų59.428%0.27729%0.293SS..Hα-helixtrans-72.1-43-177.4-65.30000112M109 P115M109-C113 WeakPolarHBondContact O-CB 3.36Å; M109-C113 PolarHBondContact O-N 3.5Å; M109-C113 PolarHBondContact O-SG 3.34Å; M109-C113 VanDerWaalsContact O-SG 3.35Å; C113-P115 VanDerWaalsContact C-CD 3.47Å; C113-P115 WeakPolarHBondContact O-CD 3.46Å
114W90.3Very high91Very high157 Ų15763.2 Ų63.260%0.59531%0.308SS*.  trans-128.163.4-172.9-56.2-32.5000112.2W110 V116 N117 Y118W110-W114 AromaticContact CD1-CE3 3.72Å; W110-W114 PolarHBondContact O-N 2.85Å; W114-V116 VanDerWaalsContact C-N 3.27Å; W114-V116 PolarHBondContact O-N 3.32Å; W114-N117 HydrophobicContact CB-CB 4.02Å; W114-N117 PolarHBondContact O-N 2.86Å; W114-Y118 WeakPolarHBondContact O-CB 3.5Å; W114-Y118 PolarHBondContact O-N 3.47Å
115P87.9Confident90.9Very high69 Ų6969.7 Ų69.745%0.44834%0.336SS..Hα-helixtrans-61.8-30.2-172.724.4-35.1000114M111 C113 R119M111-P115 WeakPolarHBondContact O-CA 3.49Å; C113-P115 VanDerWaalsContact C-CD 3.47Å; C113-P115 WeakPolarHBondContact O-CD 3.46Å; P115-R119 WeakPolarHBondContact O-CB 3.4Å; P115-R119 WeakPolarHBondContact O-CG 3.23Å; P115-R119 PolarHBondContact O-N 2.8Å; P115-R119 VanDerWaalsContact O-N 3.13Å
116V87.8Confident90.7Very high103 Ų10374.9 Ų74.962%0.62436%0.36SS*.Hα-helixtrans-71.4-52.3177.2-178.50000110.8W114 Y118 R119 L120W114-V116 VanDerWaalsContact C-N 3.27Å; W114-V116 PolarHBondContact O-N 3.32Å; V116-Y118 VanDerWaalsContact C-N 3.32Å; V116-Y118 PolarHBondContact O-N 3.39Å; V116-R119 PolarHBondContact O-N 2.95Å; V116-R119 VanDerWaalsContact O-N 3.12Å; V116-L120 HydrophobicContact CG1-CD1 4.05Å; V116-L120 PolarHBondContact O-N 3.41Å
117N89.3Confident90.5Very high81 Ų8169.7 Ų69.743%0.43334%0.341SS..Hα-helixtrans-57-46.7175.8-178.323.2000110.9W110 W114 R119 L120 S121W110-N117 PolarHBondContact NE1-ND2 2.8Å; W114-N117 HydrophobicContact CB-CB 4.02Å; W114-N117 PolarHBondContact O-N 2.86Å; N117-R119 VanDerWaalsContact C-N 3.3Å; N117-R119 PolarHBondContact O-N 2.94Å; N117-L120 PolarHBondContact O-N 3.43Å; N117-S121 VanDerWaalsContact O-CB 3.29Å; N117-S121 WeakPolarHBondContact O-CB 3.48Å; N117-S121 PolarHBondContact O-N 2.99Å
118Y88.5Confident90.5Very high27 Ų2772.2 Ų72.211%0.10636%0.357CS..Hα-helixtrans-56.7-40.1176.3177.4-90.2000112.8H107 W110 M111 W114 V116 S121 A123H107-Y118 AromaticContact CE1-CE2 3.84Å; H107-Y118 AromaticContact CE1-CZ 3.9Å; H107-Y118 PolarHBondContact CE1-OH 2.78Å; H107-Y118 VanDerWaalsContact CE1-OH 3.29Å; H107-Y118 AromaticContact NE2-CE2 3.44Å; H107-Y118 WeakPolarHBondContact NE2-CE2 3.41Å; H107-Y118 AromaticContact NE2-CZ 3.73Å; H107-Y118 PolarHBondContact NE2-OH 3.44Å; H107-Y118 VanDerWaalsContact NE2-OH 3.17Å; W110-Y118 AromaticContact CD2-CD2 3.82Å; W110-Y118 HydrophobicContact CD2-CD2 3.82Å; W110-Y118 AromaticContact CE3-CD2 3.71Å; W110-Y118 HydrophobicContact CE3-CD2 3.71Å; W110-Y118 HydrophobicContact CE3-CE2 4.14Å; W110-Y118 HydrophobicContact CG-CD2 4.35Å; W110-Y118 HydrophobicContact CH2-CD2 4.41Å; W110-Y118 HydrophobicContact CZ2-CD2 4.5Å; W110-Y118 HydrophobicContact CZ3-CD2 4.02Å; W110-Y118 HydrophobicContact CZ3-CE2 4.3Å; M111-Y118 HydrophobicContact CB-CD1 4.27Å; M111-Y118 HydrophobicContact CB-CD2 4.04Å; M111-Y118 HydrophobicContact CB-CE1 4.43Å; M111-Y118 HydrophobicContact CB-CE2 4.18Å; M111-Y118 HydrophobicContact CB-CG 4.1Å; M111-Y118 HydrophobicContact CE-CD1 4.49Å; M111-Y118 HydrophobicContact CE-CE1 3.62Å; M111-Y118 HydrophobicContact CE-CE2 4.19Å; M111-Y118 VanDerWaalsContact CE-CZ 3.44Å; M111-Y118 VanDerWaalsContact CE-OH 3.29Å; M111-Y118 WeakPolarHBondContact CE-OH 3.35Å; M111-Y118 HydrophobicContact CG-CD1 3.96Å; M111-Y118 HydrophobicContact CG-CE1 4.02Å; M111-Y118 HydrophobicContact CG-CG 4.28Å; W114-Y118 WeakPolarHBondContact O-CB 3.5Å; W114-Y118 PolarHBondContact O-N 3.47Å; V116-Y118 VanDerWaalsContact C-N 3.32Å; V116-Y118 PolarHBondContact O-N 3.39Å; Y118-S121 PolarHBondContact O-OG 3.41Å; Y118-A123 HydrophobicContact CD2-CB 4.25Å; Y118-A123 HydrophobicContact CE2-CB 3.69Å
119R85.9Confident90.5Very high188 Ų18876.6 Ų76.671%0.70938%0.377SS*.Hα-helixtrans-71.8-34.9177.5-80.2-176.965.6-142.1-4.3114.4P115 V116 N117P115-R119 WeakPolarHBondContact O-CB 3.4Å; P115-R119 WeakPolarHBondContact O-CG 3.23Å; P115-R119 PolarHBondContact O-N 2.8Å; P115-R119 VanDerWaalsContact O-N 3.13Å; V116-R119 PolarHBondContact O-N 2.95Å; V116-R119 VanDerWaalsContact O-N 3.12Å; N117-R119 VanDerWaalsContact C-N 3.3Å; N117-R119 PolarHBondContact O-N 2.94Å
120L86.6Confident90.5Very high144 Ų14477.3 Ų77.375%0.75438%0.384SS*.Hα-helixtrans-78.7-27.3176.8-66.5172.7000111.7V116 N117V116-L120 HydrophobicContact CG1-CD1 4.05Å; V116-L120 PolarHBondContact O-N 3.41Å; N117-L120 PolarHBondContact O-N 3.43Å
121S86Confident90.6Very high32 Ų3276.2 Ų76.222%0.22438%0.381CS..THydrogen-bonded Turntrans-69147175.380.80000112.2W110 N117 Y118 A123W110-S121 WeakPolarHBondContact CH2-OG 3.37Å; W110-S121 VanDerWaalsContact CZ2-OG 3.27Å; W110-S121 WeakPolarHBondContact CZ2-OG 3.46Å; N117-S121 VanDerWaalsContact O-CB 3.29Å; N117-S121 WeakPolarHBondContact O-CB 3.48Å; N117-S121 PolarHBondContact O-N 2.99Å; Y118-S121 PolarHBondContact O-OG 3.41Å; S121-A123 PolarHBondContact O-N 3.38Å
122N88.9Confident90.8Very high133 Ų13379.6 Ų79.671%0.71140%0.397SS*.THydrogen-bonded Turntrans-7757.3168.8-82.5-58.1000111.6K124 K125 Q126N122-K124 PolarHBondContact O-N 2.92Å; N122-K125 HydrophobicContact CB-CB 4.26Å; N122-K125 PolarHBondContact O-N 3.48Å; N122-Q126 PolarHBondContact O-N 3.29Å
123A88.8Confident91.1Very high8 Ų879.8 Ų79.87%0.06641%0.405CS..Hα-helixtrans-53.2-26.9-174.700000114.1P41 W110 Y118 S121 A127P41-A123 HydrophobicContact CG-CB 3.93Å; W110-A123 HydrophobicContact CH2-CB 4.33Å; W110-A123 HydrophobicContact CZ3-CB 4.2Å; Y118-A123 HydrophobicContact CD2-CB 4.25Å; Y118-A123 HydrophobicContact CE2-CB 3.69Å; S121-A123 PolarHBondContact O-N 3.38Å; A123-A127 WeakPolarHBondContact O-CB 3.22Å; A123-A127 PolarHBondContact O-N 3Å
124K90.2Very high91.4Very high95 Ų9578.6 Ų78.641%0.41340%0.396SS..Hα-helixtrans-64.2-54.3171.7-67.3-171.3178.7-143.20112.4W39 P41 N122 Q126 A127 V128W39-K124 WeakPolarHBondContact O-CE 3.34Å; W39-K124 PolarHBondContact O-NZ 3.08Å; P41-K124 HydrophobicContact CG-CB 4.49Å; P41-K124 HydrophobicContact CG-CG 3.9Å; N122-K124 PolarHBondContact O-N 2.92Å; K124-Q126 VanDerWaalsContact C-N 3.26Å; K124-Q126 PolarHBondContact O-N 3.29Å; K124-A127 PolarHBondContact O-N 3.29Å; K124-V128 WeakPolarHBondContact O-CG2 3.1Å; K124-V128 PolarHBondContact O-N 3.28Å; K124-V128 VanDerWaalsContact O-N 3.08Å
125K92.1Very high91.7Very high137 Ų13774.2 Ų74.260%0.59638%0.379SS*.Hα-helixtrans-60.6-41.5177.7-177.1173.5178.8179.10109.8N122 V128 H129N122-K125 HydrophobicContact CB-CB 4.26Å; N122-K125 PolarHBondContact O-N 3.48Å; K125-V128 PolarHBondContact O-N 3.13Å; K125-H129 WeakPolarHBondContact CE-NE2 3.44Å; K125-H129 PolarHBondContact O-CD2 3.09Å; K125-H129 PolarHBondContact O-N 3.28Å
126Q92.6Very high92.1Very high109 Ų10976.3 Ų76.351%0.50939%0.385SS..Hα-helixtrans-59.3-48175.4-162.966.78.600112.1N122 K124 V128 H129 T130N122-Q126 PolarHBondContact O-N 3.29Å; K124-Q126 VanDerWaalsContact C-N 3.26Å; K124-Q126 PolarHBondContact O-N 3.29Å; Q126-V128 VanDerWaalsContact C-N 3.35Å; Q126-V128 PolarHBondContact O-N 3.46Å; Q126-H129 PolarHBondContact O-N 3.48Å; Q126-T130 WeakPolarHBondContact O-CB 3.42Å; Q126-T130 PolarHBondContact O-N 3Å; Q126-T130 PolarHBondContact O-OG1 3.25Å
127A93.4Very high92.5Very high6 Ų674.8 Ų74.85%0.0538%0.375CS..Hα-helixtrans-62.8-38.1178.600000113P41 F44 L45 A123 K124 T130 V131P41-A127 HydrophobicContact CB-CB 3.78Å; F44-A127 HydrophobicContact CD1-CB 4.4Å; L45-A127 HydrophobicContact CG-CB 4.5Å; A123-A127 WeakPolarHBondContact O-CB 3.22Å; A123-A127 PolarHBondContact O-N 3Å; K124-A127 PolarHBondContact O-N 3.29Å; A127-T130 PolarHBondContact O-N 2.97Å; A127-V131 WeakPolarHBondContact O-CG2 3.29Å; A127-V131 PolarHBondContact O-N 2.7Å
128V94.5Very high92.8Very high63 Ų6370.9 Ų70.938%0.38236%0.355SS..Hα-helixtrans-62.4-48.9173.8175.60000110.8F44 K124 K125 Q126 T130 V131 M132F44-V128 HydrophobicContact CD1-CG2 4.46Å; F44-V128 HydrophobicContact CE1-CB 4.48Å; F44-V128 HydrophobicContact CE1-CG2 3.9Å; F44-V128 HydrophobicContact CZ-CG2 4.03Å; K124-V128 WeakPolarHBondContact O-CG2 3.1Å; K124-V128 PolarHBondContact O-N 3.28Å; K124-V128 VanDerWaalsContact O-N 3.08Å; K125-V128 PolarHBondContact O-N 3.13Å; Q126-V128 VanDerWaalsContact C-N 3.35Å; Q126-V128 PolarHBondContact O-N 3.46Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.31Å; V128-V131 PolarHBondContact O-N 2.78Å; V128-M132 HydrophobicContact CG1-CE 4.14Å; V128-M132 HydrophobicContact CG1-SD 4.4Å; V128-M132 WeakPolarHBondContact O-CG 3.45Å; V128-M132 PolarHBondContact O-N 3.3Å
129H94.7Very high93.1Very high93 Ų9375.1 Ų75.143%0.43137%0.374SS..Hα-helixtrans-61.6-38174.7-70.8-63.8000112.9K125 Q126 M132 G133K125-H129 WeakPolarHBondContact CE-NE2 3.44Å; K125-H129 PolarHBondContact O-CD2 3.09Å; K125-H129 PolarHBondContact O-N 3.28Å; Q126-H129 PolarHBondContact O-N 3.48Å; H129-M132 WeakPolarHBondContact ND1-CE 3.34Å; H129-M132 PolarHBondContact O-N 3.35Å; H129-G133 PolarHBondContact O-N 2.84Å
130T94.9Very high93.5Very high48 Ų4870.6 Ų70.629%0.29436%0.362SS..Hα-helixtrans-63.4-45.1176-58.30000111.4S103 Q126 A127 V128 G133 I134S103-T130 WeakPolarHBondContact OG-CG2 3.45Å; Q126-T130 WeakPolarHBondContact O-CB 3.42Å; Q126-T130 PolarHBondContact O-N 3Å; Q126-T130 PolarHBondContact O-OG1 3.25Å; A127-T130 PolarHBondContact O-N 2.97Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 3.31Å; T130-G133 PolarHBondContact O-N 2.75Å; T130-I134 HydrophobicContact CG2-CD1 3.86Å; T130-I134 HydrophobicContact CG2-CG1 4.45Å; T130-I134 WeakPolarHBondContact O-CB 3.33Å; T130-I134 WeakPolarHBondContact O-CG1 3.48Å; T130-I134 PolarHBondContact O-N 3.29Å
131V96.4Very high93.8Very high9 Ų965.6 Ų65.66%0.05534%0.337CS..Hα-helixtrans-62-49175.7168.30000111.1F44 L45 M48 A127 V128 G133 I134 W135F44-V131 HydrophobicContact CD1-CG2 4.33Å; F44-V131 HydrophobicContact CE1-CB 4.08Å; F44-V131 HydrophobicContact CE1-CG2 3.69Å; F44-V131 HydrophobicContact CZ-CG2 4.5Å; L45-V131 HydrophobicContact CD2-CG2 3.6Å; M48-V131 HydrophobicContact CB-CG1 4.37Å; M48-V131 HydrophobicContact CB-CG2 4.36Å; M48-V131 HydrophobicContact CE-CG1 3.78Å; M48-V131 HydrophobicContact CG-CG1 3.92Å; M48-V131 HydrophobicContact CG-CG2 4.12Å; M48-V131 HydrophobicContact SD-CG1 4.29Å; A127-V131 WeakPolarHBondContact O-CG2 3.29Å; A127-V131 PolarHBondContact O-N 2.7Å; V128-V131 PolarHBondContact O-N 2.78Å; V131-G133 VanDerWaalsContact C-N 3.31Å; V131-G133 PolarHBondContact O-N 3.03Å; V131-I134 PolarHBondContact O-N 2.94Å; V131-W135 VanDerWaalsContact O-CD1 3.32Å; V131-W135 PolarHBondContact O-N 3.2Å
132M96.1Very high94.1Very high98 Ų9864.1 Ų64.148%0.48333%0.326SS..Hα-helixtrans-58.2-44.2177.3-67.1-172.6-56.800111.6V128 H129 W135 M136V128-M132 HydrophobicContact CG1-CE 4.14Å; V128-M132 HydrophobicContact CG1-SD 4.4Å; V128-M132 WeakPolarHBondContact O-CG 3.45Å; V128-M132 PolarHBondContact O-N 3.3Å; H129-M132 WeakPolarHBondContact ND1-CE 3.34Å; H129-M132 PolarHBondContact O-N 3.35Å; M132-W135 PolarHBondContact O-N 3.03Å; M132-M136 WeakPolarHBondContact O-CB 3.23Å; M132-M136 VanDerWaalsContact O-CG 3.26Å; M132-M136 WeakPolarHBondContact O-CG 3.11Å; M132-M136 PolarHBondContact O-N 2.91Å
133G96.7Very high94.1Very high34 Ų3458.9 Ų58.935%0.35130%0.301SS..Hα-helixtrans-61.4-4317600000113.2H129 T130 V131 M136 V137H129-G133 PolarHBondContact O-N 2.84Å; T130-G133 PolarHBondContact O-N 2.75Å; V131-G133 VanDerWaalsContact C-N 3.31Å; V131-G133 PolarHBondContact O-N 3.03Å; G133-M136 PolarHBondContact O-N 3.46Å; G133-V137 WeakPolarHBondContact O-CB 3.34Å; G133-V137 VanDerWaalsContact O-CG2 3.29Å; G133-V137 WeakPolarHBondContact O-CG2 3.37Å; G133-V137 PolarHBondContact O-N 2.84Å
134I97.2Very high94Very high16 Ų1660.7 Ų60.78%0.08231%0.31CS..Hα-helixtrans-58.8-49.5176.2-74.2166.7000110.8A96 F99 T130 V131 S138A96-I134 HydrophobicContact CB-CG2 4.27Å; F99-I134 HydrophobicContact CB-CB 4.45Å; F99-I134 HydrophobicContact CB-CD1 4.22Å; F99-I134 HydrophobicContact CB-CG1 3.91Å; F99-I134 HydrophobicContact CB-CG2 3.83Å; F99-I134 HydrophobicContact CD2-CG2 4.47Å; T130-I134 HydrophobicContact CG2-CD1 3.86Å; T130-I134 HydrophobicContact CG2-CG1 4.45Å; T130-I134 WeakPolarHBondContact O-CB 3.33Å; T130-I134 WeakPolarHBondContact O-CG1 3.48Å; T130-I134 PolarHBondContact O-N 3.29Å; V131-I134 PolarHBondContact O-N 2.94Å; I134-S138 WeakPolarHBondContact O-CB 3.31Å; I134-S138 PolarHBondContact O-N 3.37Å; I134-S138 PolarHBondContact O-OG 3.22Å
135W96.9Very high93.6Very high65 Ų6556.2 Ų56.225%0.24629%0.29CS..Hα-helixtrans-64.9-46.3179.9-82.487.9000112T52 L55 L93 V131 M132 S138 F139T52-W135 HydrophobicContact CG2-CZ2 4.34Å; T52-W135 WeakPolarHBondContact OG1-CZ2 3.09Å; L55-W135 HydrophobicContact CD2-CH2 3.81Å; L55-W135 HydrophobicContact CD2-CZ3 4.01Å; L93-W135 HydrophobicContact CD2-CH2 3.47Å; L93-W135 VanDerWaalsContact CD2-CH2 3.47Å; L93-W135 HydrophobicContact CD2-CZ2 4.5Å; L93-W135 HydrophobicContact CD2-CZ3 3.65Å; V131-W135 VanDerWaalsContact O-CD1 3.32Å; V131-W135 PolarHBondContact O-N 3.2Å; M132-W135 PolarHBondContact O-N 3.03Å; W135-S138 PolarHBondContact O-N 2.95Å; W135-F139 VanDerWaalsContact O-CB 3.31Å; W135-F139 WeakPolarHBondContact O-CB 3.39Å; W135-F139 PolarHBondContact O-N 2.91Å
136M96.7Very high93.1Very high114 Ų11451.6 Ų51.656%0.56228%0.278SS*.Hα-helixtrans-59.3-50.4178.2-73.7-61.2-62.200112.1M132 G133 F139 I140M132-M136 WeakPolarHBondContact O-CB 3.23Å; M132-M136 VanDerWaalsContact O-CG 3.26Å; M132-M136 WeakPolarHBondContact O-CG 3.11Å; M132-M136 PolarHBondContact O-N 2.91Å; G133-M136 PolarHBondContact O-N 3.46Å; M136-F139 PolarHBondContact O-N 3.13Å; M136-I140 HydrophobicContact CE-CD1 4.21Å; M136-I140 WeakPolarHBondContact O-CB 3.43Å; M136-I140 WeakPolarHBondContact O-CD1 3.35Å; M136-I140 WeakPolarHBondContact O-CG1 3.39Å; M136-I140 PolarHBondContact O-N 3.46Å
137V96Very high92.5Very high70 Ų7052.5 Ų52.542%0.42429%0.29SS..Hα-helixtrans-64.5-43.3179.9171.70000111F99 G133 F139 L141F99-V137 HydrophobicContact CE2-CG1 4.34Å; G133-V137 WeakPolarHBondContact O-CB 3.34Å; G133-V137 VanDerWaalsContact O-CG2 3.29Å; G133-V137 WeakPolarHBondContact O-CG2 3.37Å; G133-V137 PolarHBondContact O-N 2.84Å; V137-F139 PolarHBondContact O-N 3.3Å; V137-L141 HydrophobicContact CG1-CD1 3.55Å; V137-L141 HydrophobicContact CG1-CG 4.36Å; V137-L141 WeakPolarHBondContact O-CB 3.22Å; V137-L141 WeakPolarHBondContact O-CD1 3.45Å; V137-L141 WeakPolarHBondContact O-CG 3.39Å; V137-L141 PolarHBondContact O-N 3.48Å
138S96.8Very high91.6Very high0 Ų053.7 Ų53.70%030%0.303CS..Hα-helixtrans-63.4-42.4179.2-56.50000112.3T92 A96 I134 W135 S142T92-S138 WeakPolarHBondContact O-CB 3.27Å; A96-S138 WeakPolarHBondContact CA-OG 3.34Å; A96-S138 PolarHBondContact N-OG 3.14Å; I134-S138 WeakPolarHBondContact O-CB 3.31Å; I134-S138 PolarHBondContact O-N 3.37Å; I134-S138 PolarHBondContact O-OG 3.22Å; W135-S138 PolarHBondContact O-N 2.95Å; S138-S142 VanDerWaalsContact O-CB 3.25Å; S138-S142 WeakPolarHBondContact O-CB 3.46Å; S138-S142 PolarHBondContact O-N 2.87Å; S138-S142 VanDerWaalsContact O-N 3.1Å; S138-S142 PolarHBondContact O-OG 3.5Å
139F94.4Very high90.9Very high116 Ų11657.2 Ų57.251%0.50931%0.31SS..Hα-helixtrans-68.2-49.8178.4176.9-103.3000111.8T92 W135 M136 V137 L141 S142 A143T92-F139 HydrophobicContact CG2-CB 4.1Å; W135-F139 VanDerWaalsContact O-CB 3.31Å; W135-F139 WeakPolarHBondContact O-CB 3.39Å; W135-F139 PolarHBondContact O-N 2.91Å; M136-F139 PolarHBondContact O-N 3.13Å; V137-F139 PolarHBondContact O-N 3.3Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 2.98Å; F139-S142 PolarHBondContact O-N 2.86Å; F139-A143 WeakPolarHBondContact O-CB 3.41Å; F139-A143 PolarHBondContact O-N 3.35Å
140I93.9Very high89.9Confident92 Ų9254.8 Ų54.847%0.47230%0.298SS..Hα-helixtrans-55.5-49.7179.1-71.2165.9000110.1M136 S142 A143 L144M136-I140 HydrophobicContact CE-CD1 4.21Å; M136-I140 WeakPolarHBondContact O-CB 3.43Å; M136-I140 WeakPolarHBondContact O-CD1 3.35Å; M136-I140 WeakPolarHBondContact O-CG1 3.39Å; M136-I140 PolarHBondContact O-N 3.46Å; I140-S142 VanDerWaalsContact C-N 3.34Å; I140-S142 PolarHBondContact O-N 2.93Å; I140-A143 PolarHBondContact O-N 3.43Å; I140-L144 WeakPolarHBondContact O-CG 3.47Å
141L92.4Very high88.6Confident40 Ų4056.8 Ų56.821%0.20931%0.308CS..Hα-helixtrans-66-35.7-178.2-67.6169.3000112.6L95 V137 F139 L144 F172 L179L95-L141 HydrophobicContact CD1-CB 4.2Å; V137-L141 HydrophobicContact CG1-CD1 3.55Å; V137-L141 HydrophobicContact CG1-CG 4.36Å; V137-L141 WeakPolarHBondContact O-CB 3.22Å; V137-L141 WeakPolarHBondContact O-CD1 3.45Å; V137-L141 WeakPolarHBondContact O-CG 3.39Å; V137-L141 PolarHBondContact O-N 3.48Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 2.98Å; L141-L144 HydrophobicContact CD2-CD1 4.04Å; L141-L144 WeakPolarHBondContact O-CD1 3.24Å; L141-F172 WeakPolarHBondContact O-CE2 3.35Å; L141-L179 HydrophobicContact CD1-CD1 3.73Å; L141-L179 HydrophobicContact CD1-CD2 4.47Å
142S91.8Very high87Confident1 Ų161.9 Ų61.91%0.00734%0.339CS..Hα-helixtrans-83.1-13.8-178.9-530000114S88 Y91 T92 S138 F139 I140 P145S88-S142 WeakPolarHBondContact O-CB 3.34Å; S88-S142 PolarHBondContact OG-O 3.27Å; Y91-S142 PolarHBondContact O-OG 3.15Å; T92-S142 VanDerWaalsContact CA-OG 3.29Å; T92-S142 WeakPolarHBondContact CA-OG 3.43Å; T92-S142 PolarHBondContact N-OG 3.31Å; T92-S142 VanDerWaalsContact OG1-CB 3.24Å; T92-S142 WeakPolarHBondContact OG1-CB 3.45Å; S138-S142 VanDerWaalsContact O-CB 3.25Å; S138-S142 WeakPolarHBondContact O-CB 3.46Å; S138-S142 PolarHBondContact O-N 2.87Å; S138-S142 VanDerWaalsContact O-N 3.1Å; S138-S142 PolarHBondContact O-OG 3.5Å; F139-S142 PolarHBondContact O-N 2.86Å; I140-S142 VanDerWaalsContact C-N 3.34Å; I140-S142 PolarHBondContact O-N 2.93Å; S142-P145 WeakPolarHBondContact O-CD 3.39Å
143A89.2Confident85.1Confident22 Ų2262 Ų6218%0.18235%0.349CS..Hα-helixtrans-80.1-20.4172.100000112.9F139 I140 A146 V147F139-A143 WeakPolarHBondContact O-CB 3.41Å; F139-A143 PolarHBondContact O-N 3.35Å; I140-A143 PolarHBondContact O-N 3.43Å; A143-A146 WeakPolarHBondContact O-CB 3.48Å; A143-A146 PolarHBondContact O-N 3.16Å; A143-V147 PolarHBondContact O-N 2.99Å
144L87.1Confident83.2Confident47 Ų4768 Ų6825%0.24637%0.368CS..G310 helixtrans-54.7-42-176.3-63.4165.9000114.3I140 L141 A146 V147 G148 W149I140-L144 WeakPolarHBondContact O-CG 3.47Å; L141-L144 HydrophobicContact CD2-CD1 4.04Å; L141-L144 WeakPolarHBondContact O-CD1 3.24Å; L144-A146 VanDerWaalsContact C-N 3.27Å; L144-A146 PolarHBondContact O-N 2.98Å; L144-V147 PolarHBondContact O-N 2.77Å; L144-G148 PolarHBondContact O-N 2.93Å; L144-W149 HydrophobicContact CB-CB 4.29Å; L144-W149 HydrophobicContact CB-CE3 3.97Å; L144-W149 HydrophobicContact CD1-CE3 3.71Å; L144-W149 HydrophobicContact CD1-CZ3 3.71Å; L144-W149 HydrophobicContact CD2-CE3 4.19Å; L144-W149 HydrophobicContact CG-CE3 4.15Å; L144-W149 PolarHBondContact O-N 3.29Å
145P83Confident81.3Confident1 Ų177 Ų771%0.00640%0.401CS..G310 helixtrans-61.8-31.6174.2-25.537000113.8S142 G148 H150 I168 F172S142-P145 WeakPolarHBondContact O-CD 3.39Å; P145-G148 PolarHBondContact O-N 2.89Å; P145-H150 PolarHBondContact O-CD2 2.96Å; P145-I168 HydrophobicContact CB-CG2 3.81Å; P145-I168 HydrophobicContact CG-CG2 3.94Å; P145-F172 HydrophobicContact CG-CD1 4Å; P145-F172 HydrophobicContact CG-CD2 3.61Å; P145-F172 HydrophobicContact CG-CE1 3.98Å; P145-F172 HydrophobicContact CG-CE2 3.59Å; P145-F172 HydrophobicContact CG-CG 3.82Å; P145-F172 HydrophobicContact CG-CZ 3.78Å
146A80.6Confident79.5Confident40 Ų4075.2 Ų75.233%0.33140%0.395SS..G310 helixtrans-76.4-23.3178.800000113K84 A143 L144 G148K84-A146 HydrophobicContact CB-CB 4.45Å; K84-A146 HydrophobicContact CG-CB 4.49Å; A143-A146 WeakPolarHBondContact O-CB 3.48Å; A143-A146 PolarHBondContact O-N 3.16Å; L144-A146 VanDerWaalsContact C-N 3.27Å; L144-A146 PolarHBondContact O-N 2.98Å; A146-G148 VanDerWaalsContact C-N 3.27Å
147V81.1Confident77.8Confident127 Ų12770.2 Ų70.277%0.7737%0.37SS*.G310 helixtrans-81.8-7.3173.4-177.50000111.7A143 L144A143-V147 PolarHBondContact O-N 2.99Å; L144-V147 PolarHBondContact O-N 2.77Å
148G74.3Confident75.9Confident32 Ų3269.5 Ų69.533%0.3337%0.366SS..THydrogen-bonded Turntrans103.212.1177.500000114.8L144 P145 A146 H150L144-G148 PolarHBondContact O-N 2.93Å; P145-G148 PolarHBondContact O-N 2.89Å; A146-G148 VanDerWaalsContact C-N 3.27Å; G148-H150 PolarHBondContact O-N 3.32Å
149W78.3Confident74Confident136 Ų13677.3 Ų77.352%0.51540%0.402SS..  trans-79.164164.6-168.36.7000110.4L144L144-W149 HydrophobicContact CB-CB 4.29Å; L144-W149 HydrophobicContact CB-CE3 3.97Å; L144-W149 HydrophobicContact CD1-CE3 3.71Å; L144-W149 HydrophobicContact CD1-CZ3 3.71Å; L144-W149 HydrophobicContact CD2-CE3 4.19Å; L144-W149 HydrophobicContact CG-CE3 4.15Å; L144-W149 PolarHBondContact O-N 3.29Å
150H73.6Confident72.7Confident42 Ų4272.8 Ų72.819%0.19439%0.388CS..SBendtrans-140.1167175.160.221.7000108.7P145 G148 T152 Y157 I168P145-H150 PolarHBondContact O-CD2 2.96Å; G148-H150 PolarHBondContact O-N 3.32Å; H150-T152 PolarHBondContact O-N 3.34Å; H150-Y157 AromaticContact CD2-CE2 3.76Å; H150-Y157 AromaticContact NE2-CE2 3.85Å; H150-I168 CarbonylContact C-O 3.56Å; H150-I168 WeakPolarHBondContact CA-O 3.35Å; H150-I168 HydrophobicContact CB-CG2 4.27Å; H150-I168 WeakPolarHBondContact CB-O 3.46Å
151D68.7Low71.8Confident91 Ų9169 Ų6949%0.48737%0.369SS..  trans-61.4127.7171.7-155.8-49.5000110.2S153 I168D151-S153 VanDerWaalsContact OD1-CB 3.3Å; D151-S153 WeakPolarHBondContact OD1-CB 3.11Å; D151-S153 PolarHBondContact OD1-N 3.42Å; D151-S153 PolarHBondContact OD1-OG 3.03Å; D151-I168 PolarHBondContact N-O 3.27Å; D151-I168 VanDerWaalsContact N-O 3.09Å
152T62.1Low71Confident116 Ų11673.7 Ų73.771%0.71238%0.384SS*.  trans-96.5-2.5-175.151.80000113.2H150H150-T152 PolarHBondContact O-N 3.34Å
153S55.9Low70.4Confident99 Ų9973.9 Ų73.969%0.69239%0.385SS*.SBendtrans-68.9-34.6-178.5570000113.3D151D151-S153 VanDerWaalsContact OD1-CB 3.3Å; D151-S153 WeakPolarHBondContact OD1-CB 3.11Å; D151-S153 PolarHBondContact OD1-N 3.42Å; D151-S153 PolarHBondContact OD1-OG 3.03Å
154E56.5Low70.1Confident160 Ų16073.3 Ų73.375%0.74838%0.379SS*.SBendtrans-115.6147.8168.7-63.5-160.7168.800111F156E154-F156 PolarHBondContact O-N 3.02Å
155R58Low69.6Low207 Ų20771.1 Ų71.178%0.78137%0.368SS*.  trans-75.682.1171.3-68-176.8-174.4150.50.5109.3Y157 T158R155-Y157 PolarHBondContact O-N 3.46Å; R155-T158 HydrophobicContact CB-CG2 3.66Å; R155-T158 WeakPolarHBondContact CB-OG1 3.37Å; R155-T158 HydrophobicContact CG-CG2 4.4Å; R155-T158 PolarHBondContact O-N 3.03Å; R155-T158 PolarHBondContact O-OG1 3.26Å; R155-T158 VanDerWaalsContact O-OG1 3.05Å
156F59Low68.6Low27 Ų2771.5 Ų71.512%0.11837%0.37CS..THydrogen-bonded Turntrans-41.1-31.6-178.3176.2-99.8000115.5E154 R162 E167 I168E154-F156 PolarHBondContact O-N 3.02Å; F156-R162 WeakPolarHBondContact CE2-O 3.27Å; F156-R162 WeakPolarHBondContact CZ-O 3.08Å; F156-E167 HydrophobicContact CD2-CB 4.35Å; F156-E167 WeakPolarHBondContact CD2-O 3.41Å; F156-E167 HydrophobicContact CE2-CB 3.81Å; F156-E167 WeakPolarHBondContact CE2-O 3.37Å; F156-I168 HydrophobicContact CE1-CG1 4.26Å; F156-I168 HydrophobicContact CE2-CG1 3.85Å; F156-I168 HydrophobicContact CZ-CB 4.49Å; F156-I168 HydrophobicContact CZ-CD1 4.46Å; F156-I168 HydrophobicContact CZ-CG1 3.47Å; F156-I168 VanDerWaalsContact CZ-CG1 3.47Å
157Y61.5Low68Low8 Ų872.4 Ų72.43%0.03137%0.368CS..THydrogen-bonded Turntrans-91.8-6.3-178-61.5-71.9000116.2E80 C83 K84 H150 R155E80-Y157 HydrophobicContact CG-CG 4.14Å; C83-Y157 HydrophobicContact CB-CD1 3.83Å; C83-Y157 HydrophobicContact CB-CE1 4.34Å; C83-Y157 VanDerWaalsContact SG-CD1 3.55Å; K84-Y157 HydrophobicContact CB-CE1 4.28Å; K84-Y157 HydrophobicContact CD-CD2 4.39Å; K84-Y157 HydrophobicContact CD-CE2 4.18Å; K84-Y157 HydrophobicContact CG-CD1 3.83Å; K84-Y157 HydrophobicContact CG-CD2 4.12Å; K84-Y157 HydrophobicContact CG-CE1 3.43Å; K84-Y157 VanDerWaalsContact CG-CE1 3.43Å; K84-Y157 HydrophobicContact CG-CE2 3.74Å; K84-Y157 HydrophobicContact CG-CG 4.16Å; H150-Y157 AromaticContact CD2-CE2 3.76Å; H150-Y157 AromaticContact NE2-CE2 3.85Å; R155-Y157 PolarHBondContact O-N 3.46Å
158T55.2Low67.7Low55 Ų5566.4 Ų66.434%0.33733%0.331SS..SBendtrans-90.3-17.4-171.258.40000115.8R155R155-T158 HydrophobicContact CB-CG2 3.66Å; R155-T158 WeakPolarHBondContact CB-OG1 3.37Å; R155-T158 HydrophobicContact CG-CG2 4.4Å; R155-T158 PolarHBondContact O-N 3.03Å; R155-T158 PolarHBondContact O-OG1 3.26Å; R155-T158 VanDerWaalsContact O-OG1 3.05Å
159H57.1Low67.9Low165 Ų16565.4 Ų65.476%0.76432%0.321SS*.SBendtrans-126.855.9-175.2-64.1-50.4000113.4
160G66.6Low68.1Low21 Ų2164.6 Ų64.622%0.21633%0.326CS..  trans82.7137.6176.200000113.3R162G160-R162 PolarHBondContact O-N 3.34Å
161C75Confident68.6Low12 Ų1264.5 Ų64.58%0.08134%0.336CS..  trans-74.198.3-172-163.50000112.9W78 C83W78-C161 HydrophobicContact CB-CB 4.14Å; W78-C161 HydrophobicContact CD2-CB 3.23Å; W78-C161 VanDerWaalsContact CE2-CB 3.45Å; W78-C161 HydrophobicContact CE3-CB 3.58Å; W78-C161 HydrophobicContact CG-CB 3.5Å; W78-C161 HydrophobicContact CH2-CB 4.28Å; W78-C161 HydrophobicContact CZ2-CB 4Å; W78-C161 HydrophobicContact CZ3-CB 4.09Å; C83-C161 WeakPolarHBondContact CA-SG 3.44Å; C83-C161 HydrophobicContact CB-CB 3.66Å; C83-C161 WeakPolarHBondContact CB-SG 3.48Å; C83-C161 WeakPolarHBondContact SG-CA 3.09Å; C83-C161 WeakPolarHBondContact SG-CB 3.4Å; C83-C161 CovalentContact SG-SG 2.03Å; C83-C161 PolarHBondContact SG-SG 3.45Å
162R76.6Confident69.5Low138 Ų13860.7 Ų60.752%0.52132%0.316SS..  trans-96100.6169.9-65.3-175.5-176.3-177.27109.6F156 G160 I164 E167F156-R162 WeakPolarHBondContact CE2-O 3.27Å; F156-R162 WeakPolarHBondContact CZ-O 3.08Å; G160-R162 PolarHBondContact O-N 3.34Å; R162-I164 VanDerWaalsContact C-N 3.33Å; R162-I164 PolarHBondContact O-N 2.99Å; R162-E167 VanDerWaalsContact CD-CD 3.44Å; R162-E167 WeakPolarHBondContact CD-OE1 3.3Å; R162-E167 WeakPolarHBondContact CD-OE2 3.4Å; R162-E167 IonicContact CZ-OE1 3.72Å; R162-E167 IonicContact CZ-OE2 3.13Å; R162-E167 IonicContact NE-OE2 3.82Å; R162-E167 VanDerWaalsContact NH1-CD 3.3Å; R162-E167 IonicContact NH1-OE1 2.91Å; R162-E167 PolarHBondContact NH1-OE1 2.91Å; R162-E167 IonicContact NH1-OE2 3.82Å; R162-E167 PolarHBondContact NH1-OE2 3.42Å
163F80.1Confident70.7Confident5 Ų555.1 Ų55.12%0.02228%0.282CS..  trans-86.34.8-174.669.8-84.4000115Y64 F86 V87 F90 Y91 A279 L283Y64-F163 HydrophobicContact CD2-CE1 4.28Å; Y64-F163 HydrophobicContact CE2-CD1 4.25Å; Y64-F163 AromaticContact CE2-CE1 3.8Å; Y64-F163 HydrophobicContact CE2-CE1 3.8Å; F86-F163 HydrophobicContact CD1-CB 4.42Å; F86-F163 HydrophobicContact CE1-CB 3.75Å; F86-F163 AromaticContact CE1-CD1 3.59Å; F86-F163 HydrophobicContact CE1-CD1 3.59Å; F86-F163 HydrophobicContact CE1-CD2 4.48Å; F86-F163 HydrophobicContact CE1-CE1 4.29Å; F86-F163 AromaticContact CE1-CG 3.7Å; F86-F163 HydrophobicContact CE1-CG 3.7Å; F86-F163 AromaticContact CZ-CD1 3.94Å; F86-F163 HydrophobicContact CZ-CD1 3.94Å; F86-F163 HydrophobicContact CZ-CE1 4.19Å; F86-F163 HydrophobicContact CZ-CG 4.14Å; V87-F163 HydrophobicContact CG2-CB 3.82Å; F90-F163 AromaticContact CD1-CD2 3.95Å; F90-F163 HydrophobicContact CD1-CD2 3.95Å; F90-F163 HydrophobicContact CD1-CE2 4.2Å; F90-F163 HydrophobicContact CE1-CD2 4.07Å; F90-F163 AromaticContact CE1-CE2 3.95Å; F90-F163 HydrophobicContact CE1-CE2 3.95Å; F90-F163 HydrophobicContact CZ-CE2 4.21Å; Y91-F163 WeakPolarHBondContact CE2-O 3.29Å; Y91-F163 PolarHBondContact OH-O 3.41Å; F163-A279 HydrophobicContact CE1-CB 3.75Å; F163-A279 HydrophobicContact CZ-CB 3.77Å; F163-L283 HydrophobicContact CE1-CD1 4.49Å; F163-L283 HydrophobicContact CZ-CD1 4.22Å; F163-L283 HydrophobicContact CZ-CD2 4.29Å; F163-L283 HydrophobicContact CZ-CG 4.12Å
164I81.9Confident72.3Confident11 Ų1153.6 Ų53.66%0.05627%0.268CS..SBendtrans-77.2140.6-175.5-57.3-61.9000110.7R162 A166 E167 S268 M278 A279R162-I164 VanDerWaalsContact C-N 3.33Å; R162-I164 PolarHBondContact O-N 2.99Å; I164-A166 VanDerWaalsContact C-N 3.3Å; I164-A166 PolarHBondContact O-N 3.4Å; I164-A166 VanDerWaalsContact O-N 3.12Å; I164-E167 PolarHBondContact O-N 2.9Å; I164-E167 VanDerWaalsContact O-N 3.11Å; I164-S268 WeakPolarHBondContact CG2-OG 3.05Å; I164-M278 HydrophobicContact CD1-CB 4.45Å; I164-A279 HydrophobicContact CD1-CB 4.19Å
165V75.7Confident74Confident1 Ų148 Ų481%0.00625%0.246CC..Hα-helixtrans-50.6-38.6-169.2178.20000115.4Y91 E167 I168 F176 S265 L269Y91-V165 HydrophobicContact CE1-CG2 3.92Å; Y91-V165 WeakPolarHBondContact OH-CG2 3.47Å; Y91-V165 PolarHBondContact OH-N 2.81Å; V165-E167 VanDerWaalsContact C-N 3.29Å; V165-E167 PolarHBondContact O-N 3.41Å; V165-I168 PolarHBondContact O-N 2.85Å; V165-F176 HydrophobicContact CG2-CD1 3.96Å; V165-F176 HydrophobicContact CG2-CE1 4.14Å; V165-S265 WeakPolarHBondContact CG2-OG 3.27Å; V165-L269 HydrophobicContact CG1-CD1 3.75Å; V165-L269 HydrophobicContact CG1-CD2 4.17Å; V165-L269 HydrophobicContact CG1-CG 3.95Å
166A62.6Low75.6Confident8 Ų838.3 Ų38.37%0.06621%0.21CC..Hα-helixtrans-59.1-41.5-178.800000112.6I164 I168 G169 S268I164-A166 VanDerWaalsContact C-N 3.3Å; I164-A166 PolarHBondContact O-N 3.4Å; I164-A166 VanDerWaalsContact O-N 3.12Å; A166-I168 VanDerWaalsContact C-N 3.27Å; A166-I168 PolarHBondContact O-N 2.87Å; A166-G169 PolarHBondContact O-N 3.18Å; A166-S268 WeakPolarHBondContact CB-O 3.26Å; A166-S268 WeakPolarHBondContact CB-OG 3.48Å
167E69.1Low77.2Confident59 Ų5938.4 Ų38.428%0.27621%0.211SC..Hα-helixtrans-78.8-16-172.2-51.9-142.6-156.800112F156 R162 I164 V165 S274F156-E167 HydrophobicContact CD2-CB 4.35Å; F156-E167 WeakPolarHBondContact CD2-O 3.41Å; F156-E167 HydrophobicContact CE2-CB 3.81Å; F156-E167 WeakPolarHBondContact CE2-O 3.37Å; R162-E167 VanDerWaalsContact CD-CD 3.44Å; R162-E167 WeakPolarHBondContact CD-OE1 3.3Å; R162-E167 WeakPolarHBondContact CD-OE2 3.4Å; R162-E167 IonicContact CZ-OE1 3.72Å; R162-E167 IonicContact CZ-OE2 3.13Å; R162-E167 IonicContact NE-OE2 3.82Å; R162-E167 VanDerWaalsContact NH1-CD 3.3Å; R162-E167 IonicContact NH1-OE1 2.91Å; R162-E167 PolarHBondContact NH1-OE1 2.91Å; R162-E167 IonicContact NH1-OE2 3.82Å; R162-E167 PolarHBondContact NH1-OE2 3.42Å; I164-E167 PolarHBondContact O-N 2.9Å; I164-E167 VanDerWaalsContact O-N 3.11Å; V165-E167 VanDerWaalsContact C-N 3.29Å; V165-E167 PolarHBondContact O-N 3.41Å; E167-S274 VanDerWaalsContact OE1-CB 3.28Å; E167-S274 WeakPolarHBondContact OE1-CB 3.36Å; E167-S274 PolarHBondContact OE1-OG 3.39Å
168I74.7Confident78.8Confident1 Ų144 Ų441%0.00524%0.241CC..Hα-helixtrans-77.8-35.7174.4-60.5169.4000110.9V87 Y91 P145 H150 D151 F156 V165 A166 F172V87-I168 HydrophobicContact CG1-CD1 4.14Å; Y91-I168 HydrophobicContact CD2-CD1 4.42Å; Y91-I168 HydrophobicContact CE2-CD1 3.55Å; P145-I168 HydrophobicContact CB-CG2 3.81Å; P145-I168 HydrophobicContact CG-CG2 3.94Å; H150-I168 CarbonylContact C-O 3.56Å; H150-I168 WeakPolarHBondContact CA-O 3.35Å; H150-I168 HydrophobicContact CB-CG2 4.27Å; H150-I168 WeakPolarHBondContact CB-O 3.46Å; D151-I168 PolarHBondContact N-O 3.27Å; D151-I168 VanDerWaalsContact N-O 3.09Å; F156-I168 HydrophobicContact CE1-CG1 4.26Å; F156-I168 HydrophobicContact CE2-CG1 3.85Å; F156-I168 HydrophobicContact CZ-CB 4.49Å; F156-I168 HydrophobicContact CZ-CD1 4.46Å; F156-I168 HydrophobicContact CZ-CG1 3.47Å; F156-I168 VanDerWaalsContact CZ-CG1 3.47Å; V165-I168 PolarHBondContact O-N 2.85Å; A166-I168 VanDerWaalsContact C-N 3.27Å; A166-I168 PolarHBondContact O-N 2.87Å; I168-F172 HydrophobicContact CB-CD1 4.27Å; I168-F172 HydrophobicContact CD1-CD1 4.31Å; I168-F172 HydrophobicContact CD1-CE1 4.09Å; I168-F172 HydrophobicContact CG2-CB 4.29Å; I168-F172 HydrophobicContact CG2-CD1 3.66Å; I168-F172 HydrophobicContact CG2-CE1 4.34Å; I168-F172 HydrophobicContact CG2-CG 4.17Å
169G76.8Confident80.7Confident11 Ų1143.7 Ų43.711%0.11324%0.237CC..  trans127.2148.5177.100000114.5A166 G171 F172 G173A166-G169 PolarHBondContact O-N 3.18Å; G169-G171 PolarHBondContact O-N 3.03Å; G169-F172 PolarHBondContact O-N 3.49Å; G169-G173 PolarHBondContact O-N 3.06Å; G169-G173 VanDerWaalsContact O-N 3.07Å
170L82.8Confident82.4Confident120 Ų12035.9 Ų35.963%0.62820%0.201SC*.Hα-helixtrans-55.9-42.2-169.5-175.764.9000114.1G173 V174 L269L170-G173 PolarHBondContact O-N 3.18Å; L170-V174 HydrophobicContact CD1-CG2 3.93Å; L170-V174 HydrophobicContact CG-CG2 4.35Å; L170-V174 WeakPolarHBondContact O-CG2 3.33Å; L170-V174 PolarHBondContact O-N 3.38Å; L170-L269 HydrophobicContact CD1-CD2 4.12Å
171G84.3Confident83.8Confident39 Ų3935.8 Ų35.840%0.40220%0.2SC..Hα-helixtrans-64-49.9-17600000113.3G169 G173 C175G169-G171 PolarHBondContact O-N 3.03Å; G171-G173 VanDerWaalsContact C-N 3.34Å; G171-C175 WeakPolarHBondContact O-CB 3.31Å; G171-C175 PolarHBondContact O-N 3.07Å
172F87.3Confident84.8Confident11 Ų1136.7 Ų36.75%0.04821%0.211CC..Hα-helixtrans-62.7-43.6173.6175.3-102.9000110.8Y91 L141 P145 I168 G169 V174 C175 F176Y91-F172 HydrophobicContact CD1-CE1 4.36Å; Y91-F172 HydrophobicContact CD1-CZ 4.29Å; Y91-F172 HydrophobicContact CD2-CE1 4.44Å; Y91-F172 HydrophobicContact CD2-CZ 4.46Å; Y91-F172 HydrophobicContact CE1-CE1 4.37Å; Y91-F172 HydrophobicContact CE2-CE1 4.48Å; Y91-F172 HydrophobicContact CG-CE1 4.41Å; Y91-F172 HydrophobicContact CG-CZ 4.16Å; L141-F172 WeakPolarHBondContact O-CE2 3.35Å; P145-F172 HydrophobicContact CG-CD1 4Å; P145-F172 HydrophobicContact CG-CD2 3.61Å; P145-F172 HydrophobicContact CG-CE1 3.98Å; P145-F172 HydrophobicContact CG-CE2 3.59Å; P145-F172 HydrophobicContact CG-CG 3.82Å; P145-F172 HydrophobicContact CG-CZ 3.78Å; I168-F172 HydrophobicContact CB-CD1 4.27Å; I168-F172 HydrophobicContact CD1-CD1 4.31Å; I168-F172 HydrophobicContact CD1-CE1 4.09Å; I168-F172 HydrophobicContact CG2-CB 4.29Å; I168-F172 HydrophobicContact CG2-CD1 3.66Å; I168-F172 HydrophobicContact CG2-CE1 4.34Å; I168-F172 HydrophobicContact CG2-CG 4.17Å; G169-F172 PolarHBondContact O-N 3.49Å; F172-V174 PolarHBondContact O-N 3.19Å; F172-C175 WeakPolarHBondContact O-CB 3.28Å; F172-C175 PolarHBondContact O-N 2.86Å; F172-F176 WeakPolarHBondContact O-CB 3.44Å; F172-F176 PolarHBondContact O-N 3.35Å
173G88.3Confident85.7Confident0 Ų030.4 Ų30.40%019%0.188CC..Hα-helixtrans-64.3-41.3-17700000115G169 L170 G171 L177G169-G173 PolarHBondContact O-N 3.06Å; G169-G173 VanDerWaalsContact O-N 3.07Å; L170-G173 PolarHBondContact O-N 3.18Å; G171-G173 VanDerWaalsContact C-N 3.34Å; G173-L177 WeakPolarHBondContact O-CB 3.29Å; G173-L177 WeakPolarHBondContact O-CG 3.49Å; G173-L177 PolarHBondContact O-N 2.74Å
174V89.8Confident86.5Confident66 Ų6631.2 Ų31.240%0.419%0.194SC..Hα-helixtrans-66.9-42.2174172.30000110.9L170 F172 L177 L178L170-V174 HydrophobicContact CD1-CG2 3.93Å; L170-V174 HydrophobicContact CG-CG2 4.35Å; L170-V174 WeakPolarHBondContact O-CG2 3.33Å; L170-V174 PolarHBondContact O-N 3.38Å; F172-V174 PolarHBondContact O-N 3.19Å; V174-L177 PolarHBondContact O-N 3.02Å; V174-L178 HydrophobicContact CG1-CD1 4.06Å; V174-L178 HydrophobicContact CG1-CG 4.49Å; V174-L178 VanDerWaalsContact O-CG 3.32Å; V174-L178 WeakPolarHBondContact O-CG 3.49Å; V174-L178 PolarHBondContact O-N 3.29Å
175C91.4Very high87.1Confident43 Ų4334.7 Ų34.729%0.29122%0.216SC..Hα-helixtrans-58.5-50.2175.4-174.50000111.3G171 F172 L177 L178 L179G171-C175 WeakPolarHBondContact O-CB 3.31Å; G171-C175 PolarHBondContact O-N 3.07Å; F172-C175 WeakPolarHBondContact O-CB 3.28Å; F172-C175 PolarHBondContact O-N 2.86Å; C175-L177 PolarHBondContact O-N 3.5Å; C175-L178 PolarHBondContact O-N 3.17Å; C175-L179 WeakPolarHBondContact O-CD1 3.42Å; C175-L179 VanDerWaalsContact O-CG 3.27Å; C175-L179 WeakPolarHBondContact O-CG 3.21Å; C175-L179 PolarHBondContact O-N 3.29Å
176F91.8Very high88.1Confident4 Ų439.7 Ų39.72%0.01824%0.24CC..Hα-helixtrans-59.3-46.2177.5176.3-104.6000112.6Y91 T94 L95 V165 F172 L178 L179 V180 V261Y91-F176 AromaticContact CD1-CD2 3.89Å; Y91-F176 HydrophobicContact CD1-CD2 3.89Å; Y91-F176 HydrophobicContact CD1-CE1 4.22Å; Y91-F176 AromaticContact CD1-CE2 3.51Å; Y91-F176 HydrophobicContact CD1-CE2 3.51Å; Y91-F176 HydrophobicContact CD1-CG 4.39Å; Y91-F176 AromaticContact CD1-CZ 3.69Å; Y91-F176 HydrophobicContact CD1-CZ 3.69Å; Y91-F176 HydrophobicContact CE1-CD1 4.19Å; Y91-F176 HydrophobicContact CE1-CD2 4.32Å; Y91-F176 AromaticContact CE1-CE1 3.83Å; Y91-F176 HydrophobicContact CE1-CE1 3.83Å; Y91-F176 HydrophobicContact CE1-CE2 4Å; Y91-F176 HydrophobicContact CE1-CG 4.41Å; Y91-F176 AromaticContact CE1-CZ 3.73Å; Y91-F176 HydrophobicContact CE1-CZ 3.73Å; T94-F176 HydrophobicContact CG2-CE2 3.86Å; T94-F176 HydrophobicContact CG2-CZ 3.64Å; L95-F176 HydrophobicContact CD1-CD2 4.49Å; L95-F176 HydrophobicContact CD2-CD2 3.91Å; L95-F176 HydrophobicContact CD2-CE2 3.87Å; L95-F176 HydrophobicContact CG-CD2 4.2Å; L95-F176 HydrophobicContact CG-CE2 4.04Å; V165-F176 HydrophobicContact CG2-CD1 3.96Å; V165-F176 HydrophobicContact CG2-CE1 4.14Å; F172-F176 WeakPolarHBondContact O-CB 3.44Å; F172-F176 PolarHBondContact O-N 3.35Å; F176-L178 VanDerWaalsContact C-N 3.34Å; F176-L178 PolarHBondContact O-N 2.77Å; F176-L179 PolarHBondContact O-N 3.23Å; F176-V180 HydrophobicContact CD2-CG2 4.13Å; F176-V180 HydrophobicContact CE1-CG2 4.12Å; F176-V180 HydrophobicContact CE2-CG2 3.63Å; F176-V180 HydrophobicContact CZ-CG2 3.64Å; F176-V180 WeakPolarHBondContact O-CG2 3.35Å; F176-V180 PolarHBondContact O-N 3.29Å; F176-V261 HydrophobicContact CE1-CG1 3.74Å; F176-V261 HydrophobicContact CZ-CG1 3.85Å
177L92.8Very high89.7Confident29 Ų2939.4 Ų39.415%0.15224%0.238CC..Hα-helixtrans-57.6-43174.8-84.4178.3000112.6G173 V174 C175 G181 L262 F266 L269G173-L177 WeakPolarHBondContact O-CB 3.29Å; G173-L177 WeakPolarHBondContact O-CG 3.49Å; G173-L177 PolarHBondContact O-N 2.74Å; V174-L177 PolarHBondContact O-N 3.02Å; C175-L177 PolarHBondContact O-N 3.5Å; L177-G181 WeakPolarHBondContact O-CA 3.3Å; L177-G181 PolarHBondContact O-N 3.11Å; L177-L262 HydrophobicContact CD2-CD2 3.62Å; L177-F266 HydrophobicContact CD1-CB 4.28Å; L177-F266 HydrophobicContact CD1-CD2 4.47Å; L177-F266 HydrophobicContact CD2-CB 4.44Å; L177-L269 HydrophobicContact CD1-CD1 3.59Å; L177-L269 HydrophobicContact CG-CD1 4.34Å
178L94.6Very high91Very high125 Ų12540.1 Ų40.165%0.65425%0.246SC*.Hα-helixtrans-67.4-37.4178.8-71.4171.9000112.1V174 C175 F176 G182V174-L178 HydrophobicContact CG1-CD1 4.06Å; V174-L178 HydrophobicContact CG1-CG 4.49Å; V174-L178 VanDerWaalsContact O-CG 3.32Å; V174-L178 WeakPolarHBondContact O-CG 3.49Å; V174-L178 PolarHBondContact O-N 3.29Å; C175-L178 PolarHBondContact O-N 3.17Å; F176-L178 VanDerWaalsContact C-N 3.34Å; F176-L178 PolarHBondContact O-N 2.77Å; L178-G182 WeakPolarHBondContact O-CA 3.16Å; L178-G182 PolarHBondContact O-N 2.82Å
179L94.8Very high92.1Very high49 Ų4943.7 Ų43.726%0.25727%0.268SS..Hα-helixtrans-70.4-45178.1-67162.9000112.1L95 F99 L141 C175 F176 S183L95-L179 HydrophobicContact CD2-CB 4.03Å; F99-L179 HydrophobicContact CZ-CB 4.23Å; F99-L179 HydrophobicContact CZ-CD2 4.17Å; L141-L179 HydrophobicContact CD1-CD1 3.73Å; L141-L179 HydrophobicContact CD1-CD2 4.47Å; C175-L179 WeakPolarHBondContact O-CD1 3.42Å; C175-L179 VanDerWaalsContact O-CG 3.27Å; C175-L179 WeakPolarHBondContact O-CG 3.21Å; C175-L179 PolarHBondContact O-N 3.29Å; F176-L179 PolarHBondContact O-N 3.23Å; L179-S183 VanDerWaalsContact O-CB 3.3Å; L179-S183 WeakPolarHBondContact O-CB 3.33Å; L179-S183 PolarHBondContact O-N 3.21Å; L179-S183 PolarHBondContact O-OG 3.17Å
180V94.5Very high93.1Very high1 Ų143.4 Ų43.41%0.00626%0.264CS..Hα-helixtrans-67.7-43.9175.4177.90000110.5L95 F176 S183 V184 L262L95-V180 HydrophobicContact CD2-CG2 3.94Å; F176-V180 HydrophobicContact CD2-CG2 4.13Å; F176-V180 HydrophobicContact CE1-CG2 4.12Å; F176-V180 HydrophobicContact CE2-CG2 3.63Å; F176-V180 HydrophobicContact CZ-CG2 3.64Å; F176-V180 WeakPolarHBondContact O-CG2 3.35Å; F176-V180 PolarHBondContact O-N 3.29Å; V180-S183 WeakPolarHBondContact CA-OG 3.35Å; V180-S183 PolarHBondContact O-N 3.03Å; V180-S183 PolarHBondContact O-OG 3.02Å; V180-V184 HydrophobicContact CG1-CG2 4.42Å; V180-V184 WeakPolarHBondContact O-CB 3.42Å; V180-V184 VanDerWaalsContact O-CG2 3.26Å; V180-V184 WeakPolarHBondContact O-CG2 3.2Å; V180-V184 PolarHBondContact O-N 3.36Å; V180-L262 HydrophobicContact CB-CD2 3.95Å; V180-L262 HydrophobicContact CB-CG 4.48Å; V180-L262 HydrophobicContact CG1-CD1 4.32Å; V180-L262 HydrophobicContact CG1-CD2 3.86Å; V180-L262 HydrophobicContact CG1-CG 3.83Å
181G95.4Very high93.8Very high19 Ų1938.1 Ų38.120%0.19624%0.237CC..Hα-helixtrans-65.3-42.3178.500000112.8L177 T185L177-G181 WeakPolarHBondContact O-CA 3.3Å; L177-G181 PolarHBondContact O-N 3.11Å; G181-T185 WeakPolarHBondContact O-CB 3.22Å; G181-T185 WeakPolarHBondContact O-CG2 3.44Å; G181-T185 PolarHBondContact O-N 3.02Å; G181-T185 PolarHBondContact O-OG1 3.12Å
182G95.8Very high94.4Very high31 Ų3138.9 Ų38.932%0.3224%0.239SC..Hα-helixtrans-64.2-42.517500000112.7L178 T185 M186L178-G182 WeakPolarHBondContact O-CA 3.16Å; L178-G182 PolarHBondContact O-N 2.82Å; G182-T185 WeakPolarHBondContact CA-OG1 3.26Å; G182-T185 PolarHBondContact O-OG1 3.45Å; G182-T185 VanDerWaalsContact O-OG1 3.08Å; G182-M186 VanDerWaalsContact O-CB 3.28Å; G182-M186 WeakPolarHBondContact O-CB 3.44Å; G182-M186 WeakPolarHBondContact O-CG 3.46Å; G182-M186 PolarHBondContact O-N 3.49Å
183S95.3Very high94.8Very high6 Ų641.5 Ų41.54%0.04225%0.253CS..Hα-helixtrans-68.8-42178.852.50000113C98 T102 L179 V180 G187C98-S183 WeakPolarHBondContact CB-OG 3.49Å; T102-S183 VanDerWaalsContact OG1-C 3.31Å; T102-S183 WeakPolarHBondContact OG1-CA 3.33Å; T102-S183 WeakPolarHBondContact OG1-CB 3.47Å; T102-S183 PolarHBondContact OG1-O 3.34Å; L179-S183 VanDerWaalsContact O-CB 3.3Å; L179-S183 WeakPolarHBondContact O-CB 3.33Å; L179-S183 PolarHBondContact O-N 3.21Å; L179-S183 PolarHBondContact O-OG 3.17Å; V180-S183 WeakPolarHBondContact CA-OG 3.35Å; V180-S183 PolarHBondContact O-N 3.03Å; V180-S183 PolarHBondContact O-OG 3.02Å; S183-G187 PolarHBondContact O-N 2.93Å
184V95.8Very high95.1Very high22 Ų2241.5 Ų41.513%0.13325%0.253CS..Hα-helixtrans-60.6-52.5172.6169.40000110.7V180 M186 G187 V188 D254V180-V184 HydrophobicContact CG1-CG2 4.42Å; V180-V184 WeakPolarHBondContact O-CB 3.42Å; V180-V184 VanDerWaalsContact O-CG2 3.26Å; V180-V184 WeakPolarHBondContact O-CG2 3.2Å; V180-V184 PolarHBondContact O-N 3.36Å; V184-M186 PolarHBondContact O-N 2.92Å; V184-G187 PolarHBondContact O-N 3.26Å; V184-G187 VanDerWaalsContact O-N 3.12Å; V184-V188 WeakPolarHBondContact O-CG2 2.9Å; V184-V188 PolarHBondContact O-N 3.25Å; V184-D254 HydrophobicContact CG1-CB 4.16Å
185T96.3Very high95.4Very high84 Ų8441 Ų4152%0.51525%0.248SC..Hα-helixtrans-61.3-43.4-179490000112.5G181 G182 V189G181-T185 WeakPolarHBondContact O-CB 3.22Å; G181-T185 WeakPolarHBondContact O-CG2 3.44Å; G181-T185 PolarHBondContact O-N 3.02Å; G181-T185 PolarHBondContact O-OG1 3.12Å; G182-T185 WeakPolarHBondContact CA-OG1 3.26Å; G182-T185 PolarHBondContact O-OG1 3.45Å; G182-T185 VanDerWaalsContact O-OG1 3.08Å; T185-V189 WeakPolarHBondContact O-CB 3.4Å; T185-V189 VanDerWaalsContact O-CG2 3.29Å; T185-V189 WeakPolarHBondContact O-CG2 3.45Å; T185-V189 PolarHBondContact O-N 2.98Å
186M96.9Very high95.5Very high106 Ų10645.7 Ų45.752%0.52226%0.263SS..Hα-helixtrans-64.1-38.5173.9-71.4-63-64.600112.5T102 G182 V184 V189 C190T102-M186 HydrophobicContact CG2-CB 3.81Å; G182-M186 VanDerWaalsContact O-CB 3.28Å; G182-M186 WeakPolarHBondContact O-CB 3.44Å; G182-M186 WeakPolarHBondContact O-CG 3.46Å; G182-M186 PolarHBondContact O-N 3.49Å; V184-M186 PolarHBondContact O-N 2.92Å; M186-V189 PolarHBondContact O-N 3.45Å; M186-C190 WeakPolarHBondContact O-CB 3.36Å; M186-C190 PolarHBondContact O-N 3.26Å; M186-C190 PolarHBondContact O-SG 3.28Å; M186-C190 VanDerWaalsContact O-SG 3.35Å
187G96.1Very high95.6Very high1 Ų149 Ų491%0.0128%0.279CS..Hα-helixtrans-61.8-48.617700000112.3S105 S183 V184 T191S105-G187 WeakPolarHBondContact CB-O 3.38Å; S105-G187 PolarHBondContact OG-O 3.27Å; S183-G187 PolarHBondContact O-N 2.93Å; V184-G187 PolarHBondContact O-N 3.26Å; V184-G187 VanDerWaalsContact O-N 3.12Å; G187-T191 VanDerWaalsContact O-CB 3.22Å; G187-T191 WeakPolarHBondContact O-CB 3.32Å; G187-T191 PolarHBondContact O-N 3.32Å; G187-T191 PolarHBondContact O-OG1 3.33Å
188V96.4Very high95.5Very high74 Ų7448.1 Ų48.145%0.44828%0.275SS..Hα-helixtrans-60.4-47.2175.1174.40000111.2V184 T191 A192 D254V184-V188 WeakPolarHBondContact O-CG2 2.9Å; V184-V188 PolarHBondContact O-N 3.25Å; V188-T191 PolarHBondContact O-N 3.01Å; V188-A192 WeakPolarHBondContact O-CB 3.24Å; V188-A192 PolarHBondContact O-N 3.36Å; V188-D254 VanDerWaalsContact CG2-OD2 3.29Å; V188-D254 WeakPolarHBondContact CG2-OD2 3.42Å
189V97.6Very high95.3Very high77 Ų7746 Ų4647%0.46726%0.264SS..Hα-helixtrans-62.9-49.6-179.5169.30000111.5T185 M186 T191 A192 I193T185-V189 WeakPolarHBondContact O-CB 3.4Å; T185-V189 VanDerWaalsContact O-CG2 3.29Å; T185-V189 WeakPolarHBondContact O-CG2 3.45Å; T185-V189 PolarHBondContact O-N 2.98Å; M186-V189 PolarHBondContact O-N 3.45Å; V189-T191 VanDerWaalsContact C-N 3.3Å; V189-T191 PolarHBondContact O-N 2.89Å; V189-A192 PolarHBondContact O-N 2.98Å; V189-I193 HydrophobicContact CG1-CD1 3.86Å; V189-I193 VanDerWaalsContact O-CG1 3.31Å; V189-I193 WeakPolarHBondContact O-CG1 3.25Å; V189-I193 PolarHBondContact O-N 2.86Å
190C97.4Very high95Very high5 Ų545.7 Ų45.73%0.03427%0.269CS..Hα-helixtrans-59.7-41.6177.2-72.40000111.9M109 M186 I193 A194M109-C190 HydrophobicContact CB-CB 4.21Å; M109-C190 HydrophobicContact SD-CB 3.96Å; M186-C190 WeakPolarHBondContact O-CB 3.36Å; M186-C190 PolarHBondContact O-N 3.26Å; M186-C190 PolarHBondContact O-SG 3.28Å; M186-C190 VanDerWaalsContact O-SG 3.35Å; C190-I193 PolarHBondContact O-N 3.36Å; C190-A194 WeakPolarHBondContact O-CB 3.14Å; C190-A194 PolarHBondContact O-N 3.08Å
191T96.5Very high94.5Very high9 Ų949.3 Ų49.36%0.05529%0.29CS..Hα-helixtrans-65.7-43.1177.8-67.70000112.2S105 G187 V188 V189 I193 A194 L195 T247S105-T191 WeakPolarHBondContact CB-OG1 3.47Å; S105-T191 PolarHBondContact OG-OG1 2.97Å; S105-T191 VanDerWaalsContact OG-OG1 3.13Å; G187-T191 VanDerWaalsContact O-CB 3.22Å; G187-T191 WeakPolarHBondContact O-CB 3.32Å; G187-T191 PolarHBondContact O-N 3.32Å; G187-T191 PolarHBondContact O-OG1 3.33Å; V188-T191 PolarHBondContact O-N 3.01Å; V189-T191 VanDerWaalsContact C-N 3.3Å; V189-T191 PolarHBondContact O-N 2.89Å; T191-I193 PolarHBondContact O-N 3.39Å; T191-A194 PolarHBondContact O-N 3.49Å; T191-L195 WeakPolarHBondContact O-CB 3.34Å; T191-L195 PolarHBondContact O-N 2.85Å; T191-T247 HydrophobicContact CG2-CG2 3.8Å; T191-T247 WeakPolarHBondContact CG2-OG1 3.19Å
192A96.6Very high93.9Very high55 Ų5549.8 Ų49.846%0.45529%0.287SS..Hα-helixtrans-61.9-42.817700000111.6V188 V189 L195 F196V188-A192 WeakPolarHBondContact O-CB 3.24Å; V188-A192 PolarHBondContact O-N 3.36Å; V189-A192 PolarHBondContact O-N 2.98Å; A192-L195 PolarHBondContact O-N 2.86Å; A192-F196 VanDerWaalsContact O-CB 3.28Å; A192-F196 WeakPolarHBondContact O-CB 3.34Å; A192-F196 PolarHBondContact O-N 2.94Å
193I96.3Very high93.3Very high65 Ų6553 Ų5333%0.33330%0.301SS..Hα-helixtrans-62.2-47.8174.8-65.1164.4000110.6M109 V189 C190 T191 L195 F196 Q197M109-I193 HydrophobicContact CG-CB 4.16Å; M109-I193 HydrophobicContact CG-CG2 3.84Å; M109-I193 HydrophobicContact SD-CB 4.23Å; M109-I193 HydrophobicContact SD-CD1 3.97Å; M109-I193 HydrophobicContact SD-CG2 4.17Å; V189-I193 HydrophobicContact CG1-CD1 3.86Å; V189-I193 VanDerWaalsContact O-CG1 3.31Å; V189-I193 WeakPolarHBondContact O-CG1 3.25Å; V189-I193 PolarHBondContact O-N 2.86Å; C190-I193 PolarHBondContact O-N 3.36Å; T191-I193 PolarHBondContact O-N 3.39Å; I193-L195 PolarHBondContact O-N 3.31Å; I193-F196 PolarHBondContact O-N 3.4Å; I193-Q197 HydrophobicContact CG2-CG 4.33Å; I193-Q197 WeakPolarHBondContact O-CB 3.38Å; I193-Q197 VanDerWaalsContact O-CG 3.27Å; I193-Q197 WeakPolarHBondContact O-CG 3.31Å; I193-Q197 PolarHBondContact O-N 3.01Å
194A95.1Very high92.5Very high1 Ų154.7 Ų54.71%0.00832%0.319CS..Hα-helixtrans-61.5-42.1179.200000112.6R108 M109 C190 T191 T198 T243R108-A194 HydrophobicContact CG-CB 4.36Å; M109-A194 HydrophobicContact CB-CB 4.22Å; C190-A194 WeakPolarHBondContact O-CB 3.14Å; C190-A194 PolarHBondContact O-N 3.08Å; T191-A194 PolarHBondContact O-N 3.49Å; A194-T198 WeakPolarHBondContact O-CB 3.44Å; A194-T198 WeakPolarHBondContact O-CG2 3.17Å; A194-T198 PolarHBondContact O-N 2.96Å; A194-T198 PolarHBondContact O-OG1 2.89Å; A194-T243 HydrophobicContact CB-CG2 4.31Å
195L95.3Very high91.3Very high55 Ų5559.5 Ų59.529%0.28834%0.335SS..Hα-helixtrans-66.8-48.4177.5-175.167.2000111.1T191 A192 I193 Q197 T198 L199 T243 T247T191-L195 WeakPolarHBondContact O-CB 3.34Å; T191-L195 PolarHBondContact O-N 2.85Å; A192-L195 PolarHBondContact O-N 2.86Å; I193-L195 PolarHBondContact O-N 3.31Å; L195-Q197 PolarHBondContact O-N 3.42Å; L195-T198 PolarHBondContact O-N 3.45Å; L195-T198 PolarHBondContact O-OG1 2.97Å; L195-T198 VanDerWaalsContact O-OG1 3.06Å; L195-L199 HydrophobicContact CD1-CD1 4.21Å; L195-L199 HydrophobicContact CD1-CG 4.44Å; L195-L199 HydrophobicContact CG-CD1 4.02Å; L195-L199 WeakPolarHBondContact O-CB 3.24Å; L195-L199 VanDerWaalsContact O-CG 3.31Å; L195-L199 WeakPolarHBondContact O-CG 3.36Å; L195-L199 PolarHBondContact O-N 3.12Å; L195-T243 HydrophobicContact CD1-CG2 4.37Å; L195-T247 HydrophobicContact CD2-CG2 4.27Å
196F94.7Very high90.1Very high141 Ų14163.9 Ų63.962%0.61834%0.342SS*.Hα-helixtrans-57.6-49.9177.8178.7-98.6000111.7A192 I193 T198 L199 A200A192-F196 VanDerWaalsContact O-CB 3.28Å; A192-F196 WeakPolarHBondContact O-CB 3.34Å; A192-F196 PolarHBondContact O-N 2.94Å; I193-F196 PolarHBondContact O-N 3.4Å; F196-T198 PolarHBondContact O-N 2.77Å; F196-L199 PolarHBondContact O-N 3.42Å; F196-A200 WeakPolarHBondContact O-CB 3.35Å; F196-A200 PolarHBondContact O-N 3.36Å
197Q92.7Very high88.9Confident74 Ų7461.7 Ų61.735%0.34634%0.341SS..Hα-helixtrans-63.9-41.4-179.9-70.2-713.900112.3V112 I193 L195 A200 V201V112-Q197 HydrophobicContact CG1-CB 3.55Å; I193-Q197 HydrophobicContact CG2-CG 4.33Å; I193-Q197 WeakPolarHBondContact O-CB 3.38Å; I193-Q197 VanDerWaalsContact O-CG 3.27Å; I193-Q197 WeakPolarHBondContact O-CG 3.31Å; I193-Q197 PolarHBondContact O-N 3.01Å; L195-Q197 PolarHBondContact O-N 3.42Å; Q197-A200 PolarHBondContact O-N 3.09Å; Q197-V201 WeakPolarHBondContact O-CB 3.39Å; Q197-V201 VanDerWaalsContact O-CG2 3.31Å; Q197-V201 WeakPolarHBondContact O-CG2 3.33Å; Q197-V201 PolarHBondContact O-N 3.44Å
198T91.2Very high87.4Confident10 Ų1066.2 Ų66.26%0.06137%0.365CS..Hα-helixtrans-66.1-38.1176.747.50000113.1V112 A194 L195 F196 Q202 T243V112-T198 HydrophobicContact CB-CG2 4.3Å; V112-T198 HydrophobicContact CG1-CG2 3.64Å; V112-T198 HydrophobicContact CG2-CG2 3.57Å; A194-T198 WeakPolarHBondContact O-CB 3.44Å; A194-T198 WeakPolarHBondContact O-CG2 3.17Å; A194-T198 PolarHBondContact O-N 2.96Å; A194-T198 PolarHBondContact O-OG1 2.89Å; L195-T198 PolarHBondContact O-N 3.45Å; L195-T198 PolarHBondContact O-OG1 2.97Å; L195-T198 VanDerWaalsContact O-OG1 3.06Å; F196-T198 PolarHBondContact O-N 2.77Å; T198-Q202 WeakPolarHBondContact O-CB 3.34Å; T198-Q202 WeakPolarHBondContact O-CG 3.46Å; T198-Q202 PolarHBondContact O-N 3.41Å; T198-Q202 VanDerWaalsContact O-N 3.13Å; T198-T243 HydrophobicContact CG2-CG2 4.38Å; T198-T243 WeakPolarHBondContact CG2-OG1 3.28Å
199L90.5Very high85.7Confident80 Ų8073 Ų7342%0.41938%0.382SS..Hα-helixtrans-68-44.4174.6-67.9173.1000111.6L195 F196 V201 Q202 V203 L240L195-L199 HydrophobicContact CD1-CD1 4.21Å; L195-L199 HydrophobicContact CD1-CG 4.44Å; L195-L199 HydrophobicContact CG-CD1 4.02Å; L195-L199 WeakPolarHBondContact O-CB 3.24Å; L195-L199 VanDerWaalsContact O-CG 3.31Å; L195-L199 WeakPolarHBondContact O-CG 3.36Å; L195-L199 PolarHBondContact O-N 3.12Å; F196-L199 PolarHBondContact O-N 3.42Å; L199-V201 PolarHBondContact O-N 3.42Å; L199-Q202 PolarHBondContact O-N 3.38Å; L199-V203 WeakPolarHBondContact O-CG2 3.47Å; L199-V203 PolarHBondContact O-N 3.33Å; L199-L240 HydrophobicContact CD2-CD1 3.99Å
200A89.2Confident83.8Confident44 Ų4480.2 Ų80.236%0.36440%0.401SS..Hα-helixtrans-59.2-48.5177.800000112F196 Q197 Q202 V203 G204F196-A200 WeakPolarHBondContact O-CB 3.35Å; F196-A200 PolarHBondContact O-N 3.36Å; Q197-A200 PolarHBondContact O-N 3.09Å; A200-Q202 VanDerWaalsContact C-N 3.29Å; A200-Q202 PolarHBondContact O-N 2.91Å; A200-V203 PolarHBondContact O-N 2.84Å; A200-G204 PolarHBondContact O-N 3.35Å
201V84.3Confident81.6Confident76 Ų7683.8 Ų83.846%0.46143%0.431SS..Hα-helixtrans-62.5-34.9176.6171.10000111.9Q197 L199 R205Q197-V201 WeakPolarHBondContact O-CB 3.39Å; Q197-V201 VanDerWaalsContact O-CG2 3.31Å; Q197-V201 WeakPolarHBondContact O-CG2 3.33Å; Q197-V201 PolarHBondContact O-N 3.44Å; L199-V201 PolarHBondContact O-N 3.42Å; V201-R205 WeakPolarHBondContact O-CB 3.35Å; V201-R205 WeakPolarHBondContact O-CG 3.39Å; V201-R205 PolarHBondContact O-N 2.76Å
202Q82.4Confident79.2Confident29 Ų2990.5 Ų90.514%0.13646%0.459CS..Hα-helixtrans-69.5-41.8174.8-81.1-162.8-11.300113.3T198 L199 A200 R206 A236 L240T198-Q202 WeakPolarHBondContact O-CB 3.34Å; T198-Q202 WeakPolarHBondContact O-CG 3.46Å; T198-Q202 PolarHBondContact O-N 3.41Å; T198-Q202 VanDerWaalsContact O-N 3.13Å; L199-Q202 PolarHBondContact O-N 3.38Å; A200-Q202 VanDerWaalsContact C-N 3.29Å; A200-Q202 PolarHBondContact O-N 2.91Å; Q202-R206 WeakPolarHBondContact O-CB 3.19Å; Q202-R206 WeakPolarHBondContact O-CG 3.1Å; Q202-R206 PolarHBondContact O-N 3.18Å; Q202-A236 PolarHBondContact NE2-O 3.2Å; Q202-L240 VanDerWaalsContact NE2-CB 3.28Å
203V82.5Confident76.7Confident99 Ų9993.7 Ų93.760%0.647%0.473SS*.Hα-helixtrans-64.8-46.6176.7172.80000110L199 A200 R205 R206 A207L199-V203 WeakPolarHBondContact O-CG2 3.47Å; L199-V203 PolarHBondContact O-N 3.33Å; A200-V203 PolarHBondContact O-N 2.84Å; V203-R205 PolarHBondContact O-N 2.98Å; V203-R206 PolarHBondContact O-N 2.88Å; V203-R206 VanDerWaalsContact O-N 3.12Å; V203-A207 PolarHBondContact O-N 2.99Å
204G78.9Confident74.5Confident41 Ų4195.4 Ų95.442%0.42349%0.487SS..Hα-helixtrans-54.7-52.4174.200000112.2A200 R206 A207 D208A200-G204 PolarHBondContact O-N 3.35Å; G204-R206 VanDerWaalsContact C-N 3.29Å; G204-R206 PolarHBondContact O-N 3.2Å; G204-A207 PolarHBondContact O-N 3.05Å; G204-A207 VanDerWaalsContact O-N 3.14Å; G204-D208 WeakPolarHBondContact O-CB 3.45Å; G204-D208 PolarHBondContact O-N 3.19Å
205R70.6Confident72.2Confident124 Ų12498 Ų9847%0.46850%0.504SS..Hα-helixtrans-62-30176.5-79.9179.6163.9-178.3-6.7114.1V201 V203 R209V201-R205 WeakPolarHBondContact O-CB 3.35Å; V201-R205 WeakPolarHBondContact O-CG 3.39Å; V201-R205 PolarHBondContact O-N 2.76Å; V203-R205 PolarHBondContact O-N 2.98Å; R205-R209 WeakPolarHBondContact O-CB 3.23Å; R205-R209 PolarHBondContact O-N 3.03Å
206R70.8Confident70Confident175 Ų17598.3 Ų98.366%0.6651%0.508SS*.Hα-helixtrans-74.3-31.9175.2-77.8179.2-175.1-179.14.9112.7Q202 V203 G204 R210Q202-R206 WeakPolarHBondContact O-CB 3.19Å; Q202-R206 WeakPolarHBondContact O-CG 3.1Å; Q202-R206 PolarHBondContact O-N 3.18Å; V203-R206 PolarHBondContact O-N 2.88Å; V203-R206 VanDerWaalsContact O-N 3.12Å; G204-R206 VanDerWaalsContact C-N 3.29Å; G204-R206 PolarHBondContact O-N 3.2Å; R206-R210 WeakPolarHBondContact O-CG 3.39Å
207A72.4Confident68.1Low61 Ų6195.2 Ų95.250%0.50450%0.497SS..Hα-helixtrans-72.3-47.8172.100000110.8V203 G204 R209 R210 A211V203-A207 PolarHBondContact O-N 2.99Å; G204-A207 PolarHBondContact O-N 3.05Å; G204-A207 VanDerWaalsContact O-N 3.14Å; A207-R209 PolarHBondContact O-N 3.23Å; A207-R210 WeakPolarHBondContact O-CA 3.32Å; A207-R210 WeakPolarHBondContact O-CB 3.18Å; A207-R210 PolarHBondContact O-N 3.36Å; A207-A211 PolarHBondContact O-N 3.35Å
208D63.9Low66.2Low96 Ų9693.6 Ų93.651%0.51349%0.492SS..Hα-helixtrans-65.9-37.6-177-163.827.4000112.7G204 R210 A211 F212G204-D208 WeakPolarHBondContact O-CB 3.45Å; G204-D208 PolarHBondContact O-N 3.19Å; D208-R210 PolarHBondContact O-N 2.99Å; D208-A211 PolarHBondContact O-N 2.96Å; D208-F212 PolarHBondContact O-N 3.26Å
209R59.8Low64.3Low215 Ų21597.3 Ų97.381%0.81152%0.515SS*.THydrogen-bonded Turntrans-64.3-7.8171.3-167.6173.2-177.4-171.21114R205 A207R205-R209 WeakPolarHBondContact O-CB 3.23Å; R205-R209 PolarHBondContact O-N 3.03Å; A207-R209 PolarHBondContact O-N 3.23Å
210R58.6Low62.3Low230 Ų23098.2 Ų98.287%0.86852%0.517SS*.THydrogen-bonded Turntrans-102.5-6.5169.5-63.5174.2174.5-173.9-3113R206 A207 D208R206-R210 WeakPolarHBondContact O-CG 3.39Å; A207-R210 WeakPolarHBondContact O-CA 3.32Å; A207-R210 WeakPolarHBondContact O-CB 3.18Å; A207-R210 PolarHBondContact O-N 3.36Å; D208-R210 PolarHBondContact O-N 2.99Å
211A50.6Low60.5Low79 Ų7998.8 Ų98.865%0.65351%0.513SS*.THydrogen-bonded Turntrans-114-41-173.100000113.2A207 D208A207-A211 PolarHBondContact O-N 3.35Å; D208-A211 PolarHBondContact O-N 2.96Å
212F46.5Very low58.9Low150 Ų150100.3 Ų100.366%0.65853%0.534SS*.  trans-155.2120.9-178.3-159.8-122.9000113.6D208 V214D208-F212 PolarHBondContact O-N 3.26Å; F212-V214 HydrophobicContact CD1-CG2 3.52Å; F212-V214 HydrophobicContact CE1-CG2 3.59Å; F212-V214 PolarHBondContact O-N 3.03Å
213T44.1Very low57.2Low122 Ų122106.7 Ų106.775%0.74856%0.564SS**  trans-96.884.1178.5-44.70000110.5P215T213-P215 WeakPolarHBondContact O-CD 3.12Å
214V49.9Very low55.7Low102 Ų102104.9 Ų104.962%0.61857%0.565SS**PPolyproline II helixtrans-66.8119.8167.6-176.50000108.2F212 T216F212-V214 HydrophobicContact CD1-CG2 3.52Å; F212-V214 HydrophobicContact CE1-CG2 3.59Å; F212-V214 PolarHBondContact O-N 3.03Å; V214-T216 PolarHBondContact O-N 3.47Å
215P48.2Very low53.9Low56 Ų56108.8 Ų108.836%0.36457%0.57SS.*PPolyproline II helixtrans-64.3133.2178.625.7-32.7000110T213 I217 Q385T213-P215 WeakPolarHBondContact O-CD 3.12Å; P215-I217 PolarHBondContact O-N 3.22Å; P215-I217 VanDerWaalsContact O-N 3.12Å; P215-Q385 WeakPolarHBondContact CB-O 3.32Å
216T49.2Very low52.8Low61 Ų61110.1 Ų110.137%0.37458%0.575SS.*PPolyproline II helixtrans-60.3116.7175.849.10000109.4V214 V218 I230V214-T216 PolarHBondContact O-N 3.47Å; T216-V218 PolarHBondContact O-N 2.83Å; T216-I230 HydrophobicContact CG2-CD1 4.2Å
217I54.3Low51.4Low75 Ų75108.2 Ų108.239%0.38557%0.568SS.*  trans-65.9105.4176.4-58172.1000107.8P215 V219 S228 S229P215-I217 PolarHBondContact O-N 3.22Å; P215-I217 VanDerWaalsContact O-N 3.12Å; I217-V219 HydrophobicContact CG2-CG2 4.24Å; I217-S228 CarbonylContact O-C 3.58Å; I217-S228 VanDerWaalsContact O-CA 3.31Å; I217-S228 WeakPolarHBondContact O-CA 3.43Å; I217-S229 PolarHBondContact O-N 3.32Å
218V51.7Low50.2Low41 Ų41106.5 Ų106.525%0.24855%0.552CS.*EExtended strand (participates in β ladder)trans-89.9113.4172.1-176.30000107.4T216 R226 Y386T216-V218 PolarHBondContact O-N 2.83Å; V218-R226 HydrophobicContact CG1-CB 3.89Å; V218-R226 HydrophobicContact CG1-CG 3.86Å; V218-Y386 HydrophobicContact CG2-CD1 4.44Å; V218-Y386 HydrophobicContact CG2-CE1 4.5Å
219V51.1Low49.3Very low88 Ų88106.2 Ų106.253%0.53356%0.558SS.*EExtended strand (participates in β ladder)trans-92.3116.7168.4-176.10000106.6I217 R227I217-V219 HydrophobicContact CG2-CG2 4.24Å; V219-R227 PolarHBondContact N-O 3.49Å; V219-R227 PolarHBondContact O-N 3.29Å
220E49.4Very low49Very low99 Ų99100.2 Ų100.246%0.46354%0.541SS..EExtended strand (participates in β ladder)trans-80.5121.1168.8-77.9176.1160.200108.6R226E220-R226 HydrophobicContact CG-CG 3.61Å; E220-R226 WeakPolarHBondContact OE1-CG 3.46Å; E220-R226 IonicContact OE1-CZ 3.18Å; E220-R226 IonicContact OE1-NE 2.68Å; E220-R226 PolarHBondContact OE1-NE 3.02Å; E220-R226 IonicContact OE1-NH2 2.8Å; E220-R226 PolarHBondContact OE1-NH2 3.4Å
221D50.7Low48.1Very low55 Ų5594.6 Ų94.629%0.29453%0.528SS..PPolyproline II helixtrans-64.7152.7169.3-160.6-25.6000109.3Q223 G224 K225 R227D221-Q223 PolarHBondContact O-N 3.5Å; D221-G224 PolarHBondContact O-N 2.67Å; D221-K225 HydrophobicContact CB-CB 4.07Å; D221-K225 VanDerWaalsContact CB-O 3.23Å; D221-K225 WeakPolarHBondContact CB-O 3.33Å; D221-K225 PolarHBondContact N-O 3.35Å; D221-K225 VanDerWaalsContact N-O 3.15Å; D221-R227 IonicContact OD2-CZ 3.81Å; D221-R227 IonicContact OD2-NE 3.75Å; D221-R227 IonicContact OD2-NH2 3.09Å; D221-R227 PolarHBondContact OD2-NH2 2.88Å; D221-R227 VanDerWaalsContact OD2-NH2 3.09Å
222A51Low48.1Very low108 Ų10893.5 Ų93.589%0.89352%0.524SS*.THydrogen-bonded Turntrans-60-19.3-179.200000112.9G224A222-G224 VanDerWaalsContact C-N 3.26Å; A222-G224 PolarHBondContact O-N 2.95Å
223Q47.8Very low48.6Very low164 Ų16489 Ų8977%0.76651%0.512SS*.THydrogen-bonded Turntrans-82.813.1172.7-60.1-177.3-21.400114D221 K225D221-Q223 PolarHBondContact O-N 3.5Å; Q223-K225 PolarHBondContact O-N 3Å
224G50.1Low49.6Very low60 Ų6085.7 Ų85.762%0.61949%0.488SS*.SBendtrans71.56.9-176.600000114.5D221 A222 R226D221-G224 PolarHBondContact O-N 2.67Å; A222-G224 VanDerWaalsContact C-N 3.26Å; A222-G224 PolarHBondContact O-N 2.95Å; G224-R226 PolarHBondContact O-N 2.65Å
225K41.6Very low50.9Low124 Ų12484.7 Ų84.754%0.53948%0.483SS..  trans-85.998.3-177.2-169170-174.3169.70110.6D221 Q223 R227D221-K225 HydrophobicContact CB-CB 4.07Å; D221-K225 VanDerWaalsContact CB-O 3.23Å; D221-K225 WeakPolarHBondContact CB-O 3.33Å; D221-K225 PolarHBondContact N-O 3.35Å; D221-K225 VanDerWaalsContact N-O 3.15Å; Q223-K225 PolarHBondContact O-N 3Å; K225-R227 PolarHBondContact O-N 3.4Å
226R46.5Very low52.3Low151 Ų15183.9 Ų83.957%0.5748%0.481SS*.EExtended strand (participates in β ladder)trans-52.4121.1169.8-72.8176.3177.9-162.7-9.4110.6V218 E220 G224V218-R226 HydrophobicContact CG1-CB 3.89Å; V218-R226 HydrophobicContact CG1-CG 3.86Å; E220-R226 HydrophobicContact CG-CG 3.61Å; E220-R226 WeakPolarHBondContact OE1-CG 3.46Å; E220-R226 IonicContact OE1-CZ 3.18Å; E220-R226 IonicContact OE1-NE 2.68Å; E220-R226 PolarHBondContact OE1-NE 3.02Å; E220-R226 IonicContact OE1-NH2 2.8Å; E220-R226 PolarHBondContact OE1-NH2 3.4Å; G224-R226 PolarHBondContact O-N 2.65Å
227R43.1Very low53.8Low136 Ų13689.2 Ų89.251%0.51350%0.499SS..EExtended strand (participates in β ladder)trans-127.3114.9163.6-57.7-168.9-153.2-171.112.4108.3V219 D221 K225V219-R227 PolarHBondContact N-O 3.49Å; V219-R227 PolarHBondContact O-N 3.29Å; D221-R227 IonicContact OD2-CZ 3.81Å; D221-R227 IonicContact OD2-NE 3.75Å; D221-R227 IonicContact OD2-NH2 3.09Å; D221-R227 PolarHBondContact OD2-NH2 2.88Å; D221-R227 VanDerWaalsContact OD2-NH2 3.09Å; K225-R227 PolarHBondContact O-N 3.4Å
228S47.1Very low55.3Low24 Ų2487.6 Ų87.617%0.16849%0.493CS..EExtended strand (participates in β ladder)trans-74.6152.4170.878.80000110.9I217 I230 D231I217-S228 CarbonylContact O-C 3.58Å; I217-S228 VanDerWaalsContact O-CA 3.31Å; I217-S228 WeakPolarHBondContact O-CA 3.43Å; S228-I230 PolarHBondContact O-N 3.29Å; S228-I230 PolarHBondContact OG-N 3.39Å; S228-D231 VanDerWaalsContact O-CB 3.23Å; S228-D231 WeakPolarHBondContact O-CB 3.42Å; S228-D231 PolarHBondContact O-N 3.43Å; S228-D231 WeakPolarHBondContact OG-CB 3.49Å; S228-D231 PolarHBondContact OG-N 2.68Å; S228-D231 VanDerWaalsContact OG-N 3.11Å
229S44.8Very low57Low91 Ų9186.9 Ų86.964%0.63649%0.49SS*.THydrogen-bonded Turntrans-61.3-15.7172.961.50000113.1I217I217-S229 PolarHBondContact O-N 3.32Å
230I52.1Low58.7Low88 Ų8885.4 Ų85.445%0.45148%0.478SS..THydrogen-bonded Turntrans-94.3-13178.5-93.8168.3000113.6T216 S228 G232 S233T216-I230 HydrophobicContact CG2-CD1 4.2Å; S228-I230 PolarHBondContact O-N 3.29Å; S228-I230 PolarHBondContact OG-N 3.39Å; I230-G232 PolarHBondContact O-N 3.46Å; I230-S233 PolarHBondContact O-N 3Å; I230-S233 PolarHBondContact O-OG 3.11Å
231D41.2Very low60.7Low113 Ų11383.6 Ų83.660%0.60447%0.47SS*.THydrogen-bonded Turntrans-66.9-7.6-170.2-136.42.3000114.3S228S228-D231 VanDerWaalsContact O-CB 3.23Å; S228-D231 WeakPolarHBondContact O-CB 3.42Å; S228-D231 PolarHBondContact O-N 3.43Å; S228-D231 WeakPolarHBondContact OG-CB 3.49Å; S228-D231 PolarHBondContact OG-N 2.68Å; S228-D231 VanDerWaalsContact OG-N 3.11Å
232G50.4Low62.7Low55 Ų5581.1 Ų81.157%0.56746%0.457SS*.THydrogen-bonded Turntrans-94.5-4.7173.200000115.2I230I230-G232 PolarHBondContact O-N 3.46Å
233S56.2Low64.7Low56 Ų5676 Ų7639%0.39242%0.415SS..SBendtrans-91.6133.3179.266.30000111.3I230 P235I230-S233 PolarHBondContact O-N 3Å; I230-S233 PolarHBondContact O-OG 3.11Å; S233-P235 WeakPolarHBondContact O-CD 3.49Å
234E65.8Low66.8Low53 Ų5369.5 Ų69.525%0.24839%0.391CS..PPolyproline II helixtrans-59.5126.1175-74-156.2132.800109.2R108 A236 R302R108-E234 IonicContact NH1-OE2 3.5Å; R108-E234 PolarHBondContact NH1-OE2 3.39Å; R108-E234 VanDerWaalsContact NH1-OE2 3.13Å; E234-A236 PolarHBondContact O-N 3.4Å; E234-R302 IonicContact OE1-CZ 3.77Å; E234-R302 IonicContact OE1-NH1 2.83Å; E234-R302 PolarHBondContact OE1-NH1 2.93Å; E234-R302 IonicContact OE1-NH2 2.87Å
235P76.6Confident68.9Low81 Ų8167.2 Ų67.253%0.52637%0.365SS..PPolyproline II helixtrans-59.2142.3-176.313.9-23.1000111S233 K237 T238 S239S233-P235 WeakPolarHBondContact O-CD 3.49Å; P235-K237 PolarHBondContact O-N 3.41Å; P235-T238 WeakPolarHBondContact CD-OG1 3.39Å; P235-T238 HydrophobicContact CG-CG2 4Å; P235-T238 WeakPolarHBondContact CG-OG1 3.44Å; P235-T238 PolarHBondContact O-N 2.86Å; P235-T238 PolarHBondContact O-OG1 3.39Å; P235-S239 PolarHBondContact O-N 3.42Å
236A76.8Confident71.5Confident38 Ų3861.4 Ų61.431%0.31434%0.34SS..Hα-helixtrans-56.7-29.1-169.600000113.6Q202 E234 L240Q202-A236 PolarHBondContact NE2-O 3.2Å; E234-A236 PolarHBondContact O-N 3.4Å; A236-L240 PolarHBondContact O-N 3.49Å; A236-L240 VanDerWaalsContact O-N 3.15Å
237K82.2Confident73.9Confident173 Ų17355.6 Ų55.675%0.75232%0.321SS*.Hα-helixtrans-67.9-49.3173.7-173.5179.9178-175.70112.2P235 L240 Q241P235-K237 PolarHBondContact O-N 3.41Å; K237-L240 PolarHBondContact O-N 3.37Å; K237-Q241 WeakPolarHBondContact O-CB 3.49Å; K237-Q241 PolarHBondContact O-N 3.42Å
238T85.1Confident76.3Confident41 Ų4152 Ų5225%0.25231%0.314SS..Hα-helixtrans-69.8-36.7179.260.80000111.2P235 L240 Q241 I242P235-T238 WeakPolarHBondContact CD-OG1 3.39Å; P235-T238 HydrophobicContact CG-CG2 4Å; P235-T238 WeakPolarHBondContact CG-OG1 3.44Å; P235-T238 PolarHBondContact O-N 2.86Å; P235-T238 PolarHBondContact O-OG1 3.39Å; T238-L240 PolarHBondContact O-N 2.91Å; T238-Q241 PolarHBondContact O-N 3.33Å; T238-I242 WeakPolarHBondContact O-CB 3.42Å; T238-I242 VanDerWaalsContact O-CD1 3.25Å; T238-I242 WeakPolarHBondContact O-CD1 3.17Å; T238-I242 WeakPolarHBondContact O-CG1 3.24Å; T238-I242 PolarHBondContact O-N 3.32Å
239S86.5Confident78.6Confident26 Ų2651 Ų5118%0.18231%0.307CS..Hα-helixtrans-58.5-46.8175.2-170.20000111R108 P235 I242 T243R108-S239 PolarHBondContact NH2-O 2.92Å; R108-S239 PolarHBondContact NH2-OG 2.93Å; P235-S239 PolarHBondContact O-N 3.42Å; S239-I242 PolarHBondContact O-N 3.34Å; S239-T243 PolarHBondContact O-N 2.82Å; S239-T243 PolarHBondContact O-OG1 3.02Å
240L88.5Confident81Confident57 Ų5746.7 Ų46.730%0.29828%0.277SS..Hα-helixtrans-65.4-44.4174.2-177.975000112.8L199 Q202 A236 K237 T238 I242 T243 G244L199-L240 HydrophobicContact CD2-CD1 3.99Å; Q202-L240 VanDerWaalsContact NE2-CB 3.28Å; A236-L240 PolarHBondContact O-N 3.49Å; A236-L240 VanDerWaalsContact O-N 3.15Å; K237-L240 PolarHBondContact O-N 3.37Å; T238-L240 PolarHBondContact O-N 2.91Å; L240-I242 VanDerWaalsContact C-N 3.26Å; L240-I242 PolarHBondContact O-N 2.92Å; L240-T243 PolarHBondContact O-N 3.01Å; L240-G244 PolarHBondContact O-N 2.94Å
241Q91.5Very high83.1Confident61 Ų6149.2 Ų49.229%0.28529%0.285SS..Hα-helixtrans-56.8-41.9178.8-173174.216.100111.5K237 T238 L245 D301K237-Q241 WeakPolarHBondContact O-CB 3.49Å; K237-Q241 PolarHBondContact O-N 3.42Å; T238-Q241 PolarHBondContact O-N 3.33Å; Q241-L245 WeakPolarHBondContact O-CB 3.48Å; Q241-L245 PolarHBondContact O-N 3.34Å; Q241-D301 PolarHBondContact NE2-OD2 3.08Å
242I91.1Very high85.7Confident4 Ų446 Ų462%0.02127%0.267CS..Hα-helixtrans-74.5-40179.5-64.1158.9000111.7L42 T238 S239 L240 L245 V246L42-I242 HydrophobicContact CD2-CG2 3.42Å; L42-I242 VanDerWaalsContact CD2-CG2 3.42Å; T238-I242 WeakPolarHBondContact O-CB 3.42Å; T238-I242 VanDerWaalsContact O-CD1 3.25Å; T238-I242 WeakPolarHBondContact O-CD1 3.17Å; T238-I242 WeakPolarHBondContact O-CG1 3.24Å; T238-I242 PolarHBondContact O-N 3.32Å; S239-I242 PolarHBondContact O-N 3.34Å; L240-I242 VanDerWaalsContact C-N 3.26Å; L240-I242 PolarHBondContact O-N 2.92Å; I242-L245 PolarHBondContact O-N 3.48Å; I242-V246 WeakPolarHBondContact O-CG2 3.3Å; I242-V246 PolarHBondContact O-N 2.91Å
243T93.1Very high87.8Confident1 Ų143.5 Ų43.51%0.00624%0.241CC..Hα-helixtrans-63.7-44.7174-53.70000110.5R108 A194 L195 T198 S239 L240 L245 V246 T247R108-T243 HydrophobicContact CG-CG2 4.45Å; R108-T243 PolarHBondContact NE-OG1 3Å; R108-T243 PolarHBondContact NH2-OG1 3.11Å; A194-T243 HydrophobicContact CB-CG2 4.31Å; L195-T243 HydrophobicContact CD1-CG2 4.37Å; T198-T243 HydrophobicContact CG2-CG2 4.38Å; T198-T243 WeakPolarHBondContact CG2-OG1 3.28Å; S239-T243 PolarHBondContact O-N 2.82Å; S239-T243 PolarHBondContact O-OG1 3.02Å; L240-T243 PolarHBondContact O-N 3.01Å; T243-L245 VanDerWaalsContact C-N 3.35Å; T243-L245 PolarHBondContact O-N 3.26Å; T243-V246 PolarHBondContact O-N 3.24Å; T243-T247 WeakPolarHBondContact O-CB 3.19Å; T243-T247 PolarHBondContact O-N 2.92Å; T243-T247 PolarHBondContact O-OG1 3.42Å
244G93.4Very high89.6Confident27 Ų2741.9 Ų41.928%0.27823%0.228SC..Hα-helixtrans-59-43.1175.600000112.5L240 T247 T248L240-G244 PolarHBondContact O-N 2.94Å; G244-T247 PolarHBondContact O-N 3.46Å; G244-T248 VanDerWaalsContact O-CB 3.31Å; G244-T248 WeakPolarHBondContact O-CB 3.33Å; G244-T248 PolarHBondContact O-N 3.03Å; G244-T248 PolarHBondContact O-OG1 2.83Å
245L94.1Very high90.8Very high11 Ų1142.3 Ų42.36%0.05824%0.236CC..Hα-helixtrans-57-54.3172173.764.5000111.8Q241 I242 T243 T247 T248 I249 F296 C300 Y303Q241-L245 WeakPolarHBondContact O-CB 3.48Å; Q241-L245 PolarHBondContact O-N 3.34Å; I242-L245 PolarHBondContact O-N 3.48Å; T243-L245 VanDerWaalsContact C-N 3.35Å; T243-L245 PolarHBondContact O-N 3.26Å; L245-T247 VanDerWaalsContact C-N 3.33Å; L245-T247 PolarHBondContact O-N 3.47Å; L245-T248 WeakPolarHBondContact O-CB 3.3Å; L245-T248 PolarHBondContact O-N 2.92Å; L245-T248 VanDerWaalsContact O-N 3.11Å; L245-I249 HydrophobicContact CD1-CD1 3.81Å; L245-I249 HydrophobicContact CD1-CG1 4.14Å; L245-I249 HydrophobicContact CG-CD1 3.85Å; L245-I249 WeakPolarHBondContact O-CG1 3.49Å; L245-I249 PolarHBondContact O-N 3.49Å; L245-F296 HydrophobicContact CD1-CB 3.75Å; L245-F296 WeakPolarHBondContact CD1-O 3.32Å; L245-C300 HydrophobicContact CD2-CB 4.38Å; L245-Y303 HydrophobicContact CD2-CD2 4.02Å; L245-Y303 HydrophobicContact CD2-CE2 3.66Å
246V95.3Very high91.3Very high3 Ų341.1 Ų41.12%0.01823%0.225CC..Hα-helixtrans-60.4-44.2-179.8173.40000110.5L42 R108 I242 T243 T248 I249 V250L42-V246 HydrophobicContact CD1-CG2 4.3Å; R108-V246 HydrophobicContact CB-CG1 4.18Å; R108-V246 HydrophobicContact CG-CG2 4.5Å; I242-V246 WeakPolarHBondContact O-CG2 3.3Å; I242-V246 PolarHBondContact O-N 2.91Å; T243-V246 PolarHBondContact O-N 3.24Å; V246-T248 VanDerWaalsContact C-N 3.29Å; V246-T248 PolarHBondContact O-N 3.5Å; V246-I249 PolarHBondContact O-N 2.88Å; V246-V250 HydrophobicContact CG1-CG2 4.19Å; V246-V250 WeakPolarHBondContact O-CB 3.37Å; V246-V250 WeakPolarHBondContact O-CG2 3.4Å; V246-V250 PolarHBondContact O-N 3.03Å
247T96.1Very high91.8Very high29 Ų2939.5 Ų39.518%0.17821%0.211CC..Hα-helixtrans-57.7-41.5174.2-60.40000112.3T191 L195 T243 G244 L245 F251T191-T247 HydrophobicContact CG2-CG2 3.8Å; T191-T247 WeakPolarHBondContact CG2-OG1 3.19Å; L195-T247 HydrophobicContact CD2-CG2 4.27Å; T243-T247 WeakPolarHBondContact O-CB 3.19Å; T243-T247 PolarHBondContact O-N 2.92Å; T243-T247 PolarHBondContact O-OG1 3.42Å; G244-T247 PolarHBondContact O-N 3.46Å; L245-T247 VanDerWaalsContact C-N 3.33Å; L245-T247 PolarHBondContact O-N 3.47Å; T247-F251 VanDerWaalsContact O-CB 3.23Å; T247-F251 WeakPolarHBondContact O-CB 3.21Å; T247-F251 PolarHBondContact O-N 2.83Å
248T95.3Very high92Very high60 Ų6031.3 Ų31.337%0.36818%0.176SC..Hα-helixtrans-68.3-44.2-179.7-58.40000111G244 L245 V246 I252 F296G244-T248 VanDerWaalsContact O-CB 3.31Å; G244-T248 WeakPolarHBondContact O-CB 3.33Å; G244-T248 PolarHBondContact O-N 3.03Å; G244-T248 PolarHBondContact O-OG1 2.83Å; L245-T248 WeakPolarHBondContact O-CB 3.3Å; L245-T248 PolarHBondContact O-N 2.92Å; L245-T248 VanDerWaalsContact O-N 3.11Å; V246-T248 VanDerWaalsContact C-N 3.29Å; V246-T248 PolarHBondContact O-N 3.5Å; T248-I252 HydrophobicContact CG2-CD1 3.66Å; T248-I252 VanDerWaalsContact O-CB 3.31Å; T248-I252 WeakPolarHBondContact O-CB 3.47Å; T248-I252 VanDerWaalsContact O-CG1 3.3Å; T248-I252 WeakPolarHBondContact O-CG1 3.21Å; T248-I252 PolarHBondContact O-N 2.76Å; T248-F296 HydrophobicContact CG2-CD1 4.29Å; T248-F296 HydrophobicContact CG2-CE1 4Å; T248-F296 HydrophobicContact CG2-CZ 4.49Å
249I95.1Very high92.2Very high2 Ų235.9 Ų35.91%0.0119%0.192CC..Hα-helixtrans-58.5-54.2174.8-67.8166.9000109.9L46 L245 V246 I252 Y253 L293 F296L46-I249 HydrophobicContact CD2-CD1 3.95Å; L245-I249 HydrophobicContact CD1-CD1 3.81Å; L245-I249 HydrophobicContact CD1-CG1 4.14Å; L245-I249 HydrophobicContact CG-CD1 3.85Å; L245-I249 WeakPolarHBondContact O-CG1 3.49Å; L245-I249 PolarHBondContact O-N 3.49Å; V246-I249 PolarHBondContact O-N 2.88Å; I249-I252 PolarHBondContact O-N 3.08Å; I249-Y253 HydrophobicContact CG2-CD1 4.12Å; I249-Y253 HydrophobicContact CG2-CE1 4.19Å; I249-Y253 HydrophobicContact CG2-CG 4.45Å; I249-Y253 VanDerWaalsContact O-CB 3.27Å; I249-Y253 WeakPolarHBondContact O-CB 3.22Å; I249-Y253 WeakPolarHBondContact O-CD1 3.27Å; I249-Y253 PolarHBondContact O-N 2.89Å; I249-L293 HydrophobicContact CD1-CD1 4.27Å; I249-F296 HydrophobicContact CG1-CB 4.23Å; I249-F296 HydrophobicContact CG1-CD2 3.69Å; I249-F296 HydrophobicContact CG1-CE2 4.35Å; I249-F296 HydrophobicContact CG1-CG 4.19Å
250V95.7Very high92.4Very high2 Ų235.7 Ų35.71%0.01219%0.19CC..Hα-helixtrans-59.1-54.4-176.9174.70000110.5V101 S105 V246 I252 Y253 D254V101-V250 HydrophobicContact CG1-CB 4.11Å; V101-V250 HydrophobicContact CG1-CG1 4.18Å; V101-V250 HydrophobicContact CG1-CG2 3.71Å; S105-V250 WeakPolarHBondContact OG-CG2 3.49Å; V246-V250 HydrophobicContact CG1-CG2 4.19Å; V246-V250 WeakPolarHBondContact O-CB 3.37Å; V246-V250 WeakPolarHBondContact O-CG2 3.4Å; V246-V250 PolarHBondContact O-N 3.03Å; V250-I252 PolarHBondContact O-N 3.14Å; V250-Y253 PolarHBondContact O-N 3.31Å; V250-D254 WeakPolarHBondContact CG1-OD2 3.37Å; V250-D254 WeakPolarHBondContact O-CB 3.47Å; V250-D254 PolarHBondContact O-N 2.67Å
251F95Very high92.5Very high140 Ų14033.3 Ų33.361%0.61418%0.178SC*.Hα-helixtrans-57.5-46.5-179.7178.9-102.3000112.5T247 C255T247-F251 VanDerWaalsContact O-CB 3.23Å; T247-F251 WeakPolarHBondContact O-CB 3.21Å; T247-F251 PolarHBondContact O-N 2.83Å; F251-C255 WeakPolarHBondContact O-CB 3.32Å; F251-C255 PolarHBondContact O-N 3.4Å; F251-C255 PolarHBondContact O-SG 2.95Å
252I95Very high92.5Very high45 Ų4532.2 Ų32.223%0.23117%0.174CC..Hα-helixtrans-71-34.2-178.2-67173.8000111.4T248 I249 V250 C255 L256 L292 F296T248-I252 HydrophobicContact CG2-CD1 3.66Å; T248-I252 VanDerWaalsContact O-CB 3.31Å; T248-I252 WeakPolarHBondContact O-CB 3.47Å; T248-I252 VanDerWaalsContact O-CG1 3.3Å; T248-I252 WeakPolarHBondContact O-CG1 3.21Å; T248-I252 PolarHBondContact O-N 2.76Å; I249-I252 PolarHBondContact O-N 3.08Å; V250-I252 PolarHBondContact O-N 3.14Å; I252-C255 PolarHBondContact O-N 2.98Å; I252-L256 HydrophobicContact CG2-CD1 3.5Å; I252-L256 HydrophobicContact CG2-CG 4.01Å; I252-L256 VanDerWaalsContact O-CB 3.23Å; I252-L256 WeakPolarHBondContact O-CB 3.35Å; I252-L256 VanDerWaalsContact O-CG 3.27Å; I252-L256 WeakPolarHBondContact O-CG 3.22Å; I252-L256 PolarHBondContact O-N 3.3Å; I252-L292 HydrophobicContact CG2-CD1 3.95Å; I252-F296 HydrophobicContact CB-CZ 4.09Å; I252-F296 HydrophobicContact CD1-CE1 3.75Å; I252-F296 HydrophobicContact CD1-CZ 3.49Å; I252-F296 VanDerWaalsContact CD1-CZ 3.49Å; I252-F296 HydrophobicContact CG1-CZ 4.36Å; I252-F296 HydrophobicContact CG2-CZ 3.96Å
253Y95Very high92.6Very high4 Ų434.9 Ų34.92%0.01619%0.19CC..Hα-helixtrans-71.1-41.3177.1-85.447.3000112.1L49 H53 T97 V101 I249 V250 C255 L256 M257 G258 Q289 L293 F296L49-Y253 HydrophobicContact CD1-CE2 4.4Å; L49-Y253 HydrophobicContact CD2-CE2 4.2Å; H53-Y253 AromaticContact CE1-CE2 3.51Å; H53-Y253 AromaticContact CE1-CZ 3.9Å; H53-Y253 PolarHBondContact CE1-OH 3.29Å; H53-Y253 AromaticContact NE2-CE2 3.24Å; H53-Y253 WeakPolarHBondContact NE2-CE2 3.22Å; H53-Y253 AromaticContact NE2-CZ 3.41Å; H53-Y253 PolarHBondContact NE2-OH 2.95Å; T97-Y253 HydrophobicContact CG2-CD2 4.12Å; T97-Y253 HydrophobicContact CG2-CE2 4.14Å; V101-Y253 HydrophobicContact CG2-CD2 3.56Å; V101-Y253 HydrophobicContact CG2-CE2 4.19Å; V101-Y253 HydrophobicContact CG2-CG 4.2Å; I249-Y253 HydrophobicContact CG2-CD1 4.12Å; I249-Y253 HydrophobicContact CG2-CE1 4.19Å; I249-Y253 HydrophobicContact CG2-CG 4.45Å; I249-Y253 VanDerWaalsContact O-CB 3.27Å; I249-Y253 WeakPolarHBondContact O-CB 3.22Å; I249-Y253 WeakPolarHBondContact O-CD1 3.27Å; I249-Y253 PolarHBondContact O-N 2.89Å; V250-Y253 PolarHBondContact O-N 3.31Å; Y253-C255 VanDerWaalsContact C-N 3.33Å; Y253-L256 PolarHBondContact O-N 2.88Å; Y253-M257 PolarHBondContact O-N 3.43Å; Y253-G258 PolarHBondContact O-N 3.4Å; Y253-G258 VanDerWaalsContact O-N 3.14Å; Y253-Q289 HydrophobicContact CE2-CB 4.37Å; Y253-Q289 PolarHBondContact OH-O 2.61Å; Y253-L293 WeakPolarHBondContact OH-CB 3.37Å; Y253-F296 HydrophobicContact CE1-CE2 4.06Å
254D93.4Very high92.5Very high21 Ų2135.1 Ų35.111%0.11219%0.192CC..Iπ-helixtrans-63.6-40.9174.2-66.3-22.5000110.4V184 V188 V250 G258 F259V184-D254 HydrophobicContact CG1-CB 4.16Å; V188-D254 VanDerWaalsContact CG2-OD2 3.29Å; V188-D254 WeakPolarHBondContact CG2-OD2 3.42Å; V250-D254 WeakPolarHBondContact CG1-OD2 3.37Å; V250-D254 WeakPolarHBondContact O-CB 3.47Å; V250-D254 PolarHBondContact O-N 2.67Å; D254-G258 CarbonylContact O-C 3.59Å; D254-G258 PolarHBondContact O-N 2.96Å; D254-F259 WeakPolarHBondContact O-CB 3.46Å; D254-F259 PolarHBondContact O-N 2.73Å
255C92.2Very high92.3Very high63 Ų6334 Ų3443%0.42618%0.18SC..Iπ-helixtrans-70.5-39.3175.9-72.40000114.1F251 I252 Y253 P260F251-C255 WeakPolarHBondContact O-CB 3.32Å; F251-C255 PolarHBondContact O-N 3.4Å; F251-C255 PolarHBondContact O-SG 2.95Å; I252-C255 PolarHBondContact O-N 2.98Å; Y253-C255 VanDerWaalsContact C-N 3.33Å; C255-P260 VanDerWaalsContact O-CD 3.22Å; C255-P260 WeakPolarHBondContact O-CD 3.38Å; C255-P260 WeakPolarHBondContact O-CG 3.2Å
256L87.3Confident92.1Very high55 Ų5539 Ų3929%0.28820%0.201SC..Iπ-helixtrans-86.4-21.7-175.4-71.6179.3000113.9I252 Y253 P260 C285 Q289 L292I252-L256 HydrophobicContact CG2-CD1 3.5Å; I252-L256 HydrophobicContact CG2-CG 4.01Å; I252-L256 VanDerWaalsContact O-CB 3.23Å; I252-L256 WeakPolarHBondContact O-CB 3.35Å; I252-L256 VanDerWaalsContact O-CG 3.27Å; I252-L256 WeakPolarHBondContact O-CG 3.22Å; I252-L256 PolarHBondContact O-N 3.3Å; Y253-L256 PolarHBondContact O-N 2.88Å; L256-P260 WeakPolarHBondContact O-CG 3.39Å; L256-C285 WeakPolarHBondContact O-CB 3.4Å; L256-C285 PolarHBondContact O-SG 3.22Å; L256-Q289 HydrophobicContact CB-CG 4.34Å; L256-L292 HydrophobicContact CD1-CD1 3.19Å
257M86.5Confident91.8Very high5 Ų541.4 Ų41.43%0.02522%0.218CC..Iπ-helixtrans-140.8-46.4-174.2175.4-106.4-156.600113.3T94 T97 Y253 F259 V261 Q289T94-M257 HydrophobicContact CG2-CE 3.63Å; T97-M257 HydrophobicContact CG2-CE 4.34Å; Y253-M257 PolarHBondContact O-N 3.43Å; M257-F259 PolarHBondContact O-N 2.94Å; M257-V261 HydrophobicContact CG-CG2 4Å; M257-V261 WeakPolarHBondContact O-CB 3.25Å; M257-V261 WeakPolarHBondContact O-CG2 3.27Å; M257-V261 PolarHBondContact O-N 3.27Å; M257-Q289 HydrophobicContact CB-CG 4.15Å
258G87.2Confident91.3Very high1 Ų140 Ų401%0.0121%0.21CC..Iπ-helixtrans-53.5-58177.600000111.8Y253 D254 L262Y253-G258 PolarHBondContact O-N 3.4Å; Y253-G258 VanDerWaalsContact O-N 3.14Å; D254-G258 CarbonylContact O-C 3.59Å; D254-G258 PolarHBondContact O-N 2.96Å; G258-L262 VanDerWaalsContact O-CB 3.32Å; G258-L262 WeakPolarHBondContact O-CB 3.43Å; G258-L262 WeakPolarHBondContact O-CD1 3.28Å; G258-L262 WeakPolarHBondContact O-CG 3.4Å; G258-L262 PolarHBondContact O-N 3.48Å
259F89.8Confident90.9Very high136 Ų13638.7 Ų38.760%0.59620%0.2SC*.Hα-helixtrans-67.3-48.8179.2179.8-96.7000113.3D254 M257 V261 L262 V263D254-F259 WeakPolarHBondContact O-CB 3.46Å; D254-F259 PolarHBondContact O-N 2.73Å; M257-F259 PolarHBondContact O-N 2.94Å; F259-V261 PolarHBondContact O-N 3.25Å; F259-L262 PolarHBondContact O-N 3.46Å; F259-V263 HydrophobicContact CD1-CG2 4.16Å; F259-V263 HydrophobicContact CD2-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.82Å; F259-V263 HydrophobicContact CE2-CG2 3.73Å; F259-V263 HydrophobicContact CG-CG2 4.29Å; F259-V263 HydrophobicContact CZ-CG2 3.6Å; F259-V263 WeakPolarHBondContact O-CB 3.44Å; F259-V263 VanDerWaalsContact O-CG2 3.31Å; F259-V263 WeakPolarHBondContact O-CG2 3.4Å; F259-V263 PolarHBondContact O-N 2.89Å
260P90.9Very high90.6Very high22 Ų2248.4 Ų48.414%0.14324%0.237CC..Hα-helixtrans-58.5-42.9175.7-30.539.4000114.3C255 L256 V263 V264C255-P260 VanDerWaalsContact O-CD 3.22Å; C255-P260 WeakPolarHBondContact O-CD 3.38Å; C255-P260 WeakPolarHBondContact O-CG 3.2Å; L256-P260 WeakPolarHBondContact O-CG 3.39Å; P260-V263 PolarHBondContact O-N 3.37Å; P260-V264 WeakPolarHBondContact O-CB 3.19Å; P260-V264 VanDerWaalsContact O-CG2 3.28Å; P260-V264 WeakPolarHBondContact O-CG2 3.2Å; P260-V264 PolarHBondContact O-N 3.03Å
261V89.8Confident90Very high7 Ų751.5 Ų51.54%0.04226%0.263CS..Hα-helixtrans-66.8-42.1177.5171.70000111F176 M257 F259 S265 V282F176-V261 HydrophobicContact CE1-CG1 3.74Å; F176-V261 HydrophobicContact CZ-CG1 3.85Å; M257-V261 HydrophobicContact CG-CG2 4Å; M257-V261 WeakPolarHBondContact O-CB 3.25Å; M257-V261 WeakPolarHBondContact O-CG2 3.27Å; M257-V261 PolarHBondContact O-N 3.27Å; F259-V261 PolarHBondContact O-N 3.25Å; V261-S265 WeakPolarHBondContact O-CB 3.37Å; V261-S265 PolarHBondContact O-N 3.46Å; V261-S265 PolarHBondContact O-OG 2.88Å; V261-V282 HydrophobicContact CG2-CG1 4.15Å; V261-V282 HydrophobicContact CG2-CG2 4.29Å
262L92Very high89.4Confident38 Ų3851.6 Ų51.620%0.19927%0.269CS..Hα-helixtrans-62.1-47.9175.3-73.6169.8000111.8L177 V180 G258 F259 S265 F266L177-L262 HydrophobicContact CD2-CD2 3.62Å; V180-L262 HydrophobicContact CB-CD2 3.95Å; V180-L262 HydrophobicContact CB-CG 4.48Å; V180-L262 HydrophobicContact CG1-CD1 4.32Å; V180-L262 HydrophobicContact CG1-CD2 3.86Å; V180-L262 HydrophobicContact CG1-CG 3.83Å; G258-L262 VanDerWaalsContact O-CB 3.32Å; G258-L262 WeakPolarHBondContact O-CB 3.43Å; G258-L262 WeakPolarHBondContact O-CD1 3.28Å; G258-L262 WeakPolarHBondContact O-CG 3.4Å; G258-L262 PolarHBondContact O-N 3.48Å; F259-L262 PolarHBondContact O-N 3.46Å; L262-S265 PolarHBondContact O-N 2.64Å; L262-F266 WeakPolarHBondContact O-CB 3.4Å; L262-F266 PolarHBondContact O-N 3.29Å
263V92.1Very high88.4Confident60 Ų6051.8 Ų51.836%0.36428%0.278SS..Hα-helixtrans-63.5-48.4178.8170.80000110.8F259 P260 S265 F266 S267F259-V263 HydrophobicContact CD1-CG2 4.16Å; F259-V263 HydrophobicContact CD2-CG2 4.08Å; F259-V263 HydrophobicContact CE1-CG2 3.82Å; F259-V263 HydrophobicContact CE2-CG2 3.73Å; F259-V263 HydrophobicContact CG-CG2 4.29Å; F259-V263 HydrophobicContact CZ-CG2 3.6Å; F259-V263 WeakPolarHBondContact O-CB 3.44Å; F259-V263 VanDerWaalsContact O-CG2 3.31Å; F259-V263 WeakPolarHBondContact O-CG2 3.4Å; F259-V263 PolarHBondContact O-N 2.89Å; P260-V263 PolarHBondContact O-N 3.37Å; V263-S265 PolarHBondContact O-N 3.25Å; V263-F266 PolarHBondContact O-N 2.95Å; V263-S267 WeakPolarHBondContact O-CB 3.39Å; V263-S267 PolarHBondContact O-N 3.34Å; V263-S267 PolarHBondContact O-OG 2.91Å
264V91Very high87.6Confident6 Ų653.2 Ų53.24%0.03629%0.289CS..Hα-helixtrans-59-48.5177.2159.60000111.2P260 S267 S268 W277 M278 V282P260-V264 WeakPolarHBondContact O-CB 3.19Å; P260-V264 VanDerWaalsContact O-CG2 3.28Å; P260-V264 WeakPolarHBondContact O-CG2 3.2Å; P260-V264 PolarHBondContact O-N 3.03Å; V264-S267 PolarHBondContact O-N 3.45Å; V264-S268 WeakPolarHBondContact O-CB 3.18Å; V264-S268 PolarHBondContact O-N 2.85Å; V264-W277 HydrophobicContact CG2-CZ3 4.45Å; V264-M278 HydrophobicContact CB-CE 4.42Å; V264-M278 HydrophobicContact CG1-CB 3.87Å; V264-M278 HydrophobicContact CG1-CE 3.92Å; V264-M278 HydrophobicContact CG2-CB 4.36Å; V264-M278 WeakPolarHBondContact O-CE 3.24Å; V264-V282 HydrophobicContact CB-CG2 4.2Å; V264-V282 HydrophobicContact CG1-CG2 3.93Å; V264-V282 HydrophobicContact CG2-CG2 4.19Å
265S89.6Confident87Confident4 Ų453.7 Ų53.73%0.02830%0.295CS..Hα-helixtrans-66.5-43.6-177.4-55.50000111.6V165 V261 L262 V263 S268 L269V165-S265 WeakPolarHBondContact CG2-OG 3.27Å; V261-S265 WeakPolarHBondContact O-CB 3.37Å; V261-S265 PolarHBondContact O-N 3.46Å; V261-S265 PolarHBondContact O-OG 2.88Å; L262-S265 PolarHBondContact O-N 2.64Å; V263-S265 PolarHBondContact O-N 3.25Å; S265-S268 PolarHBondContact O-N 3.37Å; S265-L269 WeakPolarHBondContact O-CB 3.35Å; S265-L269 WeakPolarHBondContact O-CG 3.47Å; S265-L269 PolarHBondContact O-N 2.95Å
266F90.3Very high86.4Confident117 Ų11755.8 Ų55.851%0.51331%0.308SS..Hα-helixtrans-65.9-45.5176.4178.1-98.7000112.4L177 L262 V263 S268 L269 R270L177-F266 HydrophobicContact CD1-CB 4.28Å; L177-F266 HydrophobicContact CD1-CD2 4.47Å; L177-F266 HydrophobicContact CD2-CB 4.44Å; L262-F266 WeakPolarHBondContact O-CB 3.4Å; L262-F266 PolarHBondContact O-N 3.29Å; V263-F266 PolarHBondContact O-N 2.95Å; F266-S268 VanDerWaalsContact C-N 3.31Å; F266-S268 PolarHBondContact O-N 2.96Å; F266-L269 PolarHBondContact O-N 2.89Å; F266-R270 VanDerWaalsContact O-CB 3.27Å; F266-R270 WeakPolarHBondContact O-CB 2.98Å; F266-R270 PolarHBondContact O-N 3.2Å
267S88.5Confident86.2Confident53 Ų5360.3 Ų60.337%0.37132%0.321SS..Hα-helixtrans-62-39.3176.8-70.60000111.9V263 V264 A271V263-S267 WeakPolarHBondContact O-CB 3.39Å; V263-S267 PolarHBondContact O-N 3.34Å; V263-S267 PolarHBondContact O-OG 2.91Å; V264-S267 PolarHBondContact O-N 3.45Å; S267-A271 VanDerWaalsContact O-CB 3.25Å; S267-A271 WeakPolarHBondContact O-CB 3.48Å; S267-A271 PolarHBondContact O-N 3.37Å
268S86.6Confident86.3Confident0 Ų060.5 Ų60.50%032%0.322CS..Hα-helixtrans-66.3-50.7177.2-153.40000111I164 A166 V264 S265 F266 R270 A271 D272 A273I164-S268 WeakPolarHBondContact CG2-OG 3.05Å; A166-S268 WeakPolarHBondContact CB-O 3.26Å; A166-S268 WeakPolarHBondContact CB-OG 3.48Å; V264-S268 WeakPolarHBondContact O-CB 3.18Å; V264-S268 PolarHBondContact O-N 2.85Å; S265-S268 PolarHBondContact O-N 3.37Å; F266-S268 VanDerWaalsContact C-N 3.31Å; F266-S268 PolarHBondContact O-N 2.96Å; S268-R270 VanDerWaalsContact C-N 3.25Å; S268-R270 PolarHBondContact O-N 3.12Å; S268-A271 PolarHBondContact O-N 2.86Å; S268-D272 PolarHBondContact O-N 2.88Å; S268-A273 WeakPolarHBondContact CA-O 3.24Å; S268-A273 PolarHBondContact O-N 3.48Å; S268-A273 PolarHBondContact OG-O 2.95Å
269L86.2Confident86.2Confident32 Ų3260.8 Ų60.817%0.16833%0.325CS..Hα-helixtrans-61.3-32.7178.7-76.6165.6000112.9V165 L170 L177 S265 F266V165-L269 HydrophobicContact CG1-CD1 3.75Å; V165-L269 HydrophobicContact CG1-CD2 4.17Å; V165-L269 HydrophobicContact CG1-CG 3.95Å; L170-L269 HydrophobicContact CD1-CD2 4.12Å; L177-L269 HydrophobicContact CD1-CD1 3.59Å; L177-L269 HydrophobicContact CG-CD1 4.34Å; S265-L269 WeakPolarHBondContact O-CB 3.35Å; S265-L269 WeakPolarHBondContact O-CG 3.47Å; S265-L269 PolarHBondContact O-N 2.95Å; F266-L269 PolarHBondContact O-N 2.89Å
270R88.3Confident86.1Confident205 Ų20556.6 Ų56.677%0.77431%0.308SS*.Hα-helixtrans-75.6-34.8176.9-177.7179.2177.3-160.6-1.6112.9F266 S268F266-R270 VanDerWaalsContact O-CB 3.27Å; F266-R270 WeakPolarHBondContact O-CB 2.98Å; F266-R270 PolarHBondContact O-N 3.2Å; S268-R270 VanDerWaalsContact C-N 3.25Å; S268-R270 PolarHBondContact O-N 3.12Å
271A84.2Confident86Confident68 Ų6857.6 Ų57.656%0.56232%0.315SS*.Hα-helixtrans-88-9.5-178.300000113.3S267 S268 A273S267-A271 VanDerWaalsContact O-CB 3.25Å; S267-A271 WeakPolarHBondContact O-CB 3.48Å; S267-A271 PolarHBondContact O-N 3.37Å; S268-A271 PolarHBondContact O-N 2.86Å; A271-A273 HydrophobicContact CB-CB 4.31Å; A271-A273 PolarHBondContact O-N 3.15Å
272D81.2Confident86Confident141 Ų14157.6 Ų57.675%0.75432%0.315SS*.THydrogen-bonded Turntrans47.738.1-169.4-151.922.6000112.9S268S268-D272 PolarHBondContact O-N 2.88Å
273A75.3Confident86Confident50 Ų5055.9 Ų55.941%0.41331%0.306SS..  trans-152.2144.8-171.900000110.7S268 A271S268-A273 WeakPolarHBondContact CA-O 3.24Å; S268-A273 PolarHBondContact O-N 3.48Å; S268-A273 PolarHBondContact OG-O 2.95Å; A271-A273 HydrophobicContact CB-CB 4.31Å; A271-A273 PolarHBondContact O-N 3.15Å
274S76.8Confident86Confident34 Ų3457.6 Ų57.624%0.23831%0.306CS..  trans-111.9133.2170.180.20000111.2E167E167-S274 VanDerWaalsContact OE1-CB 3.28Å; E167-S274 WeakPolarHBondContact OE1-CB 3.36Å; E167-S274 PolarHBondContact OE1-OG 3.39Å
275A81.4Confident86.1Confident30 Ų3058.3 Ų58.325%0.24831%0.311CS..  trans-107.6142.917700000110.4W277 M278A275-W277 HydrophobicContact CB-CG 4.43Å; A275-W277 VanDerWaalsContact CB-NE1 3.33Å; A275-W277 PolarHBondContact O-N 2.87Å; A275-W277 VanDerWaalsContact O-N 3.14Å; A275-M278 HydrophobicContact CB-CG 4.12Å; A275-M278 HydrophobicContact CB-SD 3.76Å; A275-M278 PolarHBondContact N-SD 3.04Å; A275-M278 VanDerWaalsContact O-CB 3.24Å; A275-M278 WeakPolarHBondContact O-CB 3.36Å; A275-M278 WeakPolarHBondContact O-CG 3.25Å; A275-M278 PolarHBondContact O-N 3.39Å
276P80.3Confident86.3Confident107 Ų10758.2 Ų58.270%0.69531%0.31SS*.Hα-helixtrans-62.5-29.5-172.123.4-34000113.3M278 A279 L280P276-M278 PolarHBondContact O-N 2.94Å; P276-A279 PolarHBondContact O-N 2.93Å; P276-L280 WeakPolarHBondContact O-CG 3.29Å; P276-L280 PolarHBondContact O-N 3.49Å
277W83.4Confident86.5Confident151 Ų15152.7 Ų52.757%0.57229%0.287SS*.Hα-helixtrans-63.8-25.5175.970.1-99.3000113.1V264 A275 L280 C281V264-W277 HydrophobicContact CG2-CZ3 4.45Å; A275-W277 HydrophobicContact CB-CG 4.43Å; A275-W277 VanDerWaalsContact CB-NE1 3.33Å; A275-W277 PolarHBondContact O-N 2.87Å; A275-W277 VanDerWaalsContact O-N 3.14Å; W277-L280 PolarHBondContact O-N 2.94Å; W277-C281 HydrophobicContact CE3-CB 4.47Å; W277-C281 WeakPolarHBondContact O-CB 3.37Å; W277-C281 PolarHBondContact O-N 2.88Å
278M87.8Confident86.8Confident8 Ų851.8 Ų51.84%0.03928%0.282CS..Hα-helixtrans-68.4-43.5-179.3-60.916981.700110.6I164 V264 A275 P276 C281 V282I164-M278 HydrophobicContact CD1-CB 4.45Å; V264-M278 HydrophobicContact CB-CE 4.42Å; V264-M278 HydrophobicContact CG1-CB 3.87Å; V264-M278 HydrophobicContact CG1-CE 3.92Å; V264-M278 HydrophobicContact CG2-CB 4.36Å; V264-M278 WeakPolarHBondContact O-CE 3.24Å; A275-M278 HydrophobicContact CB-CG 4.12Å; A275-M278 HydrophobicContact CB-SD 3.76Å; A275-M278 PolarHBondContact N-SD 3.04Å; A275-M278 VanDerWaalsContact O-CB 3.24Å; A275-M278 WeakPolarHBondContact O-CB 3.36Å; A275-M278 WeakPolarHBondContact O-CG 3.25Å; A275-M278 PolarHBondContact O-N 3.39Å; P276-M278 PolarHBondContact O-N 2.94Å; M278-C281 PolarHBondContact O-N 3.47Å; M278-V282 WeakPolarHBondContact O-CG2 3.29Å; M278-V282 PolarHBondContact O-N 2.93Å; M278-V282 VanDerWaalsContact O-N 3.09Å
279A85.3Confident87.1Confident8 Ų852 Ų527%0.06628%0.283CS..Hα-helixtrans-62.4-45.4172.200000111.5F163 I164 P276 C281 V282 L283F163-A279 HydrophobicContact CE1-CB 3.75Å; F163-A279 HydrophobicContact CZ-CB 3.77Å; I164-A279 HydrophobicContact CD1-CB 4.19Å; P276-A279 PolarHBondContact O-N 2.93Å; A279-C281 VanDerWaalsContact C-N 3.33Å; A279-C281 PolarHBondContact O-N 2.98Å; A279-V282 PolarHBondContact O-N 3.44Å; A279-L283 WeakPolarHBondContact O-CB 3.35Å; A279-L283 WeakPolarHBondContact O-CD1 3.31Å; A279-L283 WeakPolarHBondContact O-CG 3.24Å; A279-L283 PolarHBondContact O-N 3.37Å
280L87.3Confident87.6Confident47 Ų4750.4 Ų50.425%0.24628%0.275CS..Hα-helixtrans-58.4-45.1177-61.8-179.8000111.8W14 P276 W277 W284W14-L280 HydrophobicContact CH2-CD2 3.44Å; W14-L280 VanDerWaalsContact CH2-CD2 3.44Å; W14-L280 HydrophobicContact CZ2-CD2 3.57Å; P276-L280 WeakPolarHBondContact O-CG 3.29Å; P276-L280 PolarHBondContact O-N 3.49Å; W277-L280 PolarHBondContact O-N 2.94Å; L280-W284 WeakPolarHBondContact O-CB 3.45Å; L280-W284 PolarHBondContact O-N 2.99Å
281C89Confident87.9Confident44 Ų4443 Ų4330%0.29725%0.25SS..Hα-helixtrans-58.4-56178.2179.70000110.8W277 M278 A279 L283 W284 C285W277-C281 HydrophobicContact CE3-CB 4.47Å; W277-C281 WeakPolarHBondContact O-CB 3.37Å; W277-C281 PolarHBondContact O-N 2.88Å; M278-C281 PolarHBondContact O-N 3.47Å; A279-C281 VanDerWaalsContact C-N 3.33Å; A279-C281 PolarHBondContact O-N 2.98Å; C281-L283 PolarHBondContact O-N 3.3Å; C281-W284 PolarHBondContact O-N 3.41Å; C281-C285 VanDerWaalsContact O-CB 3.3Å; C281-C285 WeakPolarHBondContact O-CB 3.29Å; C281-C285 PolarHBondContact O-N 3.03Å; C281-C285 PolarHBondContact O-SG 2.83Å
282V90.1Very high88.4Confident7 Ų741.9 Ų41.94%0.04224%0.235CC..Hα-helixtrans-60.8-42-177.7172.40000112.2F90 V261 V264 M278 A279 C285 S286F90-V282 HydrophobicContact CE1-CG1 4.25Å; F90-V282 HydrophobicContact CE2-CG1 4.28Å; F90-V282 HydrophobicContact CZ-CG1 3.45Å; F90-V282 VanDerWaalsContact CZ-CG1 3.45Å; V261-V282 HydrophobicContact CG2-CG1 4.15Å; V261-V282 HydrophobicContact CG2-CG2 4.29Å; V264-V282 HydrophobicContact CB-CG2 4.2Å; V264-V282 HydrophobicContact CG1-CG2 3.93Å; V264-V282 HydrophobicContact CG2-CG2 4.19Å; M278-V282 WeakPolarHBondContact O-CG2 3.29Å; M278-V282 PolarHBondContact O-N 2.93Å; M278-V282 VanDerWaalsContact O-N 3.09Å; A279-V282 PolarHBondContact O-N 3.44Å; V282-C285 WeakPolarHBondContact O-CB 3.21Å; V282-C285 PolarHBondContact O-N 3Å; V282-S286 PolarHBondContact O-N 2.54Å; V282-S286 PolarHBondContact O-OG 3.44Å
283L91.2Very high89.1Confident1 Ų135.1 Ų35.11%0.00520%0.199CC..Hα-helixtrans-66.1-44.8178.7-68.4166.3000112.4W14 I61 Y64 F163 A279 C281 S286 V287W14-L283 HydrophobicContact CH2-CD1 4.12Å; W14-L283 HydrophobicContact CZ2-CB 4.2Å; W14-L283 HydrophobicContact CZ2-CD1 4.13Å; W14-L283 HydrophobicContact CZ3-CD1 4.49Å; I61-L283 HydrophobicContact CD1-CB 4.46Å; I61-L283 HydrophobicContact CD1-CD2 3.51Å; Y64-L283 HydrophobicContact CD1-CD1 3.43Å; Y64-L283 VanDerWaalsContact CD1-CD1 3.43Å; Y64-L283 HydrophobicContact CE1-CD1 3.28Å; Y64-L283 HydrophobicContact CE2-CD1 4.43Å; Y64-L283 HydrophobicContact CG-CD1 4.08Å; F163-L283 HydrophobicContact CE1-CD1 4.49Å; F163-L283 HydrophobicContact CZ-CD1 4.22Å; F163-L283 HydrophobicContact CZ-CD2 4.29Å; F163-L283 HydrophobicContact CZ-CG 4.12Å; A279-L283 WeakPolarHBondContact O-CB 3.35Å; A279-L283 WeakPolarHBondContact O-CD1 3.31Å; A279-L283 WeakPolarHBondContact O-CG 3.24Å; A279-L283 PolarHBondContact O-N 3.37Å; C281-L283 PolarHBondContact O-N 3.3Å; L283-S286 PolarHBondContact O-N 3.42Å; L283-V287 WeakPolarHBondContact O-CG2 3.2Å; L283-V287 PolarHBondContact O-N 2.74Å
284W92.9Very high89.9Confident97 Ų9733.6 Ų33.637%0.36719%0.185SC..Hα-helixtrans-65.2-38.7175.7-82.7116.5000112.3W14 L280 C281 V287 A288W14-W284 AromaticContact CD1-CD2 3.63Å; W14-W284 AromaticContact CD1-CE2 3.64Å; W14-W284 AromaticContact CD1-CE3 3.72Å; W14-W284 AromaticContact CD1-CH2 3.87Å; W14-W284 AromaticContact CD1-CZ2 3.77Å; W14-W284 AromaticContact CD1-CZ3 3.84Å; W14-W284 AromaticContact CE2-CE2 3.91Å; W14-W284 AromaticContact CE2-NE1 3.74Å; W14-W284 AromaticContact CZ2-NE1 3.83Å; W14-W284 AromaticContact NE1-CD1 3.48Å; W14-W284 AromaticContact NE1-CD2 3.21Å; W14-W284 AromaticContact NE1-CE2 3.11Å; W14-W284 AromaticContact NE1-CE3 3.82Å; W14-W284 AromaticContact NE1-CG 3.47Å; W14-W284 AromaticContact NE1-CZ2 3.66Å; W14-W284 AromaticContact NE1-NE1 3.27Å; L280-W284 WeakPolarHBondContact O-CB 3.45Å; L280-W284 PolarHBondContact O-N 2.99Å; C281-W284 PolarHBondContact O-N 3.41Å; W284-V287 PolarHBondContact O-N 3.46Å; W284-A288 WeakPolarHBondContact O-CB 3.26Å; W284-A288 PolarHBondContact O-N 3.47Å
285C93.4Very high90.7Very high20 Ų2036.1 Ų36.114%0.13520%0.198CC..Hα-helixtrans-57-48.3171.5-77.20000112.1L256 C281 V282 V287 A288 Q289L256-C285 WeakPolarHBondContact O-CB 3.4Å; L256-C285 PolarHBondContact O-SG 3.22Å; C281-C285 VanDerWaalsContact O-CB 3.3Å; C281-C285 WeakPolarHBondContact O-CB 3.29Å; C281-C285 PolarHBondContact O-N 3.03Å; C281-C285 PolarHBondContact O-SG 2.83Å; V282-C285 WeakPolarHBondContact O-CB 3.21Å; V282-C285 PolarHBondContact O-N 3Å; C285-V287 PolarHBondContact O-N 3.41Å; C285-A288 PolarHBondContact O-N 2.96Å; C285-Q289 WeakPolarHBondContact O-CG 3.4Å; C285-Q289 PolarHBondContact O-N 3.42Å
286S92.8Very high91.3Very high2 Ų235.7 Ų35.71%0.01419%0.191CC..Hα-helixtrans-60.8-41.3176.2-69.60000113.5V282 L283 A290V282-S286 PolarHBondContact O-N 2.54Å; V282-S286 PolarHBondContact O-OG 3.44Å; L283-S286 PolarHBondContact O-N 3.42Å; S286-A290 PolarHBondContact O-N 2.86Å
287V94.4Very high91.9Very high2 Ų231 Ų311%0.01216%0.16CC..Hα-helixtrans-67.8-40176.6172.20000111.2C17 I61 L283 W284 C285 A290 L291C17-V287 HydrophobicContact CB-CG1 3.52Å; I61-V287 HydrophobicContact CD1-CG2 4.24Å; I61-V287 HydrophobicContact CG1-CG2 4.23Å; I61-V287 HydrophobicContact CG2-CG2 3.85Å; L283-V287 WeakPolarHBondContact O-CG2 3.2Å; L283-V287 PolarHBondContact O-N 2.74Å; W284-V287 PolarHBondContact O-N 3.46Å; C285-V287 PolarHBondContact O-N 3.41Å; V287-A290 PolarHBondContact O-N 3.02Å; V287-L291 HydrophobicContact CG1-CD1 4.22Å; V287-L291 PolarHBondContact O-N 3.35Å; V287-L291 VanDerWaalsContact O-N 3.13Å
288A94.7Very high92.2Very high34 Ų3430.8 Ų30.828%0.28116%0.159SC..Hα-helixtrans-62.7-44.6177.100000112.2W284 C285 A290 L291 L292W284-A288 WeakPolarHBondContact O-CB 3.26Å; W284-A288 PolarHBondContact O-N 3.47Å; C285-A288 PolarHBondContact O-N 2.96Å; A288-A290 PolarHBondContact O-N 3.26Å; A288-L291 PolarHBondContact O-N 3.02Å; A288-L292 WeakPolarHBondContact O-CD1 3.06Å; A288-L292 VanDerWaalsContact O-CG 3.23Å; A288-L292 WeakPolarHBondContact O-CG 3.32Å; A288-L292 PolarHBondContact O-N 3Å; A288-L292 VanDerWaalsContact O-N 3.15Å
289Q93.6Very high92.3Very high3 Ų333.8 Ų33.81%0.01419%0.185CC..Hα-helixtrans-57.4-47.6174.3-72178.3-67.600112.3Y253 L256 M257 C285 L291 L292 L293Y253-Q289 HydrophobicContact CE2-CB 4.37Å; Y253-Q289 PolarHBondContact OH-O 2.61Å; L256-Q289 HydrophobicContact CB-CG 4.34Å; M257-Q289 HydrophobicContact CB-CG 4.15Å; C285-Q289 WeakPolarHBondContact O-CG 3.4Å; C285-Q289 PolarHBondContact O-N 3.42Å; Q289-L291 VanDerWaalsContact C-N 3.25Å; Q289-L291 PolarHBondContact O-N 2.7Å; Q289-L292 PolarHBondContact O-N 3.04Å; Q289-L293 PolarHBondContact O-N 2.03Å
290A95.3Very high92.3Very high0 Ų034 Ų340%019%0.186CC..Hα-helixtrans-60.6-37.2-177.900000111.5S21 N25 H53 V57 S286 V287 A288 P294S21-A290 WeakPolarHBondContact OG-CB 3.45Å; S21-A290 PolarHBondContact OG-O 2.68Å; N25-A290 PolarHBondContact ND2-O 2.91Å; H53-A290 HydrophobicContact CB-CB 3.89Å; V57-A290 HydrophobicContact CG2-CB 3.87Å; S286-A290 PolarHBondContact O-N 2.86Å; V287-A290 PolarHBondContact O-N 3.02Å; A288-A290 PolarHBondContact O-N 3.26Å; A290-P294 WeakPolarHBondContact O-CD 3.35Å
291L95.6Very high92.2Very high48 Ų4836.5 Ų36.525%0.25120%0.2SC..Hα-helixtrans-71.1-24.3173.8-73.6168.6000114.3C17 L20 S21 V287 A288 Q289C17-L291 HydrophobicContact CB-CD1 4.14Å; L20-L291 HydrophobicContact CB-CD2 4.39Å; L20-L291 HydrophobicContact CD2-CD2 4.14Å; L20-L291 HydrophobicContact CG-CD2 4.07Å; S21-L291 PolarHBondContact OG-N 2.99Å; V287-L291 HydrophobicContact CG1-CD1 4.22Å; V287-L291 PolarHBondContact O-N 3.35Å; V287-L291 VanDerWaalsContact O-N 3.13Å; A288-L291 PolarHBondContact O-N 3.02Å; Q289-L291 VanDerWaalsContact C-N 3.25Å; Q289-L291 PolarHBondContact O-N 2.7Å
292L95.3Very high91.9Very high45 Ų4536.7 Ų36.724%0.23619%0.194CC..Hα-helixtrans-84.2-33.2-172.9-77.6164.9000114.2I252 L256 A288 Q289 V295 F296I252-L292 HydrophobicContact CG2-CD1 3.95Å; L256-L292 HydrophobicContact CD1-CD1 3.19Å; A288-L292 WeakPolarHBondContact O-CD1 3.06Å; A288-L292 VanDerWaalsContact O-CG 3.23Å; A288-L292 WeakPolarHBondContact O-CG 3.32Å; A288-L292 PolarHBondContact O-N 3Å; A288-L292 VanDerWaalsContact O-N 3.15Å; Q289-L292 PolarHBondContact O-N 3.04Å; L292-V295 WeakPolarHBondContact O-CB 3.34Å; L292-V295 PolarHBondContact O-N 2.92Å; L292-V295 VanDerWaalsContact O-N 3.07Å; L292-F296 HydrophobicContact CB-CD2 4.36Å; L292-F296 HydrophobicContact CB-CE2 3.74Å; L292-F296 HydrophobicContact CB-CZ 3.93Å; L292-F296 HydrophobicContact CD2-CE1 4.45Å; L292-F296 HydrophobicContact CD2-CZ 4.13Å; L292-F296 HydrophobicContact CG-CZ 4.44Å; L292-F296 VanDerWaalsContact O-CD2 3.27Å; L292-F296 WeakPolarHBondContact O-CD2 3.21Å; L292-F296 WeakPolarHBondContact O-CG 3.05Å; L292-F296 PolarHBondContact O-N 2.93Å
293L94.4Very high91.6Very high0 Ų036.4 Ų36.40%019%0.193CC..Hα-helixtrans-56.5-46.6179-177.963.1000113.2L46 L49 A50 I249 Y253 Q289 V295 F296 L297L46-L293 HydrophobicContact CD2-CD1 4.4Å; L49-L293 HydrophobicContact CB-CD2 4.24Å; L49-L293 HydrophobicContact CD2-CD1 4.33Å; L49-L293 HydrophobicContact CD2-CD2 4.18Å; L49-L293 HydrophobicContact CG-CD2 4.02Å; A50-L293 HydrophobicContact CB-CD2 3.71Å; I249-L293 HydrophobicContact CD1-CD1 4.27Å; Y253-L293 WeakPolarHBondContact OH-CB 3.37Å; Q289-L293 PolarHBondContact O-N 2.03Å; L293-V295 VanDerWaalsContact C-N 3.27Å; L293-V295 PolarHBondContact O-N 3.4Å; L293-F296 PolarHBondContact O-N 3.46Å; L293-L297 HydrophobicContact CD1-CD1 4.48Å; L293-L297 HydrophobicContact CD1-CG 4.3Å; L293-L297 HydrophobicContact CG-CD1 4.23Å; L293-L297 HydrophobicContact CG-CG 4.47Å; L293-L297 WeakPolarHBondContact O-CG 3.46Å; L293-L297 PolarHBondContact O-N 3.1Å
294P93.8Very high91.3Very high18 Ų1842.3 Ų42.312%0.11722%0.215CC..Hα-helixtrans-59.4-36.2175-25.837000113.2A24 N25 A290 L297 W298A24-P294 VanDerWaalsContact C-CG 3.43Å; A24-P294 HydrophobicContact CB-CB 3.83Å; A24-P294 HydrophobicContact CB-CG 3.66Å; A24-P294 WeakPolarHBondContact O-CB 3.42Å; A24-P294 WeakPolarHBondContact O-CG 3.38Å; N25-P294 HydrophobicContact CB-CG 4.45Å; A290-P294 WeakPolarHBondContact O-CD 3.35Å; P294-L297 PolarHBondContact O-N 3.49Å; P294-W298 VanDerWaalsContact O-CB 3.29Å; P294-W298 WeakPolarHBondContact O-CB 3.04Å; P294-W298 PolarHBondContact O-N 3.45Å
295V93.5Very high90.9Very high86 Ų8638.2 Ų38.252%0.52120%0.202SC..Hα-helixtrans-66.5-42.3176.9179.40000110.9L292 L293 W298 A299L292-V295 WeakPolarHBondContact O-CB 3.34Å; L292-V295 PolarHBondContact O-N 2.92Å; L292-V295 VanDerWaalsContact O-N 3.07Å; L293-V295 VanDerWaalsContact C-N 3.27Å; L293-V295 PolarHBondContact O-N 3.4Å; V295-W298 PolarHBondContact O-N 3.05Å; V295-A299 WeakPolarHBondContact O-CB 3.44Å; V295-A299 PolarHBondContact O-N 3.21Å
296F93.6Very high90.4Very high21 Ų2142.6 Ų42.69%0.09222%0.224CC..Hα-helixtrans-66.4-39.2176.3-59.9-38.3000112.9L245 T248 I249 I252 Y253 L292 L293 C300L245-F296 HydrophobicContact CD1-CB 3.75Å; L245-F296 WeakPolarHBondContact CD1-O 3.32Å; T248-F296 HydrophobicContact CG2-CD1 4.29Å; T248-F296 HydrophobicContact CG2-CE1 4Å; T248-F296 HydrophobicContact CG2-CZ 4.49Å; I249-F296 HydrophobicContact CG1-CB 4.23Å; I249-F296 HydrophobicContact CG1-CD2 3.69Å; I249-F296 HydrophobicContact CG1-CE2 4.35Å; I249-F296 HydrophobicContact CG1-CG 4.19Å; I252-F296 HydrophobicContact CB-CZ 4.09Å; I252-F296 HydrophobicContact CD1-CE1 3.75Å; I252-F296 HydrophobicContact CD1-CZ 3.49Å; I252-F296 VanDerWaalsContact CD1-CZ 3.49Å; I252-F296 HydrophobicContact CG1-CZ 4.36Å; I252-F296 HydrophobicContact CG2-CZ 3.96Å; Y253-F296 HydrophobicContact CE1-CE2 4.06Å; L292-F296 HydrophobicContact CB-CD2 4.36Å; L292-F296 HydrophobicContact CB-CE2 3.74Å; L292-F296 HydrophobicContact CB-CZ 3.93Å; L292-F296 HydrophobicContact CD2-CE1 4.45Å; L292-F296 HydrophobicContact CD2-CZ 4.13Å; L292-F296 HydrophobicContact CG-CZ 4.44Å; L292-F296 VanDerWaalsContact O-CD2 3.27Å; L292-F296 WeakPolarHBondContact O-CD2 3.21Å; L292-F296 WeakPolarHBondContact O-CG 3.05Å; L292-F296 PolarHBondContact O-N 2.93Å; L293-F296 PolarHBondContact O-N 3.46Å; F296-C300 PolarHBondContact O-N 3.45Å
297L91.8Very high90Very high9 Ų948.6 Ų48.65%0.04726%0.255CS..Hα-helixtrans-65.5-43173.7-66.2176.5000111.3L46 L293 P294 C300 Y303L46-L297 HydrophobicContact CD1-CD2 4.18Å; L293-L297 HydrophobicContact CD1-CD1 4.48Å; L293-L297 HydrophobicContact CD1-CG 4.3Å; L293-L297 HydrophobicContact CG-CD1 4.23Å; L293-L297 HydrophobicContact CG-CG 4.47Å; L293-L297 WeakPolarHBondContact O-CG 3.46Å; L293-L297 PolarHBondContact O-N 3.1Å; P294-L297 PolarHBondContact O-N 3.49Å; L297-C300 PolarHBondContact O-N 3.41Å; L297-Y303 HydrophobicContact CD2-CD2 3.9Å; L297-Y303 HydrophobicContact CD2-CG 4.17Å
298W90.6Very high89.5Confident146 Ų14655.4 Ų55.455%0.55329%0.285SS*.Hα-helixtrans-63.2-40.8175.9-173.7-63.9000112.5P294 V295 C300 R304P294-W298 VanDerWaalsContact O-CB 3.29Å; P294-W298 WeakPolarHBondContact O-CB 3.04Å; P294-W298 PolarHBondContact O-N 3.45Å; V295-W298 PolarHBondContact O-N 3.05Å; W298-C300 PolarHBondContact O-N 3.46Å; W298-C300 VanDerWaalsContact O-N 3.16Å; W298-R304 WeakPolarHBondContact O-CB 3.49Å
299A88.9Confident89.1Confident72 Ų7255.4 Ų55.460%0.59529%0.285SS*.THydrogen-bonded Turntrans-65.1-13.9178.100000113.4V295V295-A299 WeakPolarHBondContact O-CB 3.44Å; V295-A299 PolarHBondContact O-N 3.21Å
300C87.3Confident88.7Confident13 Ų1355.5 Ų55.59%0.08829%0.285CS..SBendtrans-101.8114.4175.6-74.50000112L245 F296 L297 W298 R302 Y303 R304L245-C300 HydrophobicContact CD2-CB 4.38Å; F296-C300 PolarHBondContact O-N 3.45Å; L297-C300 PolarHBondContact O-N 3.41Å; W298-C300 PolarHBondContact O-N 3.46Å; W298-C300 VanDerWaalsContact O-N 3.16Å; C300-R302 PolarHBondContact O-N 3.32Å; C300-Y303 HydrophobicContact CB-CD2 3.95Å; C300-Y303 PolarHBondContact O-N 3.44Å; C300-R304 PolarHBondContact O-N 2.92Å
301D83.3Confident88.3Confident99 Ų9963.5 Ų63.553%0.52932%0.316SS..THydrogen-bonded Turntrans-51.7-28.8179-47.3-57.8000113.9K35 Q241 Y303K35-D301 PolarHBondContact NZ-O 2.91Å; Q241-D301 PolarHBondContact NE2-OD2 3.08Å; D301-Y303 VanDerWaalsContact C-N 3.32Å; D301-Y303 PolarHBondContact O-N 2.95Å
302R82.8Confident87.9Confident47 Ų4765.9 Ų65.918%0.17733%0.325CS..THydrogen-bonded Turntrans-64-32.4175.7-178.9169.5172162.4-17.5113.3K35 K40 E43 E234 C300K35-R302 WeakPolarHBondContact CD-O 3.22Å; K40-R302 VanDerWaalsContact CD-NH2 3.33Å; E43-R302 IonicContact OE1-CZ 3.52Å; E43-R302 IonicContact OE1-NE 2.71Å; E43-R302 PolarHBondContact OE1-NE 2.81Å; E43-R302 IonicContact OE1-NH2 3.75Å; E43-R302 PolarHBondContact OE1-NH2 2.96Å; E234-R302 IonicContact OE1-CZ 3.77Å; E234-R302 IonicContact OE1-NH1 2.83Å; E234-R302 PolarHBondContact OE1-NH1 2.93Å; E234-R302 IonicContact OE1-NH2 2.87Å; C300-R302 PolarHBondContact O-N 3.32Å
303Y84Confident87.3Confident2 Ų267.4 Ų67.41%0.00833%0.33CS..THydrogen-bonded Turntrans-111.9-22.1-174.9-56-55000113.4V32 E43 L46 L245 L297 C300 D301 A305V32-Y303 HydrophobicContact CG2-CD1 3.97Å; V32-Y303 HydrophobicContact CG2-CG 4.36Å; E43-Y303 HydrophobicContact CG-CE1 3.7Å; L46-Y303 HydrophobicContact CD1-CE2 4.14Å; L245-Y303 HydrophobicContact CD2-CD2 4.02Å; L245-Y303 HydrophobicContact CD2-CE2 3.66Å; L297-Y303 HydrophobicContact CD2-CD2 3.9Å; L297-Y303 HydrophobicContact CD2-CG 4.17Å; C300-Y303 HydrophobicContact CB-CD2 3.95Å; C300-Y303 PolarHBondContact O-N 3.44Å; D301-Y303 VanDerWaalsContact C-N 3.32Å; D301-Y303 PolarHBondContact O-N 2.95Å; Y303-A305 PolarHBondContact O-N 3.21Å
304R85.1Confident86.7Confident124 Ų12469.5 Ų69.547%0.46834%0.344SS..  trans-57.8101171.4-170.7-179.3-174.1-178.61.5111.4K35 W298 C300K35-R304 WeakPolarHBondContact CE-O 3.47Å; K35-R304 PolarHBondContact NZ-O 2.98Å; W298-R304 WeakPolarHBondContact O-CB 3.49Å; C300-R304 PolarHBondContact O-N 2.92Å
305A84.4Confident86.3Confident12 Ų1272.8 Ų72.810%0.09936%0.359CS..  trans-98145.4178.400000111.8K35 Y303 V310K35-A305 HydrophobicContact CG-CB 4.4Å; Y303-A305 PolarHBondContact O-N 3.21Å; A305-V310 HydrophobicContact CB-CG2 3.78Å
306D84Confident86Confident112 Ų11271 Ų7160%0.59935%0.353SS*.  trans-78.9146.7173-58.8-56000110.8K308 A309 V310D306-K308 PolarHBondContact O-N 3.3Å; D306-K308 VanDerWaalsContact O-N 3.15Å; D306-A309 PolarHBondContact O-N 2.91Å; D306-V310 PolarHBondContact O-N 3.19Å; D306-V310 VanDerWaalsContact O-N 3.12Å
307L83.2Confident85.4Confident127 Ų12775 Ų7567%0.66538%0.375SS*.Hα-helixtrans-54.7-36.7-178.9179.661.5000112.9W27 R311W27-L307 HydrophobicContact CH2-CB 4.47Å; W27-L307 HydrophobicContact CH2-CD1 3.55Å; W27-L307 HydrophobicContact CZ3-CD1 3.94Å; L307-R311 WeakPolarHBondContact O-CB 3.46Å; L307-R311 PolarHBondContact O-N 3.12Å
308K85.1Confident84.9Confident146 Ų14681 Ų8164%0.63540%0.404SS*.Hα-helixtrans-62.2-46.9175.3-179.1172.3173.5176.10112.1D306 V310 R311 E312D306-K308 PolarHBondContact O-N 3.3Å; D306-K308 VanDerWaalsContact O-N 3.15Å; K308-V310 PolarHBondContact O-N 3.41Å; K308-R311 PolarHBondContact O-N 2.95Å; K308-E312 WeakPolarHBondContact CE-OE1 3.37Å; K308-E312 HydrophobicContact CG-CG 4.45Å; K308-E312 WeakPolarHBondContact CG-OE1 3.28Å; K308-E312 IonicContact NZ-OE1 3.84Å; K308-E312 WeakPolarHBondContact O-CB 3.39Å; K308-E312 WeakPolarHBondContact O-CG 3.45Å; K308-E312 PolarHBondContact O-N 3.4Å
309A85.2Confident84.6Confident34 Ų3477 Ų7728%0.28140%0.402SS..Hα-helixtrans-66.6-36-17900000112.5D306 K313D306-A309 PolarHBondContact O-N 2.91Å; A309-K313 WeakPolarHBondContact O-CB 3.37Å; A309-K313 PolarHBondContact O-N 2.87Å
310V86Confident83.8Confident5 Ų578.6 Ų78.63%0.0340%0.401CS..Hα-helixtrans-67.4-46.9172.7179.30000110.5W27 L30 A34 A305 D306 K308 E312 K313 C314W27-V310 HydrophobicContact CH2-CB 3.77Å; W27-V310 HydrophobicContact CH2-CG1 3.94Å; W27-V310 HydrophobicContact CH2-CG2 3.74Å; W27-V310 HydrophobicContact CZ2-CB 4.48Å; W27-V310 HydrophobicContact CZ2-CG2 3.94Å; W27-V310 HydrophobicContact CZ3-CB 4.19Å; W27-V310 HydrophobicContact CZ3-CG1 3.82Å; W27-V310 HydrophobicContact CZ3-CG2 4.39Å; L30-V310 HydrophobicContact CB-CG1 3.99Å; A34-V310 HydrophobicContact CB-CG2 3.95Å; A305-V310 HydrophobicContact CB-CG2 3.78Å; D306-V310 PolarHBondContact O-N 3.19Å; D306-V310 VanDerWaalsContact O-N 3.12Å; K308-V310 PolarHBondContact O-N 3.41Å; V310-E312 PolarHBondContact O-N 3.35Å; V310-K313 PolarHBondContact O-N 3.11Å; V310-C314 PolarHBondContact O-N 3.34Å; V310-C314 PolarHBondContact O-SG 3.37Å; V310-C314 VanDerWaalsContact O-SG 3.39Å
311R85.8Confident82.6Confident168 Ų16882.8 Ų82.863%0.63442%0.423SS*.Hα-helixtrans-58.2-48.2177.6-178.3-176170.6179.7-1112.2L307 K308 K313 C314 M315L307-R311 WeakPolarHBondContact O-CB 3.46Å; L307-R311 PolarHBondContact O-N 3.12Å; K308-R311 PolarHBondContact O-N 2.95Å; R311-K313 VanDerWaalsContact C-N 3.31Å; R311-K313 PolarHBondContact O-N 3.32Å; R311-C314 PolarHBondContact O-N 3.34Å; R311-M315 HydrophobicContact CG-CE 4.05Å; R311-M315 HydrophobicContact CG-CG 4.37Å; R311-M315 HydrophobicContact CG-SD 4.01Å; R311-M315 WeakPolarHBondContact O-CG 3.18Å; R311-M315 PolarHBondContact O-N 3.07Å
312E87.8Confident81.4Confident98 Ų9885.8 Ų85.846%0.45843%0.433SS..Hα-helixtrans-59.2-42.2177.9-74.6169.6175.900111.8K308 V310 M315 A316K308-E312 WeakPolarHBondContact CE-OE1 3.37Å; K308-E312 HydrophobicContact CG-CG 4.45Å; K308-E312 WeakPolarHBondContact CG-OE1 3.28Å; K308-E312 IonicContact NZ-OE1 3.84Å; K308-E312 WeakPolarHBondContact O-CB 3.39Å; K308-E312 WeakPolarHBondContact O-CG 3.45Å; K308-E312 PolarHBondContact O-N 3.4Å; V310-E312 PolarHBondContact O-N 3.35Å; E312-M315 HydrophobicContact CG-CE 4.36Å; E312-A316 WeakPolarHBondContact O-CB 3.1Å; E312-A316 PolarHBondContact O-N 2.85Å
313K82.3Confident80.1Confident76 Ų7691.2 Ų91.233%0.3346%0.461SS..Hα-helixtrans-66.7-39.6174.8-89.9-99.3-170.8148.90113.6G33 A34 Q36 A309 V310 R311 A316 L317G33-K313 PolarHBondContact O-NZ 3.43Å; A34-K313 HydrophobicContact CB-CB 4.16Å; A34-K313 HydrophobicContact CB-CG 4.07Å; A34-K313 WeakPolarHBondContact O-CE 3.47Å; Q36-K313 PolarHBondContact O-NZ 3.49Å; A309-K313 WeakPolarHBondContact O-CB 3.37Å; A309-K313 PolarHBondContact O-N 2.87Å; V310-K313 PolarHBondContact O-N 3.11Å; R311-K313 VanDerWaalsContact C-N 3.31Å; R311-K313 PolarHBondContact O-N 3.32Å; K313-A316 PolarHBondContact O-N 3.27Å; K313-L317 WeakPolarHBondContact O-CG 3.46Å; K313-L317 PolarHBondContact O-N 3.2Å
314C83.4Confident78.4Confident44 Ų4494.8 Ų94.830%0.29749%0.486SS..Hα-helixtrans-67.4-42.9175.4-70.30000111.9V310 R311 A316 L317 M318V310-C314 PolarHBondContact O-N 3.34Å; V310-C314 PolarHBondContact O-SG 3.37Å; V310-C314 VanDerWaalsContact O-SG 3.39Å; R311-C314 PolarHBondContact O-N 3.34Å; C314-A316 VanDerWaalsContact C-N 3.32Å; C314-A316 PolarHBondContact O-N 2.91Å; C314-L317 PolarHBondContact O-N 3.26Å; C314-M318 PolarHBondContact O-N 3.37Å
315M85.3Confident76.6Confident88 Ų8895 Ų9543%0.43350%0.496SS..Hα-helixtrans-62.8-40.3174.6-67.4-177.5-45.600111.2R311 E312 A319R311-M315 HydrophobicContact CG-CE 4.05Å; R311-M315 HydrophobicContact CG-CG 4.37Å; R311-M315 HydrophobicContact CG-SD 4.01Å; R311-M315 WeakPolarHBondContact O-CG 3.18Å; R311-M315 PolarHBondContact O-N 3.07Å; E312-M315 HydrophobicContact CG-CE 4.36Å; M315-A319 VanDerWaalsContact O-CB 3.28Å; M315-A319 WeakPolarHBondContact O-CB 3.44Å; M315-A319 PolarHBondContact O-N 2.92Å
316A85.9Confident74.8Confident47 Ų47100.8 Ų100.839%0.38853%0.526SS..Hα-helixtrans-63.2-41.7174.300000112.2E312 K313 C314 A319 N320E312-A316 WeakPolarHBondContact O-CB 3.1Å; E312-A316 PolarHBondContact O-N 2.85Å; K313-A316 PolarHBondContact O-N 3.27Å; C314-A316 VanDerWaalsContact C-N 3.32Å; C314-A316 PolarHBondContact O-N 2.91Å; A316-A319 PolarHBondContact O-N 3.43Å; A316-N320 PolarHBondContact O-N 3.36Å; A316-N320 VanDerWaalsContact O-N 3.15Å; A316-N320 PolarHBondContact O-ND2 2.93Å
317L82.5Confident72.8Confident106 Ų106104 Ų10456%0.55554%0.537SS*.Hα-helixtrans-61-52.9176.4-74.1168.1000111.5K313 C314 A319 N320 D321K313-L317 WeakPolarHBondContact O-CG 3.46Å; K313-L317 PolarHBondContact O-N 3.2Å; C314-L317 PolarHBondContact O-N 3.26Å; L317-A319 PolarHBondContact O-N 3.19Å; L317-N320 PolarHBondContact O-N 3.27Å; L317-D321 PolarHBondContact O-N 2.92Å
318M80.8Confident70.6Confident134 Ų134104.3 Ų104.366%0.6654%0.544SS*.Hα-helixtrans-62.5-28.7179.5-59.5-166-38.600112.9C314C314-M318 PolarHBondContact O-N 3.37Å
319A83.4Confident68.1Low62 Ų62102.5 Ų102.551%0.51255%0.55SS..Hα-helixtrans-76.8-19.5175.300000114.3M315 A316 L317M315-A319 VanDerWaalsContact O-CB 3.28Å; M315-A319 WeakPolarHBondContact O-CB 3.44Å; M315-A319 PolarHBondContact O-N 2.92Å; A316-A319 PolarHBondContact O-N 3.43Å; L317-A319 PolarHBondContact O-N 3.19Å
320N71.4Confident65.8Low106 Ų106109 Ų10957%0.56758%0.579SS**Hα-helixtrans-86.6-26.5175-78.9-94.3000112.2A316 L317A316-N320 PolarHBondContact O-N 3.36Å; A316-N320 VanDerWaalsContact O-N 3.15Å; A316-N320 PolarHBondContact O-ND2 2.93Å; L317-N320 PolarHBondContact O-N 3.27Å
321D62.8Low63.2Low102 Ų102117.5 Ų117.555%0.54562%0.619SS.*Hα-helixtrans-67-40.7179.3-66.4-27.1000110.6L317 E323 S324L317-D321 PolarHBondContact O-N 2.92Å; D321-E323 VanDerWaalsContact C-N 3.31Å; D321-E323 PolarHBondContact O-N 3.31Å; D321-S324 PolarHBondContact O-N 3.45Å; D321-S324 VanDerWaalsContact O-N 3.13Å; D321-S324 PolarHBondContact O-OG 3.11Å
322E59.1Low60.6Low161 Ų161112.7 Ų112.775%0.75262%0.621SS**THydrogen-bonded Turntrans-63.1-28.9179-57-90.1130.300113.8S324E322-S324 VanDerWaalsContact C-N 3.27Å; E322-S324 PolarHBondContact O-N 3.03Å
323E54.3Low57.6Low162 Ų162111.5 Ų111.576%0.75764%0.635SS**THydrogen-bonded Turntrans-84.3-0.7179.4-162.7169-172.700112.3D321D321-E323 VanDerWaalsContact C-N 3.31Å; D321-E323 PolarHBondContact O-N 3.31Å
324S48.8Very low54.9Low76 Ų76116 Ų11653%0.53166%0.661SS.*SBendtrans-103.1-13.6-177.373.10000115.5D321 E322D321-S324 PolarHBondContact O-N 3.45Å; D321-S324 VanDerWaalsContact O-N 3.13Å; D321-S324 PolarHBondContact O-OG 3.11Å; E322-S324 VanDerWaalsContact C-N 3.27Å; E322-S324 PolarHBondContact O-N 3.03Å
325D46.6Very low52.2Low129 Ų129119.1 Ų119.169%0.6968%0.683SS**SBendtrans-90.8-13.5-177.7-85.2-19.7000114.1E327D325-E327 VanDerWaalsContact C-N 3.33Å; D325-E327 PolarHBondContact O-N 3.41Å
326D46.7Very low50.2Low134 Ų134120.1 Ų120.172%0.71770%0.696SS**SBendtrans-75.2-12.5-176.3-85.8-25.2000114.8T328D326-T328 PolarHBondContact O-N 2.85Å; D326-T328 VanDerWaalsContact O-N 3.08Å
327E42.3Very low47.3Very low180 Ų180125 Ų12584%0.84172%0.716SS**THydrogen-bonded Turntrans-84.433.6-177.4-72.2-70.9150.500113.9D325D325-E327 VanDerWaalsContact C-N 3.33Å; D325-E327 PolarHBondContact O-N 3.41Å
328T37.4Very low44.9Very low133 Ų133127.6 Ų127.682%0.81673%0.729SS**THydrogen-bonded Turntrans-134.75.6177.561.20000117.3D326D326-T328 PolarHBondContact O-N 2.85Å; D326-T328 VanDerWaalsContact O-N 3.08Å
329S33.2Very low42.4Very low107 Ų107127.1 Ų127.175%0.74873%0.734SS**  trans-112.180172.169.60000113.2E331S329-E331 PolarHBondContact O-N 3.44Å
330L37.1Very low39.7Very low171 Ų171131 Ų13190%0.89575%0.745SS**  trans-85.9101.5172.1-140.2174.6000109.5
331E31.4Very low37.5Very low184 Ų184133.2 Ų133.286%0.8675%0.752SS**  trans-156.3126.9162.6-164.659.5-109.600112.3S329S329-E331 PolarHBondContact O-N 3.44Å
332G30.1Very low35.7Very low66 Ų66138.3 Ų138.368%0.6876%0.764SS**  trans86.258.1144.200000122.6
333G25.2Very low34Very low73 Ų73135 Ų13575%0.75376%0.758SS**  91.7135.5120.500000123.3
334I24.9Very low32.7Very low170 Ų170135.2 Ų135.287%0.87276%0.764SS**  trans86.2125.3151.8-47.9174.9000118.6
335S26.9Very low31.6Very low110 Ų110139 Ų13977%0.76978%0.778SS**  trans-144.3168.1159-62.40000106.7
336P43.1Very low30.6Very low110 Ų110144 Ų14471%0.71479%0.789SS**  cis-133.1-163.62.240.1-20.3000114.5
337D26Very low29.6Very low148 Ų148140.8 Ų140.879%0.79179%0.788SS**  trans76117.4158.1-70.7-16.6000122.9
338L32.1Very low28.7Very low161 Ų161143.6 Ų143.684%0.84379%0.792SS**  trans159.5103.9137-85.8159000108.8
339V27.1Very low28.2Very low124 Ų124140.3 Ų140.375%0.75279%0.785SS**  87.512477163.10000115.1
340L26.8Very low27.9Very low143 Ų143139.1 Ų139.175%0.74979%0.79SS**  trans71.8105.3158.2-140.961.8000117.7
341E25.8Very low27.4Very low153 Ų153138 Ų13872%0.71579%0.785SS**  69.7105.578.3-166.9-149.1-127.400115.9
342R24Very low27.3Very low209 Ų209139 Ų13979%0.78979%0.787SS**  trans175.2111.9133.7-104.2-169.7150.873.3-1.6110.1
343S24.1Very low27.5Very low92 Ų92142 Ų14264%0.64379%0.792SS**  81.4110.383.478.90000114.6
344L26.8Very low28Very low166 Ų166142.6 Ų142.687%0.86979%0.789SS**  trans-155.884.3148.4-116.2166.2000109.5
345D25Very low28.4Very low157 Ų157142.3 Ų142.384%0.8479%0.789SS**  trans-63.7137.3158.3-88.2-50.2000109.4
346Y27.1Very low28.6Very low233 Ų233144.6 Ų144.691%0.91479%0.792SS**  trans-155.2123.7142.3-126.6-82.3000109.9
347G24.4Very low28.1Very low67 Ų67151.1 Ų151.169%0.69180%0.802SS**  trans-119.2148.5-175.300000113.7
348Y25.2Very low28.3Very low238 Ų238152.5 Ų152.593%0.93381%0.806SS**  trans-162.7131.4159.2-152.8-91.8000105.4
349G26.4Very low28.3Very low65 Ų65149.4 Ų149.467%0.6780%0.804SS**  cis132.1100.312.600000108
350G25.6Very low28.4Very low82 Ų82153 Ų15385%0.84581%0.809SS**  trans162.7112.4179.700000114.7
351D28Very low28.7Very low148 Ų148157 Ų15779%0.79182%0.816SS**  trans-68143.7178.6-62.7-73.3000113.9
352F29.3Very low28.9Very low204 Ų204158.6 Ų158.690%0.89582%0.824SS**  trans-153.381.8145.2-110.6-73.1000110.9
353V34.8Very low29.3Very low130 Ų130156.5 Ų156.579%0.78883%0.826SS**  trans-86.2144.1169.5172.20000109.8
354A34.2Very low29.6Very low85 Ų85158 Ų15870%0.70284%0.837SS**  trans66.980.9167.200000118.3
355L34.3Very low29.8Very low164 Ų164154.5 Ų154.586%0.85983%0.832SS**  trans-148.264.1159.5-15588.7000115
356D30.7Very low30.2Very low157 Ų157155 Ų15584%0.8483%0.834SS**SBendtrans-156.726.7157.5-159.533000115
357R32.2Very low30.5Very low247 Ų247153.6 Ų153.693%0.93284%0.835SS**SBendtrans-127.57.5-177.8-133.7175.2-171.4165.63.1115.9
358M30Very low30.8Very low178 Ų178154.4 Ų154.488%0.87784%0.844SS**  trans-121.343.5-178.7-64.1-157.3-69.700113.2
359A32.8Very low30.8Very low95 Ų95146.8 Ų146.879%0.78584%0.837SS**SBendtrans-119.623.5178.300000113.8
360K29.1Very low30.8Very low199 Ų199151.6 Ų151.687%0.86585%0.847SS**SBendtrans-150.418.5-178.7-138176.6-174.5177.60117.2
361Y32.3Very low31.4Very low228 Ų228152.7 Ų152.789%0.89484%0.839SS**SBendtrans-128.413.4-178.2-103.1-74.9000115.2
362E31Very low31.3Very low187 Ų187153.7 Ų153.787%0.87484%0.839SS**SBendtrans-123.440.3-170.5-149170.3-136.700113.7
363I32.1Very low31.1Very low165 Ų165150.2 Ų150.285%0.84683%0.829SS**SBendtrans-136.829.3170.8-42.5-179.6000111.1
364S29.9Very low30.7Very low123 Ų123153.8 Ų153.886%0.8683%0.83SS**SBendtrans-148.720.1-178.9-55.30000115.1
365A31.8Very low30.5Very low93 Ų93155.7 Ų155.777%0.76984%0.835SS**  trans-120.948.8-177.700000112.6
366L33.9Very low30.3Very low167 Ų167156.2 Ų156.287%0.87484%0.837SS**  trans-154.572.1168.6-16078.2000113.8
367E33.5Very low30.1Very low204 Ų204159.9 Ų159.995%0.95384%0.84SS**  trans-165.5138.1140.7-114.9172.5164.200110.1
368G30Very low30Very low84 Ų84153.9 Ų153.987%0.86683%0.833SS**  trans-127.5138.1-177.600000112
369G25.2Very low29.9Very low77 Ų77153.2 Ų153.279%0.79483%0.832SS**  trans174.1115.3176.500000112.8
370L25.9Very low29.8Very low167 Ų167157.7 Ų157.787%0.87484%0.837SS**  trans-78175.7174.6-95.281.8000111.9
371P37.5Very low29.7Very low105 Ų105156.3 Ų156.368%0.68283%0.833SS**  cis-140.1-175.1-39.536.8-18000113.7
372Q26.8Very low29.7Very low169 Ų169152.9 Ų152.979%0.7983%0.83SS**  trans114.2125.5153-72.3-166-3.500121.5
373L25.6Very low29.7Very low131 Ų131152.5 Ų152.569%0.68683%0.826SS**  trans84.1134139.1-98.871.6000123.2
374Y25.6Very low30Very low205 Ų205150.4 Ų150.480%0.80481%0.814SS**  trans72.5126.1170.6-80.1-84.7000120.3
375P31.1Very low30.2Very low125 Ų125151.6 Ų151.681%0.81281%0.806SS**PPolyproline II helixtrans-81.6120.8177.332.2-32.9000111.9
376L28.8Very low30.6Very low174 Ų174153.6 Ų153.691%0.91179%0.794SS**PPolyproline II helixtrans-80.9130168.4-96.5153.4000110.9
377R27.4Very low30.8Very low235 Ų235151 Ų15189%0.88778%0.781SS**PPolyproline II helixtrans-55.7129.4-179.6-167.9-172.4-141.5164.54.2111
378P29.4Very low31.1Very low121 Ų121149.6 Ų149.679%0.78677%0.774SS**PPolyproline II helixtrans-65.4144.8177.825.6-32.8000111.9
379L28.5Very low31.7Very low164 Ų164150.4 Ų150.486%0.85976%0.762SS**PPolyproline II helixtrans-55.2139.6177.8-171.167.3000111E381L379-E381 PolarHBondContact O-N 3.25Å
380Q30.2Very low31.9Very low189 Ų189151.1 Ų151.188%0.88375%0.753SS**  trans-73.488.4-177.2-174.4174.3000111.2
381E27.2Very low32.5Very low170 Ų170149.7 Ų149.779%0.79475%0.754SS**  trans-67.6133.4167.8-66.7-175.914600110.4L379 K383L379-E381 PolarHBondContact O-N 3.25Å; E381-K383 VanDerWaalsContact C-N 3.29Å; E381-K383 PolarHBondContact O-N 2.93Å
382D32.1Very low32.4Very low156 Ų156150.1 Ų150.183%0.83475%0.754SS**  trans-7380.4-175.8-166.117.3000110.5M384D382-M384 PolarHBondContact O-N 3.09Å
383K31.3Very low32.9Very low178 Ų178153.8 Ų153.877%0.77476%0.761SS**  trans-70.795.9-171.9-162173.8-170.8174.50110.3E381 Q385E381-K383 VanDerWaalsContact C-N 3.29Å; E381-K383 PolarHBondContact O-N 2.93Å; K383-Q385 PolarHBondContact O-N 2.9Å
384M38.3Very low33.4Very low122 Ų122159.5 Ų159.560%0.60177%0.774SS**  trans-55.8109.9171-73.7-170175.600110.1D382 Y386D382-M384 PolarHBondContact O-N 3.09Å; M384-Y386 HydrophobicContact CB-CE1 4.37Å; M384-Y386 HydrophobicContact CB-CE2 4.17Å; M384-Y386 VanDerWaalsContact O-CD2 3.23Å; M384-Y386 WeakPolarHBondContact O-CD2 3.41Å; M384-Y386 VanDerWaalsContact O-CE2 3.31Å; M384-Y386 WeakPolarHBondContact O-CE2 3.23Å; M384-Y386 PolarHBondContact O-N 3.05Å
385Q33.9Very low33.7Very low147 Ų147160.5 Ų160.569%0.68778%0.782SS**  trans-79.598.4-179.9-155.8853.200109.1P215 K383P215-Q385 WeakPolarHBondContact CB-O 3.32Å; K383-Q385 PolarHBondContact O-N 2.9Å
386Y40.1Very low34Very low136 Ų136159.8 Ų159.853%0.53378%0.78SS.*  trans-74125.8179.8-59.9-78000111.3V218 M384 Q388V218-Y386 HydrophobicContact CG2-CD1 4.44Å; V218-Y386 HydrophobicContact CG2-CE1 4.5Å; M384-Y386 HydrophobicContact CB-CE1 4.37Å; M384-Y386 HydrophobicContact CB-CE2 4.17Å; M384-Y386 VanDerWaalsContact O-CD2 3.23Å; M384-Y386 WeakPolarHBondContact O-CD2 3.41Å; M384-Y386 VanDerWaalsContact O-CE2 3.31Å; M384-Y386 WeakPolarHBondContact O-CE2 3.23Å; M384-Y386 PolarHBondContact O-N 3.05Å; Y386-Q388 PolarHBondContact O-N 2.84Å
387L37.8Very low34.2Very low112 Ų112159.6 Ų159.659%0.58677%0.774SS**  trans-8589.3171.7-154.3109.1000109.3V389L387-V389 HydrophobicContact CD2-CG2 4.48Å; L387-V389 PolarHBondContact O-N 3.32Å
388Q41.5Very low34.5Very low174 Ų174154.8 Ų154.881%0.81377%0.766SS**  trans-74107.9179.9-150.8172.118.200109.3Y386Y386-Q388 PolarHBondContact O-N 2.84Å
389V40.7Very low34.6Very low102 Ų102157.3 Ų157.362%0.61877%0.773SS**  trans-81.4123.9178-176.10000108.7L387L387-V389 HydrophobicContact CD2-CG2 4.48Å; L387-V389 PolarHBondContact O-N 3.32Å
390P29.3Very low34.8Very low92 Ų92153.7 Ų153.760%0.59777%0.767SS**  trans-60.6139.1-179-25.835.3000112.7T392P390-T392 PolarHBondContact O-N 3.06Å
391P40.2Very low34.9Very low137 Ų137151.3 Ų151.389%0.8976%0.76SS**  trans-79.762.3-178.734.7-36.9000111.2
392T35.3Very low35.1Very low114 Ų114150.4 Ų150.470%0.69977%0.766SS**  trans-130.3114.9176.953.30000111.4P390P390-T392 PolarHBondContact O-N 3.06Å
393R37.5Very low35.2Very low246 Ų246153.8 Ų153.893%0.92877%0.767SS**  trans79.867.1163-149.3-179.1-156.31786.6117.9
394R35.4Very low35.1Very low251 Ų251149.7 Ų149.795%0.94777%0.767SS**  trans-136.966.9147.1-72-163.7-179.2-158.50112
395F32.6Very low34.6Very low225 Ų225148.1 Ų148.199%0.98777%0.773SS**  trans-98.298.6152-91-78.8000107.2
396S37Very low34.5Very low110 Ų110148 Ų14877%0.76978%0.782SS**  trans-170122.9165.8-175.20000108.2
397H33.5Very low34.1Very low170 Ų170147 Ų14779%0.78779%0.792SS**SBendtrans58.383.8172.8-104.4-73.7000117.5
398D33.3Very low33.6Very low135 Ų135149.6 Ų149.672%0.72281%0.806SS**  166112.1104.1-85.8-12.5000108.3
399D31.9Very low33Very low173 Ų173147 Ų14793%0.92580%0.804SS**  trans170.280.8155.3-88.9-22.7000106.8
400A31.1Very low32.7Very low89 Ų89146.5 Ų146.574%0.73681%0.811SS**  trans-80.8158158.900000108.8
401D32.8Very low32.8Very low138 Ų138151.7 Ų151.774%0.73882%0.824SS**  trans7566.6171.4-52-29.2000118.2
402V32.6Very low32.4Very low151 Ų151153.6 Ų153.692%0.91583%0.826SS**  trans-127.7123.8137.2-1790000108.9
403W33Very low32.5Very low227 Ų227153.8 Ų153.886%0.8683%0.829SS**  trans-79.8139.3-169.1-80.775000114.4
404A29.4Very low32.1Very low92 Ų92153.3 Ų153.376%0.7683%0.827SS**  trans-12.9133.5162.900000120.2
405A28.6Very low32Very low90 Ų90153.5 Ų153.574%0.74483%0.828SS**  -164.8156124.100000112.3
406V30.2Very low31.8Very low143 Ų143146 Ų14687%0.86782%0.815SS**SBendtrans79.6139.3164.6-170.20000114.9
407P32.5Very low31.5Very low115 Ų115146.7 Ų146.775%0.74782%0.819SS**  -115.9167.8-124.935.3-24.1000117.7
408L26.4Very low31.4Very low168 Ų168141.6 Ų141.688%0.8881%0.812SS**  trans-67.6133.4178.6-68.4105.8000113.7
409P30.5Very low31.6Very low119 Ų119143.8 Ų143.877%0.77382%0.818SS**  trans-78.2128156-8.526.4000110.2F411P409-F411 PolarHBondContact O-N 3.31Å
410A33.4Very low31.7Very low91 Ų91142.4 Ų142.475%0.75281%0.811SS**  trans-81.2108.8-176.900000113
411F32.1Very low31.9Very low202 Ų202146.9 Ų146.989%0.88682%0.821SS**  trans-149.693.4156.1-81.6-69.4000111P409P409-F411 PolarHBondContact O-N 3.31Å
412L32.3Very low32.1Very low176 Ų176145 Ų14592%0.92183%0.826SS**  trans-108.4113.2170.1-84.8170.9000110.4R414L412-R414 PolarHBondContact O-N 3.38Å
413P37.1Very low32.3Very low118 Ų118141.9 Ų141.977%0.76682%0.815SS**  trans-77.8105.116116.1-3.7000109.3W415P413-W415 PolarHBondContact O-N 3.2Å
414R29Very low32.3Very low237 Ų237139.1 Ų139.189%0.89482%0.816SS**  trans-35.1120.4165.9176.7-172.3-172.4179.33.1113.1L412L412-R414 PolarHBondContact O-N 3.38Å
415W31.8Very low32.5Very low255 Ų255138.6 Ų138.697%0.96681%0.812SS**  trans-113.7139157.9-105.544.7000109.8P413P413-W415 PolarHBondContact O-N 3.2Å
416G28.5Very low32.5Very low68 Ų68143.2 Ų143.270%0.70182%0.818SS**  trans-91.3160.6-166.600000114.5
417S31.7Very low32.7Very low124 Ų124143.5 Ų143.587%0.86781%0.814SS**  trans-63.2154.5160.6-170.10000111.3
418G31.2Very low32.5Very low62 Ų62146.4 Ų146.464%0.63982%0.819SS**  trans134101.6-172.500000108.9
419E38.6Very low32.9Very low182 Ų182145.4 Ų145.485%0.8581%0.814SS**  cis45.961.938.8-65.1-170.317500111.2
420D33.2Very low33.4Very low144 Ų144145.9 Ų145.977%0.7782%0.817SS**  trans179.689.2144.1-95.3-26.5000111.7
421L35.9Very low33.2Very low182 Ų182146.3 Ų146.395%0.95382%0.821SS**  trans-140.525.8159.4-141.288.1000112.8
422A35.5Very low33Very low100 Ų100140.2 Ų140.283%0.82682%0.815SS**SBendtrans-93.63.517200000112.9
423A37.3Very low33.2Very low84 Ų84137.7 Ų137.769%0.69481%0.809SS**  trans-110.447.6-170.100000113.4
424L33.4Very low32.9Very low169 Ų169138.7 Ų138.789%0.88580%0.803SS**SBendtrans-153.6128.3166.3-111.8150.9000112.2
425A33.8Very low32.9Very low81 Ų81135.1 Ų135.167%0.66979%0.79SS**  trans75.735.5166.300000120.2L427A425-L427 PolarHBondContact O-N 3.25Å
426H28.8Very low32.8Very low187 Ų187130.9 Ų130.987%0.86677%0.774SS**  trans-74.539.8148.2-100.4-62.4000112.3
427L33.3Very low33.1Very low150 Ų150137.6 Ų137.679%0.78578%0.778SS**  trans-81.7123175.3-99.2159.3000109.2A425A425-L427 PolarHBondContact O-N 3.25Å
428M28Very low32.8Very low175 Ų175135.5 Ų135.586%0.86277%0.768SS**  trans107.185.4176.9-57.3-71.4174.200115.1
429L35.9Very low32.7Very low148 Ų148137.6 Ų137.678%0.77577%0.773SS**  trans-122.3146.9147.6-9295.5000108.2
430P39.8Very low32.2Very low128 Ų128135.7 Ų135.783%0.83177%0.768SS**  -141170.9102.842-29.3000111.5
431A29.6Very low31.9Very low100 Ų100136.2 Ų136.283%0.82677%0.77SS**  cis-152.41686.500000110.4
432G28.3Very low31.5Very low74 Ų74131.6 Ų131.676%0.76376%0.758SS**  trans133122.1149.300000115.7
433P37.6Very low31.1Very low123 Ų123136.4 Ų136.480%0.79976%0.76SS**  trans-114-174.6-162.442.8-36.1000116.3
434E29.9Very low30.6Very low139 Ų139136.6 Ų136.665%0.6576%0.762SS**  trans89.6132.9169.3-61.9-94.1119.100116.3
435R29.4Very low30.4Very low162 Ų162137 Ų13761%0.61176%0.76SS**  cis-166.8141.2-16.2-138.6-170.6-162.4145.1-9.2111.8
436R30.2Very low30.1Very low166 Ų166141 Ų14163%0.62677%0.769SS**  trans61.2117.8147-81.9174-164-163.32.9119.4
437R32.9Very low30.1Very low210 Ų210135.9 Ų135.979%0.79276%0.759SS**  78.6141.392.7-78.6-175.6-167.3169.6-0.4113.3
438A26.3Very low30.9Very low79 Ų79134.4 Ų134.465%0.65376%0.759SS**  cis-164165.4-6.800000109.8
439S28.9Very low31.9Very low106 Ų106131.2 Ų131.274%0.74175%0.751SS**  31150.2126.3-530000121.3
440L28.9Very low31.5Very low142 Ų142129.6 Ų129.674%0.74375%0.753SS**  cis-171.4154.8-3.8-104.9166000107.4
441L27.2Very low30.9Very low156 Ų156135.2 Ų135.282%0.81776%0.757SS**  trans53142.1144.6-73.4166.6000124.5
442A27.2Very low30.9Very low84 Ų84135.3 Ų135.369%0.69476%0.758SS**  trans101.5117.5132.800000122.7
443F26Very low31Very low201 Ų201142.6 Ų142.688%0.88276%0.762SS**  trans60120.4130.9-88.3-98.7000124.4
444A27.5Very low30.7Very low88 Ų88146.6 Ų146.673%0.72776%0.761SS**  77.7151.8128.500000123.5
445E29.8Very low30.8Very low179 Ų179150.2 Ų150.284%0.83677%0.769SS**  trans-40.8147.3179.1-64.1158.2117.300114.6
446D26.2Very low30.7Very low163 Ų163147.3 Ų147.387%0.87277%0.773SS**  -167177.463-132.2-36.9000113.2
447A29.3Very low30.7Very low80 Ų80142.6 Ų142.666%0.66177%0.77SS**  trans-100.3-157.7-170.600000115
448P50.9Low30.6Very low120 Ų120141.8 Ų141.878%0.77978%0.775SS**  -106.2-134.4-66.929.3-10000109.2
449P47.3Very low30.6Very low108 Ų108142.8 Ų142.870%0.70178%0.777SS**  cis-136.7-163.1-2043.8-24.6000115.6
450S27.6Very low30.6Very low114 Ų114144.6 Ų144.680%0.79778%0.778SS**  trans84.2150.6159.784.10000119.2
451R27.2Very low30.5Very low246 Ų246145.5 Ų145.593%0.92878%0.783SS**  cis175.3114.8-33.1-138.6-174.6-171175.14107.2
452A30Very low30.5Very low101 Ų101143.1 Ų143.184%0.83578%0.779SS**  trans-178.2145.8163.900000109.8
453R30Very low30.5Very low227 Ų227147 Ų14786%0.85779%0.788SS**  cis-167.1125.8-11.3179.4175.6-150.5-170.18.2109.1
454R32.8Very low30.6Very low208 Ų208147.8 Ų147.879%0.78579%0.785SS**  trans36.5144.3137.8-95.8177.6-167-109.89.6119.9
455R30.3Very low31.2Very low215 Ų215148.2 Ų148.281%0.81178%0.78SS**  cis-150.9147.432.5-66.1-177.4170.4122.9-8108.1
456S27.8Very low31.1Very low100 Ų100144.6 Ų144.670%0.69977%0.774SS**  58.4133.157.380.70000113.9
457A31.5Very low31.2Very low68 Ų68141.3 Ų141.356%0.56277%0.77SS**  cis-162.216915.700000112.9
458E29.8Very low31.2Very low192 Ų192144.9 Ų144.990%0.89778%0.777SS**  54.9150.6129.6-73.1157.9-151.600122
459S27.2Very low30.1Very low100 Ų100145.5 Ų145.570%0.69977%0.774SS**  cis-173.2-179.7-9.2-175.40000110.9
460L28Very low29.2Very low144 Ų144145.6 Ų145.675%0.75478%0.777SS**  trans81.8101.8157.6-53-177.6000122.8
461L27.9Very low29.2Very low161 Ų161143.8 Ų143.884%0.84378%0.776SS**  31.7127.9117.9-59.4169.7000121.4
462S26.4Very low29.2Very low106 Ų106139.2 Ų139.274%0.74177%0.77SS**  149.9162.897.1-152.10000116.4
463L27.1Very low29.2Very low167 Ų167143.9 Ų143.987%0.87477%0.765SS**  trans85.2118.6155.9-71.7153.5000123.4
464R27.4Very low29.1Very low217 Ų217142.7 Ų142.782%0.81976%0.761SS**  trans-82.7-175.1153.2-140-169152.5160.3-3.9108
465P41.1Very low28.8Very low97 Ų97136.7 Ų136.763%0.6376%0.756SS**  cis-149175-0.744.5-24.4000120.4
466S27.7Very low28.6Very low102 Ų102131.9 Ų131.971%0.71375%0.754SS**  trans73.2157137-760000124.8
467A27.4Very low28.6Very low94 Ų94134.4 Ų134.478%0.77776%0.76SS**  trans74.815215800000118.2
468L29.2Very low28.5Very low155 Ų155136.5 Ų136.581%0.81277%0.77SS**  cis-166.4161.1-28.7-163.189.9000107.1
469D28.5Very low30Very low134 Ų134133.1 Ų133.172%0.71777%0.765SS**  trans88.7138.5142.2-134.6-6.9000124.4
470S28.8Very low31Very low110 Ų110134.2 Ų134.277%0.76977%0.77SS**  trans69.1153.9145.679.50000122.4
471G26.6Very low31Very low76 Ų76131 Ų13178%0.78477%0.771SS**  trans141.949.2149.600000121.5
472L28.1Very low31.2Very low150 Ų150128.8 Ų128.879%0.78577%0.769SS**  trans-39.1154.6166.3-165.679.2000116.9
473R30.3Very low32.3Very low198 Ų198129.9 Ų129.975%0.74777%0.774SS**  trans94.9153.2161.1-55.1177.9-163.5-157.42.6116.5
474R27.4Very low32.6Very low203 Ų203133.3 Ų133.377%0.76678%0.775SS**  cis-174133.7-21.2166.3-176-74.4166.1-7.2109
475A26.3Very low32.7Very low81 Ų81135 Ų13567%0.66978%0.782SS**  trans42142.4150.600000124
476C26.8Very low32.3Very low114 Ų114141.9 Ų141.977%0.7780%0.795SS**  trans65.8134.3147.6-65.40000117.5
477D26.9Very low32.9Very low154 Ų154143 Ų14382%0.82480%0.8SS**  cis-160175.149.3-92.5-47.1000114.3
478S30.4Very low33Very low111 Ų111142 Ų14278%0.77680%0.799SS**  trans-140.5-174.5171.5-53.60000108.7
479P59.6Low34Very low121 Ų121141.1 Ų141.179%0.78680%0.802SS**  cis-106.9-99.3-18.229.7-7.4000109
480P49Very low34Very low124 Ų124138.4 Ų138.481%0.80581%0.806SS**  cis-94.9-170-2441.7-32.3000111.5
481G28.5Very low34.6Very low77 Ų77138.9 Ų138.979%0.79481%0.806SS**  cis-165.5174.6-400000111.2
482S32.3Very low34.7Very low114 Ų114146.3 Ų146.380%0.79781%0.811SS**  trans-122.6167.8-178.869.50000112
483P49.1Very low34.6Very low129 Ų129144.3 Ų144.384%0.83881%0.809SS**  -148.8166.995.236.4-17.5000118.2
484R32.3Very low34.5Very low239 Ų239139.4 Ų139.490%0.90281%0.811SS**  trans-47.3152.2-179.5-63.6166.6164.4170.2-6.1118.5
485R29.4Very low34.6Very low253 Ų253134.8 Ų134.896%0.95581%0.81SS**  -165.6152110.4-102.9179.2-169.2-152.44.1113.7
486R34.5Very low34.8Very low240 Ų240135.5 Ų135.591%0.90682%0.816SS**  trans-110.5167163.3-97.5-173.8-176.7-175.32.4106.9
487P39.5Very low34.7Very low127 Ų127135.1 Ų135.183%0.82581%0.814SS**  cis-151.317937.943.4-22.9000118.8
488G30.3Very low34.8Very low73 Ų73136.3 Ų136.375%0.75382%0.819SS**  trans99.5151.5144.100000118.5
489P48.9Very low34.8Very low136 Ų136137.5 Ų137.588%0.88382%0.816SS**  trans-125.9142.7-162.337.2-19.4000118.4
490G29.4Very low33.8Very low77 Ų77137.2 Ų137.279%0.79482%0.815SS**  trans76.8171.616100000117.3
491P41.2Very low33.1Very low119 Ų119138 Ų13877%0.77381%0.812SS**  cis-135.8173.1-1142.4-26.3000116
492R27.7Very low33.2Very low233 Ų233137.6 Ų137.688%0.87980%0.801SS**  trans66.1137.9150.9-78.8180179.9173.30.3123.7
493S27.7Very low33.1Very low108 Ų108141.7 Ų141.776%0.75581%0.805SS**  trans93.4114.1142.6-66.20000122.1
494A27.9Very low32.1Very low94 Ų94139.8 Ų139.878%0.77780%0.8SS**  trans53.4147.4130.900000120.5
495S28.8Very low31.8Very low107 Ų107136.6 Ų136.675%0.74880%0.8SS**  cis-159.5162.127.3-45.80000112.3
496A29.6Very low31.9Very low96 Ų96131 Ų13179%0.79380%0.795SS**  trans53.5143.4143.200000120.7
497S26.1Very low31.6Very low105 Ų105123.9 Ų123.973%0.73479%0.787SS**  cis-175.3149.1-545.50000109.4
498L28.4Very low31.1Very low179 Ų179126.7 Ų126.794%0.93779%0.786SS**  trans-176.5129.8136.6-98.1161.1000110.4
499L30.4Very low31Very low136 Ų136130.6 Ų130.671%0.71279%0.785SS**  trans-103.4-175.6177.9-91.9165.9000109.7D501L499-D501 HydrophobicContact CD2-CB 4.47Å
500P39.5Very low30.1Very low115 Ų115130 Ų13075%0.74778%0.782SS**  cis-122.6155.9516.99.4000114.8
501D32.7Very low30.2Very low140 Ų140133.3 Ų133.375%0.74978%0.777SS**  60.3139.272.9-79.6-17.2000114.8L499L499-D501 HydrophobicContact CD2-CB 4.47Å
502A30.8Very low29.6Very low69 Ų69133 Ų13357%0.5778%0.775SS**  cis-151.5-177.423.500000111
503F30.3Very low29.8Very low201 Ų201129.5 Ų129.588%0.88277%0.769SS**  cis-147.6152.322.5-90.3-82.7000113.4
504A28.1Very low29.9Very low88 Ų88128.6 Ų128.673%0.72777%0.768SS**  trans-130.5153.1165.300000110.4
505L27.4Very low30Very low172 Ų172132.6 Ų132.690%0.90178%0.775SS**  trans-124.184.7-179.1-82.8170.2000112.3
506T30.6Very low30.2Very low137 Ų137139.1 Ų139.184%0.8478%0.783SS**  trans-147.390.8164.753.20000111.2
507A27.9Very low30.4Very low90 Ų90145.4 Ų145.474%0.74479%0.787SS**  trans166.7109.2150.300000111.7
508F29Very low31.2Very low186 Ų186145.9 Ų145.982%0.81679%0.787SS**  trans-159.2133.1159.3-91.5-81.4000105.6
509E29.7Very low31.6Very low154 Ų154142.9 Ų142.972%0.7278%0.778SS**  cis-157.8148-1.1-153.6167.9-153.700109.7
510C29.7Very low32.1Very low123 Ų123138.9 Ų138.983%0.83177%0.77SS**  trans-90.5150.4162.6-86.40000109.9
511E30.3Very low32.3Very low147 Ų147139.7 Ų139.769%0.68778%0.776SS**  trans-45.8127.7177.9-177.7-169.4151.900115Q513E511-Q513 HydrophobicContact CG-CG 4.22Å; E511-Q513 PolarHBondContact O-N 3.33Å; E511-Q513 WeakPolarHBondContact OE1-CG 3.3Å; E511-Q513 PolarHBondContact OE1-NE2 2.95Å
512P29.9Very low32.5Very low112 Ų112142.1 Ų142.173%0.72778%0.78SS**  trans-89.196.7167.932.7-31000111.8A514P512-A514 PolarHBondContact O-N 2.63Å; P512-A514 VanDerWaalsContact O-N 3.16Å
513Q31.3Very low32.8Very low161 Ų161144.6 Ų144.675%0.75279%0.79SS**  trans-76.889.5166.1-69.2-173.5200111.6E511E511-Q513 HydrophobicContact CG-CG 4.22Å; E511-Q513 PolarHBondContact O-N 3.33Å; E511-Q513 WeakPolarHBondContact OE1-CG 3.3Å; E511-Q513 PolarHBondContact OE1-NE2 2.95Å
514A28.6Very low33.2Very low88 Ų88139.7 Ų139.773%0.72779%0.786SS**  trans-157.972168.900000115P512P512-A514 PolarHBondContact O-N 2.63Å; P512-A514 VanDerWaalsContact O-N 3.16Å
515L31.7Very low33.6Very low178 Ų178139.8 Ų139.893%0.93279%0.788SS**  trans-147.643.1154.6-114.5171.4000112.6
516R32.6Very low34Very low244 Ų244137.5 Ų137.592%0.92178%0.783SS**PPolyproline II helixtrans-86.4118.9161.3-87.6-175.7173.6158-0.4109.2
517R33.6Very low34Very low229 Ų229135.6 Ų135.686%0.86478%0.781SS**PPolyproline II helixtrans-56.9143.1158.3-76.3-177.2172.593.5-1.6108.7
518P41.8Very low34.3Very low115 Ų115139 Ų13975%0.74779%0.785SS**PPolyproline II helixtrans-63.6140.4163.529.1-33.1000108.8G520P518-G520 PolarHBondContact O-N 2.61Å
519P37.7Very low34.8Very low115 Ų115135.8 Ų135.875%0.74778%0.783SS**PPolyproline II helixtrans-63.8128161.928.4-31.3000107.9
520G40.6Very low34.8Very low53 Ų53136.1 Ų136.155%0.54679%0.79SS.*PPolyproline II helixtrans-63.9162.2167.900000110.7P518 F522P518-G520 PolarHBondContact O-N 2.61Å; G520-F522 PolarHBondContact O-N 3.01Å
521P43.2Very low34.8Very low132 Ų132133.6 Ų133.686%0.85778%0.784SS**PPolyproline II helixtrans-55129.8173.4-21.932.9000110.1
522F37.8Very low35Very low191 Ų191133 Ų13384%0.83879%0.791SS**PPolyproline II helixtrans-60.9133.7171.4-75.5-88.2000109.1G520 A524G520-F522 PolarHBondContact O-N 3.01Å; F522-A524 PolarHBondContact O-N 2.87Å
523P37.7Very low35.2Very low120 Ų120135 Ų13578%0.77980%0.795SS**PPolyproline II helixtrans-62.8138.2170.727.2-33000109.2A525P523-A525 PolarHBondContact O-N 3.28Å
524A37.4Very low36Very low98 Ų98133.3 Ų133.381%0.8180%0.799SS**PPolyproline II helixtrans-59.2136.2177.800000110.8F522F522-A524 PolarHBondContact O-N 2.87Å
525A37.3Very low36Very low91 Ų91132.6 Ų132.675%0.75280%0.799SS**PPolyproline II helixtrans-65.1138167.900000109.3P523P523-A525 PolarHBondContact O-N 3.28Å
526P35.8Very low36.1Very low123 Ų123133.5 Ų133.580%0.79980%0.799SS**PPolyproline II helixtrans-69134179.428.1-33.7000110.8
527A31.3Very low36.2Very low98 Ų98125.9 Ų125.981%0.8179%0.788SS**PPolyproline II helixtrans-73143.3171.500000111.2
528I32.7Very low36.8Very low160 Ų160120.7 Ų120.782%0.82178%0.784SS**  trans-127.9138.5161.9-68.1-175.7000106
529P39.8Very low36.5Very low119 Ų119121.4 Ų121.477%0.77379%0.786SS**  trans-95.6176.4-146.537.6-38.2000115.7
530D30Very low37.5Very low162 Ų162121.3 Ų121.387%0.86679%0.786SS**  trans-48.2152.8176.2-70.8-61.2000116.1
531G30.3Very low37.7Very low69 Ų69124.2 Ų124.271%0.71180%0.795SS**  trans-146.348.9174.100000113.2
532T32.9Very low37Very low134 Ų134123.6 Ų123.682%0.82279%0.794SS**  trans42108.8153.953.60000120.4
533D34.1Very low36.6Very low154 Ų154119.8 Ų119.882%0.82479%0.791SS**  trans-24.5167.4134.4-94.6-21.1000117
534P49.3Very low36.3Very low127 Ų127118.6 Ų118.683%0.82579%0.791SS**  cis-147.5173.632.140.9-20.7000119.5
535G29.3Very low35.9Very low72 Ų72122.6 Ų122.674%0.74279%0.793SS**  trans123.7125.115200000114
536E32.5Very low35.5Very low197 Ų197130 Ų13092%0.92180%0.801SS**  cis-158.9147.41-170.7174.9158.300108
537A35.1Very low35.5Very low84 Ų84129.3 Ų129.369%0.69480%0.8SS**  trans-121.3152.9176.700000110.4
538P45.5Very low36Very low121 Ų121130.7 Ų130.779%0.78680%0.8SS**  -141.8127.4110.430.8-14.5000116
539T36Very low35.9Very low129 Ų129126 Ų12679%0.79179%0.792SS**  trans21.3143.7142.351.20000123.9
540P58.8Low35.8Very low113 Ų113126.6 Ų126.673%0.73480%0.796SS**  trans-85.7-172.1169.543.7-39.7000111.3
541P45Very low36.1Very low114 Ų114130 Ų13074%0.7480%0.797SS**  -157.1-170.484.642.1-21.7000116.3
542S29.1Very low37.3Very low120 Ų120132.5 Ų132.584%0.83980%0.8SS**  trans103.4156.914682.80000118.9
543S29.8Very low37.1Very low110 Ų110130.9 Ų130.977%0.76980%0.8SS**  trans-130.6152.4-151.450.50000112.7
544A30.6Very low36.8Very low95 Ų95128.2 Ų128.279%0.78580%0.8SS**  trans69.2158.3144.800000121
545Q29.9Very low35.9Very low183 Ų183131 Ų13186%0.85580%0.801SS**  trans84.696.5147.9-154.6175.244.900119
546R27.4Very low36.8Very low245 Ų245132.1 Ų132.193%0.92580%0.796SS**  -163.9113.3121.6-107.4171-165.2-178.85.5112.6
547S36.9Very low36.6Very low110 Ų110131.4 Ų131.477%0.76979%0.792SS**  trans-76.8165142.8-47.40000108.1
548P41.4Very low36.6Very low126 Ų126132.1 Ų132.182%0.81880%0.798SS**  -140.6167.380.436.7-20.8000114.4
549G31Very low35.7Very low63 Ų63129.9 Ų129.965%0.64980%0.797SS**  trans-73-170.2160.300000111.8
550P37.6Very low35.4Very low131 Ų131133.9 Ų133.985%0.85180%0.804SS**  -142.6157.872.940-24.8000116.2
551R36.9Very low34Very low234 Ų234135.9 Ų135.988%0.88381%0.808SS**  trans-88.9-152.4153-54.6175161.6174.6-6.3107.6
552P53.5Low33.3Very low120 Ų120141.8 Ų141.878%0.77982%0.815SS**  cis-130.6176.5-32.227.6-6.8000113.1
553A29.4Very low33.6Very low100 Ų100141.4 Ų141.483%0.82681%0.81SS**  trans-179.9147134.500000109.8
554A28.7Very low33.4Very low99 Ų99139.5 Ų139.582%0.81881%0.808SS**  cis-154.8152.7-25.200000109.4
555H30.2Very low33.3Very low184 Ų184143 Ų14385%0.85281%0.812SS**  trans-76.1-165.6170.6-77-70000111.5
556P47.7Very low33.1Very low97 Ų97139.3 Ų139.363%0.6381%0.807SS**  -129.4-165.3-55.335.6-19.8000110.3
557H28.6Very low33.3Very low182 Ų182132 Ų13284%0.84380%0.799SS**  -164137.2111.6-106.362000112.5
558A34.2Very low32.7Very low98 Ų98132.3 Ų132.381%0.8180%0.801SS**  trans-94.3145.2163.900000108.9
559G27.1Very low32.2Very low75 Ų75138.1 Ų138.177%0.77381%0.807SS**  trans-141.388.3-178.700000111.7
560F30Very low32.1Very low212 Ų212138.4 Ų138.493%0.9381%0.81SS**  trans-58.5133.4150.3-109.2-106.6000107.6
561L28.4Very low31.9Very low156 Ų156140.9 Ų140.982%0.81781%0.81SS**  trans-173.9122.7138.7-103.6164.7000111.4
562R31.2Very low32.2Very low237 Ų237136.2 Ų136.289%0.89481%0.81SS**  trans-105.1128.2155.5-166.3-174.4-166.9-174.74.8105.6
563P34.3Very low30.9Very low112 Ų112133.8 Ų133.873%0.72781%0.807SS**  trans-129164.3140.424.2-7000111.5
564G25.8Very low30.9Very low71 Ų71132.3 Ų132.373%0.73280%0.802SS**  trans-85.7156.2-164.800000115.8
565L28.7Very low30.9Very low167 Ų167135.2 Ų135.287%0.87480%0.803SS**  trans-125.2115.4142.2-69.3164.6000103.8
566S25.9Very low30.9Very low107 Ų107137 Ų13775%0.74880%0.802SS**  57.17456.584.40000112.9
567A31.5Very low30Very low91 Ų91138.9 Ų138.975%0.75281%0.812SS**  trans-123.286.2159.700000108.1
568S25.6Very low30.1Very low117 Ų117139.9 Ų139.982%0.81882%0.817SS**PPolyproline II helixtrans-70.7121.3169.4490000109.8
569W31.1Very low29.7Very low247 Ų247138.9 Ų138.994%0.93682%0.816SS**PPolyproline II helixtrans-97.9116.7154.9-77.996.7000107.6
570G28.1Very low29.7Very low70 Ų70139.5 Ų139.572%0.72282%0.823SS**PPolyproline II helixtrans-93.6138.8178.900000111.7
571E34.2Very low29.6Very low183 Ų183133.4 Ų133.486%0.85582%0.819SS**PPolyproline II helixtrans-82.2149.6133.3-84.3-159.799.200107.9
572P42.1Very low29.5Very low135 Ų135129.9 Ų129.988%0.87782%0.821SS**  -149.6152.487.237.3-18.9000117.2
573G27.3Very low29.3Very low70 Ų70123.8 Ų123.872%0.72282%0.815SS**  trans126113.1161.800000112.8
574G28.3Very low29Very low69 Ų69124.8 Ų124.871%0.71182%0.819SS**  cis110.2111.87.700000111.9
575L29.5Very low29.1Very low159 Ų159127.6 Ų127.683%0.83283%0.827SS**  trans-177138.2157-104156.2000113.4
576R29.2Very low29.1Very low222 Ų222123.9 Ų123.984%0.83882%0.815SS**  trans82.389.3155.2-63.3-175.8179.8-167.7-1.2121.8
577T29.6Very low29.1Very low137 Ų137127.4 Ų127.484%0.8482%0.817SS**  -18.5136.5123.737.80000119.3
578E29.7Very low28.9Very low203 Ų203130 Ų13095%0.94982%0.818SS**  -158.6154.4121.6-99.9-175.8170.200107.2
579G26.8Very low29Very low77 Ų77129 Ų12979%0.79481%0.811SS**  cis155.690.9-4.500000113
580G26.6Very low29Very low88 Ų88123.2 Ų123.291%0.90780%0.803SS**  trans96.5152.5171.900000115.7
581G27.6Very low29.8Very low83 Ų83125.3 Ų125.386%0.85680%0.804SS**  cis139.8135.4-3.600000112.4
582G25.9Very low29.4Very low83 Ų83121.3 Ų121.386%0.85680%0.796SS**  trans121.6132.2166.800000115.7
583S28.7Very low28.8Very low109 Ų109123.8 Ų123.876%0.76280%0.796SS**  trans-112.4176.3-173.3-61.50000113.1
584T27.8Very low28.8Very low132 Ų132126.1 Ų126.181%0.8180%0.802SS**  trans82117.5156.669.80000119.3
585S27.4Very low28.9Very low130 Ų130128.2 Ų128.291%0.90981%0.805SS**  -167152.3102.439.70000111.3
586S28.3Very low28.8Very low89 Ų89124.2 Ų124.262%0.62280%0.802SS**  trans-112.5166.4-176.151.80000111.4
587F26.6Very low28.6Very low181 Ų181125 Ų12579%0.79481%0.807SS**  trans167.8115.2135-79.2-50.5000108.9
588L27.4Very low28.5Very low145 Ų145122.6 Ų122.676%0.75980%0.801SS**  62.6132.9100-63.8-178.5000114.2
589S26.8Very low28.4Very low97 Ų97118.8 Ų118.868%0.67879%0.792SS**  cis-156.6131.526.7-360000110.6
590T30.9Very low28.4Very low126 Ų126122.2 Ų122.277%0.77379%0.791SS**  64.8162.79770.70000118
591P44.3Very low28.4Very low114 Ų114126.5 Ų126.574%0.7479%0.787SS**  -136.6-175-71.541.8-23.9000113.5
592S26.8Very low28.5Very low99 Ų99127.7 Ų127.769%0.69278%0.782SS**  173.7132.5127.4-96.60000114.6
593E29.9Very low28.6Very low186 Ų186131.8 Ų131.887%0.86979%0.785SS**  trans55141.2142.3-60.2-178.3143.200120.8
594S27Very low28.8Very low120 Ų120131.8 Ų131.884%0.83979%0.785SS**  cis-150.3167.53.4-173.30000111.3
595S29.1Very low29Very low113 Ų113133.5 Ų133.579%0.7979%0.788SS**  trans-124.4147.2-176.91690000111.2
596G28.4Very low29.1Very low74 Ų74131 Ų13176%0.76378%0.783SS**  trans179.3103.1171.900000116
597Y25.1Very low29.2Very low238 Ų238132.3 Ų132.393%0.93379%0.792SS**  trans-73.9150.9161.6-85.9-116.1000110.8
598A27.9Very low29.3Very low88 Ų88128.7 Ų128.773%0.72780%0.795SS**  163.1109123.800000114.6
599T26.7Very low29.4Very low122 Ų122130.8 Ų130.875%0.74882%0.822SS**  22.9132.2129.149.60000123.4
600L26.7Very low29.6Very low149 Ų149132.5 Ų132.578%0.7883%0.829SS**  trans90.1117.5135.3-69.7165.8000121.4
601H27.3Very low29.5Very low179 Ų179132.8 Ų132.883%0.82983%0.832SS**  trans56.6122.7141.7-89.7-96.3000121.7
602S28.9Very low28.7Very low108 Ų108133.8 Ų133.876%0.75584%0.837SS**  trans-56.6143.9160.6-38.60000112.4
603D29.1Very low28.8Very low169 Ų169135.9 Ų135.990%0.90485%0.845SS**  -150163.2127.9-111.3-29.6000112.6
604S31.9Very low28.7Very low109 Ų109132.8 Ų132.876%0.76284%0.844SS**  trans-43.5144.3-161-166.10000119
605L32.3Very low28.8Very low168 Ų168133.6 Ų133.688%0.8884%0.844SS**  trans-55.3142.1156.1-73.8155.9000111.6
606G28.8Very low28.8Very low77 Ų77135.1 Ų135.179%0.79485%0.848SS**  trans-136.8124.2161.200000108.6
607S32.3Very low28.8Very low117 Ų117139.8 Ų139.882%0.81886%0.855SS**  trans-89.1159.6-169.9-59.90000114
608A28.4Very low29.1Very low104 Ų104131.6 Ų131.686%0.8685%0.848SS**  trans70.4141.3173.500000115.3
609S29.4Very low29.3Very low189 Ų189135.5 Ų135.5100%1.32286%0.859SS**  cis-145.3011.658.60000112.1

Retrieved 609 of 609 residues in 2423.6 ms (Link to these results)