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Polyprenal reductase

Plays a key role in early steps of protein N-linked glycosylation by being involved in the conversion of polyprenol into dolichol. Acts as a polyprenal reductase that mediates the reduction of polyprenal into dolichal in a NADP-dependent mechanism. Dolichols are required for the synthesis of dolichol-linked monosaccharides and the oligosaccharide precursor used for N-glycosylation. Also able to convert testosterone (T) into 5-alpha-dihydrotestosterone (DHT).

AlphaFold DB , UniProt , Accession A0A060XAT3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 319 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
1M42.7Very low66.9Low201 Ų20184.4 Ų84.499%0.9948%0.477SS*.  0-40.40-138.2175.684.900112.4T3 L4M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.06Å; M1-L4 PolarHBondContact O-N 3.38Å
2L41.3Very low69Low117 Ų11788.3 Ų88.361%0.61349%0.485SS*.G310 helixtrans-59.1-35174.8-83.3141.8000114.6
3T46.5Very low71Confident134 Ų13485.9 Ų85.982%0.82247%0.471SS*.G310 helixtrans-84.3-10-178.434.10000115.4M1M1-T3 VanDerWaalsContact C-N 3.34Å; M1-T3 PolarHBondContact O-N 3.06Å
4L45.9Very low72.8Confident148 Ų14879.8 Ų79.878%0.77544%0.437SS*.G310 helixtrans-81-15-173.4-98.8144.3000114.1M1M1-L4 PolarHBondContact O-N 3.38Å
5L55Low74.4Confident141 Ų14177.6 Ų77.674%0.73843%0.425SS*.THydrogen-bonded Turntrans-120.4-3.5179.9-75.1160000113.5F7L5-F7 VanDerWaalsContact C-N 3.28Å; L5-F7 HydrophobicContact CB-CD2 3.68Å; L5-F7 HydrophobicContact CB-CE2 4.19Å; L5-F7 VanDerWaalsContact O-CD2 3.31Å; L5-F7 WeakPolarHBondContact O-CD2 3.23Å; L5-F7 PolarHBondContact O-N 3.28Å
6G68.5Low75.8Confident63 Ų6375.1 Ų75.165%0.64942%0.415SS*.THydrogen-bonded Turntrans70.816.7-176.400000115.1
7F77.8Confident77Confident63 Ų6372.8 Ų72.828%0.27640%0.401SS..  trans-88.9132.8177.8-79-112.1000111.1L5 D11 L15 L276 L280L5-F7 VanDerWaalsContact C-N 3.28Å; L5-F7 HydrophobicContact CB-CD2 3.68Å; L5-F7 HydrophobicContact CB-CE2 4.19Å; L5-F7 VanDerWaalsContact O-CD2 3.31Å; L5-F7 WeakPolarHBondContact O-CD2 3.23Å; L5-F7 PolarHBondContact O-N 3.28Å; F7-D11 HydrophobicContact CB-CB 4.17Å; F7-D11 HydrophobicContact CD1-CB 3.46Å; F7-D11 VanDerWaalsContact CD1-CB 3.46Å; F7-D11 HydrophobicContact CE1-CB 4.25Å; F7-D11 HydrophobicContact CG-CB 4.18Å; F7-L15 HydrophobicContact CE1-CD2 3.98Å; F7-L276 HydrophobicContact CE1-CD2 4.21Å; F7-L276 HydrophobicContact CE2-CD2 4.46Å; F7-L276 HydrophobicContact CZ-CD2 4.1Å; F7-L280 HydrophobicContact CE1-CD1 4.12Å
8C85.4Confident78.2Confident20 Ų2068.8 Ų68.814%0.13538%0.38CS..  trans-82.2169.3168.9-620000111.2I10 D11 F12 T116C8-I10 VanDerWaalsContact C-N 3.25Å; C8-I10 HydrophobicContact CB-CG2 4.09Å; C8-I10 PolarHBondContact O-N 2.84Å; C8-D11 WeakPolarHBondContact CB-OD2 3.38Å; C8-D11 PolarHBondContact N-OD2 2.91Å; C8-D11 WeakPolarHBondContact O-CB 3.17Å; C8-D11 PolarHBondContact O-N 3.44Å; C8-D11 VanDerWaalsContact O-N 3.11Å; C8-F12 PolarHBondContact O-N 3.25Å; C8-F12 VanDerWaalsContact O-N 3.1Å; C8-T116 WeakPolarHBondContact CB-O 3.48Å; C8-T116 PolarHBondContact SG-O 2.96Å
9V90.1Very high79.3Confident37 Ų3770.1 Ų70.122%0.22439%0.385CS..Hα-helixtrans-58.1-40.9178175.60000111D11 F12 L13 F114 L115V9-D11 VanDerWaalsContact C-N 3.32Å; V9-D11 PolarHBondContact O-N 3.1Å; V9-F12 PolarHBondContact O-N 3.27Å; V9-L13 WeakPolarHBondContact O-CB 3.12Å; V9-L13 PolarHBondContact O-N 3.48Å; V9-F114 HydrophobicContact CG1-CE1 4.19Å; V9-L115 HydrophobicContact CG1-CD2 4.46Å; V9-L115 PolarHBondContact N-O 3.41Å
10I91.4Very high80.2Confident0 Ų070.5 Ų70.50%039%0.392CS..Hα-helixtrans-63.7-36.1177.8-168.259.6000112.7C8 L13 W14 L115 L174 T178 C181 T277C8-I10 VanDerWaalsContact C-N 3.25Å; C8-I10 HydrophobicContact CB-CG2 4.09Å; C8-I10 PolarHBondContact O-N 2.84Å; I10-L13 PolarHBondContact O-N 3.03Å; I10-W14 PolarHBondContact O-N 3.3Å; I10-L115 HydrophobicContact CB-CB 4.31Å; I10-L115 HydrophobicContact CD1-CD2 4.35Å; I10-L115 PolarHBondContact N-O 2.88Å; I10-L174 HydrophobicContact CD1-CD1 3.54Å; I10-L174 HydrophobicContact CD1-CG 4.32Å; I10-T178 HydrophobicContact CG1-CG2 4.37Å; I10-C181 HydrophobicContact CG2-CB 4.26Å; I10-T277 HydrophobicContact CB-CG2 4.36Å; I10-T277 HydrophobicContact CG1-CG2 3.82Å; I10-T277 HydrophobicContact CG2-CG2 3.74Å
11D91.6Very high81Confident4 Ų469.3 Ų69.32%0.02138%0.383CS..Hα-helixtrans-68-45.9177.6-59.1-42.1000110.6F7 C8 V9 L13 W14 L15 T277 L280F7-D11 HydrophobicContact CB-CB 4.17Å; F7-D11 HydrophobicContact CD1-CB 3.46Å; F7-D11 VanDerWaalsContact CD1-CB 3.46Å; F7-D11 HydrophobicContact CE1-CB 4.25Å; F7-D11 HydrophobicContact CG-CB 4.18Å; C8-D11 WeakPolarHBondContact CB-OD2 3.38Å; C8-D11 PolarHBondContact N-OD2 2.91Å; C8-D11 WeakPolarHBondContact O-CB 3.17Å; C8-D11 PolarHBondContact O-N 3.44Å; C8-D11 VanDerWaalsContact O-N 3.11Å; V9-D11 VanDerWaalsContact C-N 3.32Å; V9-D11 PolarHBondContact O-N 3.1Å; D11-L13 VanDerWaalsContact C-N 3.26Å; D11-L13 PolarHBondContact O-N 3.47Å; D11-W14 PolarHBondContact O-N 2.98Å; D11-L15 VanDerWaalsContact O-CB 3.27Å; D11-L15 WeakPolarHBondContact O-CB 3.38Å; D11-L15 PolarHBondContact O-N 3.34Å; D11-T277 WeakPolarHBondContact OD1-CA 3.32Å; D11-T277 WeakPolarHBondContact OD1-CB 3.43Å; D11-T277 VanDerWaalsContact OD1-CG2 3.32Å; D11-T277 WeakPolarHBondContact OD1-CG2 3.46Å; D11-T277 PolarHBondContact OD1-OG1 3.05Å; D11-L280 HydrophobicContact CB-CD1 3.66Å; D11-L280 WeakPolarHBondContact O-CD1 3.33Å
12F92.1Very high83.6Confident131 Ų13162.4 Ų62.458%0.57535%0.35SS*.Hα-helixtrans-60.6-39.6177.3-176.2-96.9000111.7C8 V9 S16C8-F12 PolarHBondContact O-N 3.25Å; C8-F12 VanDerWaalsContact O-N 3.1Å; V9-F12 PolarHBondContact O-N 3.27Å; F12-S16 WeakPolarHBondContact CE1-OG 3.3Å; F12-S16 WeakPolarHBondContact O-CB 3.4Å; F12-S16 PolarHBondContact O-N 3.19Å; F12-S16 PolarHBondContact O-OG 3.21Å
13L94.9Very high86.3Confident58 Ų5862.1 Ų62.130%0.30435%0.349SS..Hα-helixtrans-61-53176.7-170.8164.2000110.6V9 I10 D11 L15 S16 L17 L174V9-L13 WeakPolarHBondContact O-CB 3.12Å; V9-L13 PolarHBondContact O-N 3.48Å; I10-L13 PolarHBondContact O-N 3.03Å; D11-L13 VanDerWaalsContact C-N 3.26Å; D11-L13 PolarHBondContact O-N 3.47Å; L13-L15 PolarHBondContact O-N 2.99Å; L13-S16 PolarHBondContact O-N 2.93Å; L13-L17 HydrophobicContact CD2-CD1 3.55Å; L13-L17 HydrophobicContact CD2-CG 4.11Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.09Å; L13-L174 HydrophobicContact CD1-CD1 4.2Å; L13-L174 HydrophobicContact CD1-CD2 4.23Å; L13-L174 HydrophobicContact CD2-CD2 3.4Å; L13-L174 HydrophobicContact CG-CD2 4.48Å
14W96.7Very high88.7Confident0 Ų056.4 Ų56.40%032%0.315CS..Hα-helixtrans-65.1-40-179.9-75.5118.9000113.1I10 D11 L17 A18 Y171 L174 L175 T178 L280 V281 Y284I10-W14 PolarHBondContact O-N 3.3Å; D11-W14 PolarHBondContact O-N 2.98Å; W14-L17 HydrophobicContact CE3-CD1 3.92Å; W14-L17 HydrophobicContact CZ3-CD1 3.96Å; W14-L17 PolarHBondContact O-N 3.04Å; W14-A18 WeakPolarHBondContact O-CB 3.27Å; W14-A18 PolarHBondContact O-N 3.39Å; W14-Y171 AromaticContact CH2-CD2 3.68Å; W14-Y171 HydrophobicContact CH2-CD2 3.68Å; W14-Y171 AromaticContact CH2-CE2 3.43Å; W14-Y171 HydrophobicContact CH2-CE2 3.43Å; W14-Y171 VanDerWaalsContact CH2-CE2 3.43Å; W14-Y171 AromaticContact CZ3-CD2 3.99Å; W14-Y171 HydrophobicContact CZ3-CD2 3.99Å; W14-Y171 AromaticContact CZ3-CE2 3.66Å; W14-Y171 HydrophobicContact CZ3-CE2 3.66Å; W14-L174 HydrophobicContact CH2-CD2 3.83Å; W14-L174 HydrophobicContact CH2-CG 4.32Å; W14-L174 HydrophobicContact CZ2-CB 4.46Å; W14-L174 HydrophobicContact CZ2-CD2 3.55Å; W14-L174 HydrophobicContact CZ2-CG 3.68Å; W14-L174 HydrophobicContact CZ3-CD2 4.46Å; W14-L175 HydrophobicContact CZ2-CD1 4.45Å; W14-T178 PolarHBondContact NE1-OG1 3.37Å; W14-L280 HydrophobicContact CB-CB 3.65Å; W14-V281 HydrophobicContact CD2-CG2 3.76Å; W14-V281 HydrophobicContact CE3-CG2 4.31Å; W14-V281 HydrophobicContact CG-CG2 4.03Å; W14-V281 HydrophobicContact CH2-CG1 4.43Å; W14-V281 HydrophobicContact CZ2-CG2 3.98Å; W14-V281 HydrophobicContact CZ3-CG1 4.49Å; W14-Y284 HydrophobicContact CE3-CD1 4.13Å; W14-Y284 HydrophobicContact CE3-CG 4.04Å; W14-Y284 AromaticContact CZ3-CD1 3.66Å; W14-Y284 HydrophobicContact CZ3-CD1 3.66Å; W14-Y284 HydrophobicContact CZ3-CE1 4.12Å; W14-Y284 AromaticContact CZ3-CG 4Å; W14-Y284 HydrophobicContact CZ3-CG 4Å
15L96.4Very high91.1Very high47 Ų4750.8 Ų50.825%0.24628%0.284CS..Hα-helixtrans-62-45.6174.9179.960.7000111.1F7 D11 L13 L17 A18 L19 L280F7-L15 HydrophobicContact CE1-CD2 3.98Å; D11-L15 VanDerWaalsContact O-CB 3.27Å; D11-L15 WeakPolarHBondContact O-CB 3.38Å; D11-L15 PolarHBondContact O-N 3.34Å; L13-L15 PolarHBondContact O-N 2.99Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 2.77Å; L15-A18 PolarHBondContact O-N 2.98Å; L15-L19 HydrophobicContact CD1-CD1 4.21Å; L15-L19 HydrophobicContact CD1-CG 4.18Å; L15-L19 HydrophobicContact CG-CD1 4.07Å; L15-L19 HydrophobicContact CG-CG 4.44Å; L15-L19 WeakPolarHBondContact O-CB 3.05Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.34Å; L15-L19 PolarHBondContact O-N 2.9Å; L15-L280 HydrophobicContact CB-CD1 4.4Å; L15-L280 HydrophobicContact CB-CD2 4.19Å; L15-L280 HydrophobicContact CD1-CD2 4.05Å
16S96.4Very high93Very high38 Ų3846.5 Ų46.527%0.26627%0.265SS..Hα-helixtrans-60.1-45177.3-62.90000111.1F12 L13 L19 C20F12-S16 WeakPolarHBondContact CE1-OG 3.3Å; F12-S16 WeakPolarHBondContact O-CB 3.4Å; F12-S16 PolarHBondContact O-N 3.19Å; F12-S16 PolarHBondContact O-OG 3.21Å; L13-S16 PolarHBondContact O-N 2.93Å; S16-L19 PolarHBondContact O-N 3.26Å; S16-C20 WeakPolarHBondContact O-CB 3.19Å; S16-C20 PolarHBondContact O-N 2.83Å; S16-C20 PolarHBondContact O-SG 3.4Å
17L97.1Very high94.2Very high36 Ų3646.5 Ų46.519%0.18825%0.252CS..Hα-helixtrans-61-46.1175.3-71.1178.9000111.8L13 W14 L15 L19 C20 F21 F167 Y284L13-L17 HydrophobicContact CD2-CD1 3.55Å; L13-L17 HydrophobicContact CD2-CG 4.11Å; L13-L17 WeakPolarHBondContact O-CG 3.34Å; L13-L17 PolarHBondContact O-N 3.09Å; W14-L17 HydrophobicContact CE3-CD1 3.92Å; W14-L17 HydrophobicContact CZ3-CD1 3.96Å; W14-L17 PolarHBondContact O-N 3.04Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 2.77Å; L17-L19 PolarHBondContact O-N 2.89Å; L17-C20 PolarHBondContact O-N 3.42Å; L17-F21 WeakPolarHBondContact O-CD2 3.48Å; L17-F21 PolarHBondContact O-N 3.48Å; L17-F21 VanDerWaalsContact O-N 3.09Å; L17-F167 HydrophobicContact CD1-CE2 4.11Å; L17-F167 HydrophobicContact CD1-CZ 4.3Å; L17-F167 HydrophobicContact CD2-CE2 3.68Å; L17-F167 HydrophobicContact CD2-CZ 4.21Å; L17-Y284 HydrophobicContact CB-CD2 3.6Å; L17-Y284 HydrophobicContact CB-CE2 4.07Å; L17-Y284 HydrophobicContact CB-CG 4.41Å
18A98.1Very high95Very high1 Ų143.7 Ų43.71%0.00824%0.24CC..Hα-helixtrans-58.7-47.3177.400000111.5W14 L15 C20 F21 L22 L283 F287W14-A18 WeakPolarHBondContact O-CB 3.27Å; W14-A18 PolarHBondContact O-N 3.39Å; L15-A18 PolarHBondContact O-N 2.98Å; A18-C20 PolarHBondContact O-N 3.41Å; A18-F21 PolarHBondContact O-N 3.24Å; A18-L22 WeakPolarHBondContact O-CB 3.42Å; A18-L22 PolarHBondContact O-N 3.3Å; A18-L283 HydrophobicContact CB-CB 4.39Å; A18-L283 HydrophobicContact CB-CD2 4.12Å; A18-L283 HydrophobicContact CB-CG 4.02Å; A18-F287 HydrophobicContact CB-CD2 4.11Å; A18-F287 HydrophobicContact CB-CE2 4.48Å; A18-F287 VanDerWaalsContact O-CD2 3.25Å; A18-F287 WeakPolarHBondContact O-CD2 3.18Å
19L98.1Very high95.2Very high93 Ų9346.9 Ų46.949%0.48725%0.25SC..Hα-helixtrans-63.7-39.5177.9-69.4175.8000112.4L15 S16 L17 F21 L22 L23L15-L19 HydrophobicContact CD1-CD1 4.21Å; L15-L19 HydrophobicContact CD1-CG 4.18Å; L15-L19 HydrophobicContact CG-CD1 4.07Å; L15-L19 HydrophobicContact CG-CG 4.44Å; L15-L19 WeakPolarHBondContact O-CB 3.05Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.34Å; L15-L19 PolarHBondContact O-N 2.9Å; S16-L19 PolarHBondContact O-N 3.26Å; L17-L19 PolarHBondContact O-N 2.89Å; L19-F21 PolarHBondContact O-N 3.08Å; L19-L22 PolarHBondContact O-N 2.9Å; L19-L23 VanDerWaalsContact O-CB 3.26Å; L19-L23 WeakPolarHBondContact O-CB 3.1Å; L19-L23 PolarHBondContact O-N 3.32Å
20C97.4Very high95.2Very high78 Ų7850.6 Ų50.653%0.52727%0.267SS..Hα-helixtrans-60.8-43.9175.4-74.10000112.1S16 L17 A18 L23 A24S16-C20 WeakPolarHBondContact O-CB 3.19Å; S16-C20 PolarHBondContact O-N 2.83Å; S16-C20 PolarHBondContact O-SG 3.4Å; L17-C20 PolarHBondContact O-N 3.42Å; A18-C20 PolarHBondContact O-N 3.41Å; C20-L23 PolarHBondContact O-N 3.43Å; C20-A24 WeakPolarHBondContact O-CB 3.31Å; C20-A24 PolarHBondContact O-N 3.43Å
21F97.6Very high95Very high46 Ų4650.8 Ų50.820%0.20227%0.269CS..Hα-helixtrans-72.1-35.7178.2-86.2-89.7000112.7L17 A18 L19 A24 F25 F167 Y284 F287 N288 L291L17-F21 WeakPolarHBondContact O-CD2 3.48Å; L17-F21 PolarHBondContact O-N 3.48Å; L17-F21 VanDerWaalsContact O-N 3.09Å; A18-F21 PolarHBondContact O-N 3.24Å; L19-F21 PolarHBondContact O-N 3.08Å; F21-A24 PolarHBondContact O-N 2.87Å; F21-F25 WeakPolarHBondContact O-CB 3.35Å; F21-F25 PolarHBondContact O-N 3.17Å; F21-F167 HydrophobicContact CE2-CZ 4.38Å; F21-Y284 HydrophobicContact CD2-CD2 4.09Å; F21-Y284 AromaticContact CD2-CE2 3.57Å; F21-Y284 HydrophobicContact CD2-CE2 3.57Å; F21-Y284 HydrophobicContact CE2-CD2 4.49Å; F21-Y284 AromaticContact CE2-CE2 3.56Å; F21-Y284 HydrophobicContact CE2-CE2 3.56Å; F21-Y284 HydrophobicContact CG-CE2 4.39Å; F21-Y284 HydrophobicContact CZ-CE2 4.36Å; F21-F287 HydrophobicContact CB-CB 3.86Å; F21-N288 HydrophobicContact CD1-CB 3.85Å; F21-N288 HydrophobicContact CE1-CB 4.05Å; F21-N288 WeakPolarHBondContact CE1-OD1 3.36Å; F21-N288 HydrophobicContact CG-CB 4.18Å; F21-L291 HydrophobicContact CD1-CD2 4Å; F21-L291 HydrophobicContact CE1-CD2 4.43Å
22L97.8Very high94.4Very high56 Ų5657 Ų5729%0.29329%0.292SS..Hα-helixtrans-61.9-47.2170.9176.459.1000111.1A18 L19 A24 F25 C26 F287A18-L22 WeakPolarHBondContact O-CB 3.42Å; A18-L22 PolarHBondContact O-N 3.3Å; L19-L22 PolarHBondContact O-N 2.9Å; L22-A24 VanDerWaalsContact C-N 3.34Å; L22-A24 PolarHBondContact O-N 3.38Å; L22-F25 WeakPolarHBondContact O-CB 3.41Å; L22-F25 PolarHBondContact O-N 3.45Å; L22-C26 PolarHBondContact O-N 2.97Å; L22-C26 PolarHBondContact O-SG 3.43Å; L22-C26 VanDerWaalsContact O-SG 3.34Å; L22-F287 HydrophobicContact CB-CB 4.48Å; L22-F287 HydrophobicContact CB-CD1 4.21Å; L22-F287 HydrophobicContact CB-CD2 3.74Å; L22-F287 HydrophobicContact CB-CE1 4.38Å; L22-F287 HydrophobicContact CB-CE2 3.88Å; L22-F287 HydrophobicContact CB-CG 3.9Å; L22-F287 HydrophobicContact CB-CZ 4.21Å; L22-F287 HydrophobicContact CD1-CD1 3.94Å; L22-F287 HydrophobicContact CD1-CE1 3.7Å; L22-F287 HydrophobicContact CD1-CG 4.49Å; L22-F287 HydrophobicContact CD1-CZ 4.01Å; L22-F287 HydrophobicContact CD2-CE1 4.4Å; L22-F287 HydrophobicContact CD2-CE2 4Å; L22-F287 HydrophobicContact CD2-CZ 3.85Å; L22-F287 HydrophobicContact CG-CE1 4.37Å; L22-F287 HydrophobicContact CG-CE2 4.35Å; L22-F287 HydrophobicContact CG-CZ 4.24Å
23L97.4Very high93.9Very high111 Ų11159.8 Ų59.858%0.58130%0.3SS*.Hα-helixtrans-60.3-45.9177-179.564.7000110.6L19 C20 F25 C26 V27L19-L23 VanDerWaalsContact O-CB 3.26Å; L19-L23 WeakPolarHBondContact O-CB 3.1Å; L19-L23 PolarHBondContact O-N 3.32Å; C20-L23 PolarHBondContact O-N 3.43Å; L23-F25 VanDerWaalsContact C-N 3.31Å; L23-F25 PolarHBondContact O-N 3.32Å; L23-C26 PolarHBondContact O-N 2.85Å; L23-V27 HydrophobicContact CD1-CG2 4.02Å; L23-V27 HydrophobicContact CG-CG2 4.21Å; L23-V27 WeakPolarHBondContact O-CB 3.49Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.43Å; L23-V27 PolarHBondContact O-N 3.2Å
24A96.6Very high93.1Very high14 Ų1461.2 Ų61.212%0.11631%0.307CS..Hα-helixtrans-59.8-41.1175.900000111.9C20 F21 L22 H28 F47 I51 L291C20-A24 WeakPolarHBondContact O-CB 3.31Å; C20-A24 PolarHBondContact O-N 3.43Å; F21-A24 PolarHBondContact O-N 2.87Å; L22-A24 VanDerWaalsContact C-N 3.34Å; L22-A24 PolarHBondContact O-N 3.38Å; A24-H28 WeakPolarHBondContact O-CB 3.47Å; A24-H28 PolarHBondContact O-N 2.86Å; A24-F47 HydrophobicContact CB-CE2 4.07Å; A24-F47 HydrophobicContact CB-CZ 4.21Å; A24-I51 HydrophobicContact CB-CG2 4.29Å; A24-L291 HydrophobicContact CB-CD2 3.83Å
25F96.1Very high92Very high30 Ų3065.6 Ų65.613%0.13234%0.336CS..Hα-helixtrans-61-49.9173.4-179.5-93000112.3F21 L22 L23 H28 R29 A290 L291 Q294 L319F21-F25 WeakPolarHBondContact O-CB 3.35Å; F21-F25 PolarHBondContact O-N 3.17Å; L22-F25 WeakPolarHBondContact O-CB 3.41Å; L22-F25 PolarHBondContact O-N 3.45Å; L23-F25 VanDerWaalsContact C-N 3.31Å; L23-F25 PolarHBondContact O-N 3.32Å; F25-H28 PolarHBondContact O-N 2.94Å; F25-R29 HydrophobicContact CD1-CG 4.17Å; F25-R29 HydrophobicContact CE1-CG 3.82Å; F25-R29 HydrophobicContact CE2-CG 4.3Å; F25-R29 HydrophobicContact CZ-CG 3.89Å; F25-R29 WeakPolarHBondContact O-CB 3.33Å; F25-R29 VanDerWaalsContact O-CG 3.28Å; F25-R29 WeakPolarHBondContact O-CG 3.34Å; F25-R29 PolarHBondContact O-N 3.06Å; F25-A290 HydrophobicContact CD2-CB 4.37Å; F25-A290 HydrophobicContact CE2-CB 4.31Å; F25-L291 HydrophobicContact CB-CB 4.49Å; F25-L291 HydrophobicContact CD2-CB 4.33Å; F25-L291 HydrophobicContact CD2-CD1 4.47Å; F25-Q294 HydrophobicContact CE2-CB 3.89Å; F25-Q294 HydrophobicContact CE2-CG 4.1Å; F25-L319 HydrophobicContact CE2-CD1 4.49Å; F25-L319 HydrophobicContact CE2-CD2 4.14Å; F25-L319 HydrophobicContact CZ-CD1 3.95Å; F25-L319 HydrophobicContact CZ-CD2 3.82Å
26C95.6Very high90.6Very high51 Ų5168.6 Ų68.635%0.34536%0.356SS..Hα-helixtrans-61.7-48.6178.7-69.90000111.7L22 L23 H28 R29 L30L22-C26 PolarHBondContact O-N 2.97Å; L22-C26 PolarHBondContact O-SG 3.43Å; L22-C26 VanDerWaalsContact O-SG 3.34Å; L23-C26 PolarHBondContact O-N 2.85Å; C26-H28 VanDerWaalsContact C-N 3.33Å; C26-H28 PolarHBondContact O-N 2.9Å; C26-R29 PolarHBondContact O-N 3.36Å; C26-L30 WeakPolarHBondContact O-CB 3.31Å; C26-L30 VanDerWaalsContact O-CG 3.25Å; C26-L30 WeakPolarHBondContact O-CG 3.33Å; C26-L30 PolarHBondContact O-N 3.44Å
27V94.2Very high89.1Confident62 Ų6269.5 Ų69.538%0.37637%0.372SS..Hα-helixtrans-58.8-45.2176.7171.50000110.5L23 R29 L30 S31 F47L23-V27 HydrophobicContact CD1-CG2 4.02Å; L23-V27 HydrophobicContact CG-CG2 4.21Å; L23-V27 WeakPolarHBondContact O-CB 3.49Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.43Å; L23-V27 PolarHBondContact O-N 3.2Å; V27-R29 PolarHBondContact O-N 2.89Å; V27-L30 PolarHBondContact O-N 3.23Å; V27-S31 VanDerWaalsContact O-CB 3.24Å; V27-S31 WeakPolarHBondContact O-CB 3.49Å; V27-S31 PolarHBondContact O-N 3.32Å; V27-F47 HydrophobicContact CB-CE1 4.37Å; V27-F47 HydrophobicContact CB-CZ 4Å; V27-F47 HydrophobicContact CG1-CD1 4.35Å; V27-F47 HydrophobicContact CG1-CE1 3.73Å; V27-F47 HydrophobicContact CG1-CE2 4.4Å; V27-F47 HydrophobicContact CG1-CZ 3.76Å
28H93.4Very high87.7Confident4 Ų470.5 Ų70.52%0.01938%0.381CS..Hα-helixtrans-61.3-45.8177.1178.870000112A24 F25 C26 S31 F47 Q48 I51 R52 L291 L295 E298A24-H28 WeakPolarHBondContact O-CB 3.47Å; A24-H28 PolarHBondContact O-N 2.86Å; F25-H28 PolarHBondContact O-N 2.94Å; C26-H28 VanDerWaalsContact C-N 3.33Å; C26-H28 PolarHBondContact O-N 2.9Å; H28-S31 PolarHBondContact O-N 3.4Å; H28-S31 PolarHBondContact O-OG 2.91Å; H28-F47 HydrophobicContact CB-CE1 4.29Å; H28-F47 HydrophobicContact CB-CZ 4.49Å; H28-Q48 PolarHBondContact ND1-NE2 2.99Å; H28-I51 HydrophobicContact CB-CD1 4.11Å; H28-R52 PolarHBondContact CE1-NH2 2.98Å; H28-L291 HydrophobicContact CB-CD1 4.34Å; H28-L295 VanDerWaalsContact CE1-CD2 3.43Å; H28-L295 WeakPolarHBondContact CE1-CD2 3.49Å; H28-E298 IonicContact CD2-OE1 2.85Å; H28-E298 IonicContact CE1-OE2 2.93Å; H28-E298 IonicContact NE2-OE1 3.69Å; H28-E298 PolarHBondContact NE2-OE1 3.13Å; H28-E298 IonicContact NE2-OE2 2.95Å; H28-E298 PolarHBondContact NE2-OE2 3.17Å; H28-E298 VanDerWaalsContact NE2-OE2 3.11Å
29R91.3Very high86.3Confident88 Ų8874.6 Ų74.633%0.33240%0.4SS..Hα-helixtrans-64.6-43.2178.2-72.4-71.6-65.3-110.5-8.5112.4F25 C26 V27 S31F25-R29 HydrophobicContact CD1-CG 4.17Å; F25-R29 HydrophobicContact CE1-CG 3.82Å; F25-R29 HydrophobicContact CE2-CG 4.3Å; F25-R29 HydrophobicContact CZ-CG 3.89Å; F25-R29 WeakPolarHBondContact O-CB 3.33Å; F25-R29 VanDerWaalsContact O-CG 3.28Å; F25-R29 WeakPolarHBondContact O-CG 3.34Å; F25-R29 PolarHBondContact O-N 3.06Å; C26-R29 PolarHBondContact O-N 3.36Å; V27-R29 PolarHBondContact O-N 2.89Å; R29-S31 VanDerWaalsContact C-N 3.31Å
30L90.1Very high85.2Confident114 Ų11477.5 Ų77.560%0.59741%0.411SS*.Hα-helixtrans-68.8-31.6177.7-70.1172000111.8C26 V27 R32 Y33C26-L30 WeakPolarHBondContact O-CB 3.31Å; C26-L30 VanDerWaalsContact O-CG 3.25Å; C26-L30 WeakPolarHBondContact O-CG 3.33Å; C26-L30 PolarHBondContact O-N 3.44Å; V27-L30 PolarHBondContact O-N 3.23Å; L30-R32 PolarHBondContact O-N 3.41Å; L30-R32 VanDerWaalsContact O-N 3.1Å; L30-Y33 PolarHBondContact O-N 2.86Å
31S86.8Confident84.6Confident5 Ų576.4 Ų76.44%0.03541%0.405CS..Hα-helixtrans-62.8-20.8-178.574.20000114V27 H28 R29 Y33 L34V27-S31 VanDerWaalsContact O-CB 3.24Å; V27-S31 WeakPolarHBondContact O-CB 3.49Å; V27-S31 PolarHBondContact O-N 3.32Å; H28-S31 PolarHBondContact O-N 3.4Å; H28-S31 PolarHBondContact O-OG 2.91Å; R29-S31 VanDerWaalsContact C-N 3.31Å; S31-Y33 PolarHBondContact O-N 3.48Å; S31-L34 WeakPolarHBondContact O-CB 3.25Å; S31-L34 PolarHBondContact O-N 2.78Å
32R77.8Confident84.1Confident135 Ų13582.8 Ų82.851%0.50943%0.432SS..THydrogen-bonded Turntrans-70.1-19.3174.2-66.3170.5159.6-118.7-34.8113.9L30 E298L30-R32 PolarHBondContact O-N 3.41Å; L30-R32 VanDerWaalsContact O-N 3.1Å; R32-E298 IonicContact CZ-OE1 3.25Å; R32-E298 IonicContact CZ-OE2 3.05Å; R32-E298 IonicContact NE-OE1 2.8Å; R32-E298 PolarHBondContact NE-OE1 3.24Å; R32-E298 IonicContact NE-OE2 3.91Å; R32-E298 IonicContact NH1-OE1 2.83Å; R32-E298 IonicContact NH2-OE1 2.82Å; R32-E298 PolarHBondContact NH2-OE1 3.3Å; R32-E298 IonicContact NH2-OE2 3.21Å; R32-E298 PolarHBondContact NH2-OE2 3.3Å
33Y81.8Confident83.6Confident188 Ų18886.3 Ų86.374%0.73745%0.45SS*.THydrogen-bonded Turntrans-99.5-2.9177.2-56.8-76.3000112.2L30 S31L30-Y33 PolarHBondContact O-N 2.86Å; S31-Y33 PolarHBondContact O-N 3.48Å
34L78.1Confident83.2Confident88 Ų8883.3 Ų83.346%0.46143%0.432SS..SBendtrans-73.1150.6176.6-73.8169.2000110.6S31 C38S31-L34 WeakPolarHBondContact O-CB 3.25Å; S31-L34 PolarHBondContact O-N 2.78Å; L34-C38 HydrophobicContact CB-CB 4.22Å; L34-C38 HydrophobicContact CD1-CB 4.43Å
35P74.8Confident82.9Confident92 Ų9284 Ų8460%0.59743%0.434SS*.  trans-57.4145173.7-19.630.5000111.3G37 C38P35-G37 PolarHBondContact O-N 3.48Å; P35-C38 PolarHBondContact O-N 3.09Å
36T66.4Low82.7Confident110 Ų11086.2 Ų86.268%0.67545%0.446SS*.G310 helixtrans-53.2-21.6-178.544.60000114.5C38 E39 H40T36-C38 VanDerWaalsContact C-N 3.33Å; T36-C38 PolarHBondContact O-N 3.22Å; T36-E39 PolarHBondContact O-N 3.18Å; T36-H40 PolarHBondContact O-ND1 2.87Å
37G64.8Low82.5Confident58 Ų5886 Ų8660%0.59844%0.44SS*.G310 helixtrans-64.5-29.9173.300000114.6P35 E39P35-G37 PolarHBondContact O-N 3.48Å; G37-E39 VanDerWaalsContact C-N 3.35Å; G37-E39 PolarHBondContact O-N 2.93Å
38C66.8Low82.4Confident57 Ų5783.1 Ų83.139%0.38542%0.422SS..G310 helixtrans-73.9-23.4-179.2-77.60000113.6L34 P35 T36 H40 S41L34-C38 HydrophobicContact CB-CB 4.22Å; L34-C38 HydrophobicContact CD1-CB 4.43Å; P35-C38 PolarHBondContact O-N 3.09Å; T36-C38 VanDerWaalsContact C-N 3.33Å; T36-C38 PolarHBondContact O-N 3.22Å; C38-H40 PolarHBondContact O-N 2.95Å; C38-S41 WeakPolarHBondContact O-CB 3.22Å; C38-S41 PolarHBondContact O-N 3.29Å; C38-S41 VanDerWaalsContact O-N 3.13Å
39E70.4Confident82.3Confident87 Ų8783 Ų8341%0.40742%0.421SS..G310 helixtrans-66.6-18.6-179.6-60.8-174157.300113T36 G37 Y44T36-E39 PolarHBondContact O-N 3.18Å; G37-E39 VanDerWaalsContact C-N 3.35Å; G37-E39 PolarHBondContact O-N 2.93Å; E39-Y44 HydrophobicContact CB-CD1 4.44Å; E39-Y44 HydrophobicContact CB-CE1 4.14Å; E39-Y44 HydrophobicContact CG-CE1 4.41Å; E39-Y44 VanDerWaalsContact O-CD1 3.25Å; E39-Y44 WeakPolarHBondContact O-CD1 3.19Å
40H73.8Confident82.4Confident153 Ų15382.4 Ų82.471%0.70842%0.424SS*.G310 helixtrans-92-4.3178.7-65.778.3000113T36 C38 K42T36-H40 PolarHBondContact O-ND1 2.87Å; C38-H40 PolarHBondContact O-N 2.95Å; H40-K42 PolarHBondContact O-N 3.42Å
41S85.3Confident82.6Confident56 Ų5677.9 Ų77.939%0.39240%0.401SS..  trans-66.9134.4177.7177.90000111C38 L43 Y44 I45C38-S41 WeakPolarHBondContact O-CB 3.22Å; C38-S41 PolarHBondContact O-N 3.29Å; C38-S41 VanDerWaalsContact O-N 3.13Å; S41-L43 PolarHBondContact O-N 3.43Å; S41-L43 PolarHBondContact OG-N 2.86Å; S41-Y44 WeakPolarHBondContact O-CB 3.45Å; S41-Y44 PolarHBondContact O-N 3.47Å; S41-I45 PolarHBondContact O-N 2.81Å
42K87Confident82.9Confident179 Ų17979 Ų7978%0.77840%0.404SS*.Hα-helixtrans-54.5-36.7174.6-68.8-175.5178.5-179.70112.1H40 I45 L46H40-K42 PolarHBondContact O-N 3.42Å; K42-I45 PolarHBondContact O-N 3.29Å; K42-L46 WeakPolarHBondContact O-CB 3.37Å; K42-L46 PolarHBondContact O-N 3.01Å
43L88.3Confident83.6Confident130 Ų13074.9 Ų74.968%0.68139%0.389SS*.Hα-helixtrans-65.4-41.3178.2-175.766.9000111.6S41 L46 F47S41-L43 PolarHBondContact O-N 3.43Å; S41-L43 PolarHBondContact OG-N 2.86Å; L43-L46 PolarHBondContact O-N 2.58Å; L43-F47 WeakPolarHBondContact O-CB 3.3Å; L43-F47 PolarHBondContact O-N 3.39Å
44Y88.6Confident84.1Confident48 Ų4866.2 Ų66.219%0.18836%0.357CS..Hα-helixtrans-65.1-45.6176.9174.8-94.6000111.3E39 S41 L46 F47 Q48E39-Y44 HydrophobicContact CB-CD1 4.44Å; E39-Y44 HydrophobicContact CB-CE1 4.14Å; E39-Y44 HydrophobicContact CG-CE1 4.41Å; E39-Y44 VanDerWaalsContact O-CD1 3.25Å; E39-Y44 WeakPolarHBondContact O-CD1 3.19Å; S41-Y44 WeakPolarHBondContact O-CB 3.45Å; S41-Y44 PolarHBondContact O-N 3.47Å; Y44-L46 PolarHBondContact O-N 2.91Å; Y44-F47 PolarHBondContact O-N 2.9Å; Y44-Q48 HydrophobicContact CD1-CG 4.06Å; Y44-Q48 HydrophobicContact CD2-CG 4.27Å; Y44-Q48 HydrophobicContact CE1-CG 3.66Å; Y44-Q48 HydrophobicContact CE2-CG 3.9Å; Y44-Q48 VanDerWaalsContact CE2-NE2 3.31Å; Y44-Q48 HydrophobicContact CG-CG 4.36Å; Y44-Q48 WeakPolarHBondContact O-CB 3.46Å; Y44-Q48 VanDerWaalsContact O-CG 3.26Å; Y44-Q48 WeakPolarHBondContact O-CG 3.48Å; Y44-Q48 PolarHBondContact O-N 3.41Å; Y44-Q48 PolarHBondContact OH-NE2 3.41Å
45I89.6Confident84.6Confident30 Ų3064.2 Ų64.215%0.15434%0.344CS..Hα-helixtrans-62.3-44.2178.2-63.6172.1000110.6S41 K42 Q48 D49 L66S41-I45 PolarHBondContact O-N 2.81Å; K42-I45 PolarHBondContact O-N 3.29Å; I45-Q48 PolarHBondContact O-N 3.37Å; I45-D49 WeakPolarHBondContact O-CB 3.35Å; I45-D49 PolarHBondContact O-N 2.97Å; I45-L66 HydrophobicContact CG2-CD1 3.88Å
46L91.1Very high85.3Confident75 Ų7560.2 Ų60.239%0.39332%0.319SS..Hα-helixtrans-60.7-46.8176.5-179.563.9000111.5K42 L43 Y44 D49 L50 W65 L66K42-L46 WeakPolarHBondContact O-CB 3.37Å; K42-L46 PolarHBondContact O-N 3.01Å; L43-L46 PolarHBondContact O-N 2.58Å; Y44-L46 PolarHBondContact O-N 2.91Å; L46-D49 PolarHBondContact O-N 3.16Å; L46-L50 WeakPolarHBondContact O-CB 3.2Å; L46-L50 PolarHBondContact O-N 2.92Å; L46-W65 HydrophobicContact CD1-CH2 4.15Å; L46-L66 HydrophobicContact CD1-CD2 3.87Å
47F92.6Very high86.4Confident48 Ų4855.2 Ų55.221%0.21129%0.287CS..Hα-helixtrans-60.1-47.7176.3172-106.5000111.8A24 V27 H28 L43 Y44 D49 L50 I51A24-F47 HydrophobicContact CB-CE2 4.07Å; A24-F47 HydrophobicContact CB-CZ 4.21Å; V27-F47 HydrophobicContact CB-CE1 4.37Å; V27-F47 HydrophobicContact CB-CZ 4Å; V27-F47 HydrophobicContact CG1-CD1 4.35Å; V27-F47 HydrophobicContact CG1-CE1 3.73Å; V27-F47 HydrophobicContact CG1-CE2 4.4Å; V27-F47 HydrophobicContact CG1-CZ 3.76Å; H28-F47 HydrophobicContact CB-CE1 4.29Å; H28-F47 HydrophobicContact CB-CZ 4.49Å; L43-F47 WeakPolarHBondContact O-CB 3.3Å; L43-F47 PolarHBondContact O-N 3.39Å; Y44-F47 PolarHBondContact O-N 2.9Å; F47-D49 PolarHBondContact O-N 3.04Å; F47-L50 PolarHBondContact O-N 3.41Å; F47-I51 HydrophobicContact CD1-CD1 4.31Å; F47-I51 HydrophobicContact CD2-CG2 4.21Å; F47-I51 HydrophobicContact CE1-CD1 3.74Å; F47-I51 HydrophobicContact CE2-CG2 3.76Å; F47-I51 HydrophobicContact CZ-CD1 3.96Å; F47-I51 HydrophobicContact CZ-CG2 4Å; F47-I51 WeakPolarHBondContact O-CG1 3.47Å; F47-I51 PolarHBondContact O-N 3.4Å; F47-I51 VanDerWaalsContact O-N 3.08Å
48Q92Very high87Confident1 Ų155.6 Ų55.61%0.00529%0.292CS..Hα-helixtrans-64.1-38.6178.7-68.9-73.7-23.600112H28 Y44 I45 L50 R52 L60H28-Q48 PolarHBondContact ND1-NE2 2.99Å; Y44-Q48 HydrophobicContact CD1-CG 4.06Å; Y44-Q48 HydrophobicContact CD2-CG 4.27Å; Y44-Q48 HydrophobicContact CE1-CG 3.66Å; Y44-Q48 HydrophobicContact CE2-CG 3.9Å; Y44-Q48 VanDerWaalsContact CE2-NE2 3.31Å; Y44-Q48 HydrophobicContact CG-CG 4.36Å; Y44-Q48 WeakPolarHBondContact O-CB 3.46Å; Y44-Q48 VanDerWaalsContact O-CG 3.26Å; Y44-Q48 WeakPolarHBondContact O-CG 3.48Å; Y44-Q48 PolarHBondContact O-N 3.41Å; Y44-Q48 PolarHBondContact OH-NE2 3.41Å; I45-Q48 PolarHBondContact O-N 3.37Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-R52 VanDerWaalsContact O-CB 3.27Å; Q48-R52 WeakPolarHBondContact O-CB 3.3Å; Q48-R52 VanDerWaalsContact O-CD 3.24Å; Q48-R52 WeakPolarHBondContact O-CD 3.37Å; Q48-R52 WeakPolarHBondContact O-CG 3.27Å; Q48-R52 PolarHBondContact O-N 3.21Å; Q48-R52 VanDerWaalsContact OE1-NH2 3.1Å; Q48-L60 HydrophobicContact CB-CD1 3.94Å; Q48-L60 HydrophobicContact CB-CD2 3.85Å
49D91.4Very high87.4Confident1 Ų156.9 Ų56.91%0.00530%0.299CS..Hα-helixtrans-64.9-39174.9-172.674.9000111.6I45 L46 F47 K57 L60 R62 H161I45-D49 WeakPolarHBondContact O-CB 3.35Å; I45-D49 PolarHBondContact O-N 2.97Å; L46-D49 PolarHBondContact O-N 3.16Å; F47-D49 PolarHBondContact O-N 3.04Å; D49-K57 WeakPolarHBondContact O-CE 3.34Å; D49-K57 WeakPolarHBondContact OD1-CE 3.36Å; D49-K57 IonicContact OD1-NZ 3.12Å; D49-K57 PolarHBondContact OD1-NZ 3.1Å; D49-K57 IonicContact OD2-NZ 2.92Å; D49-K57 PolarHBondContact OD2-NZ 3.18Å; D49-L60 HydrophobicContact CB-CD2 3.97Å; D49-R62 WeakPolarHBondContact OD1-CD 3.37Å; D49-R62 IonicContact OD1-CZ 3.63Å; D49-R62 IonicContact OD1-NE 2.81Å; D49-R62 IonicContact OD1-NH1 3.22Å; D49-R62 PolarHBondContact OD1-NH1 2.78Å; D49-H161 IonicContact OD2-CD2 3.94Å
50L92.4Very high88Confident75 Ų7554.2 Ų54.239%0.39329%0.287SS..Hα-helixtrans-72.5-26.7-178.9-172.764.2000114L46 F47 Q48 V163 Q164L46-L50 WeakPolarHBondContact O-CB 3.2Å; L46-L50 PolarHBondContact O-N 2.92Å; F47-L50 PolarHBondContact O-N 3.41Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; L50-V163 HydrophobicContact CD1-CB 4.24Å; L50-V163 HydrophobicContact CD1-CG1 4.28Å; L50-Q164 PolarHBondContact O-NE2 3.04Å
51I93.9Very high88.4Confident20 Ų2056.1 Ų56.110%0.10329%0.294CS..Hα-helixtrans-92.6-18.5177.967177.5000113.2A24 H28 F47 L291 L295A24-I51 HydrophobicContact CB-CG2 4.29Å; H28-I51 HydrophobicContact CB-CD1 4.11Å; F47-I51 HydrophobicContact CD1-CD1 4.31Å; F47-I51 HydrophobicContact CD2-CG2 4.21Å; F47-I51 HydrophobicContact CE1-CD1 3.74Å; F47-I51 HydrophobicContact CE2-CG2 3.76Å; F47-I51 HydrophobicContact CZ-CD1 3.96Å; F47-I51 HydrophobicContact CZ-CG2 4Å; F47-I51 WeakPolarHBondContact O-CG1 3.47Å; F47-I51 PolarHBondContact O-N 3.4Å; F47-I51 VanDerWaalsContact O-N 3.08Å; I51-L291 HydrophobicContact CB-CD2 4.2Å; I51-L291 HydrophobicContact CD1-CD1 4.42Å; I51-L291 HydrophobicContact CG2-CD2 4.22Å; I51-L295 HydrophobicContact CB-CD1 4.37Å; I51-L295 HydrophobicContact CD1-CD1 4.37Å; I51-L295 HydrophobicContact CD1-CD2 4.27Å; I51-L295 HydrophobicContact CG1-CD1 4.12Å; I51-L295 VanDerWaalsContact O-CD1 3.28Å; I51-L295 WeakPolarHBondContact O-CD1 3.22Å
52R94.4Very high88.5Confident27 Ų2755 Ų5510%0.10228%0.281CS..  trans-95.2152.9-177.4-70.5166.1-179.6-80.2-5.4111.3H28 Q48 T56 K57 Q164 L295H28-R52 PolarHBondContact CE1-NH2 2.98Å; Q48-R52 VanDerWaalsContact O-CB 3.27Å; Q48-R52 WeakPolarHBondContact O-CB 3.3Å; Q48-R52 VanDerWaalsContact O-CD 3.24Å; Q48-R52 WeakPolarHBondContact O-CD 3.37Å; Q48-R52 WeakPolarHBondContact O-CG 3.27Å; Q48-R52 PolarHBondContact O-N 3.21Å; Q48-R52 VanDerWaalsContact OE1-NH2 3.1Å; R52-T56 VanDerWaalsContact CD-O 3.25Å; R52-T56 WeakPolarHBondContact CD-O 3.22Å; R52-T56 PolarHBondContact NH1-O 2.96Å; R52-K57 HydrophobicContact CB-CG 3.65Å; R52-K57 WeakPolarHBondContact O-CE 3.47Å; R52-Q164 PolarHBondContact O-NE2 2.88Å; R52-L295 HydrophobicContact CG-CD1 4.11Å; R52-L295 HydrophobicContact CG-CD2 4.11Å
53Y92.2Very high88.4Confident49 Ų4950.4 Ų50.419%0.19227%0.265CS..  trans-155.3155.9169.963.5-92.4000111.4K55 T56 F76 Y257 A292Y53-K55 PolarHBondContact O-N 2.8Å; Y53-T56 PolarHBondContact N-OG1 2.86Å; Y53-T56 VanDerWaalsContact N-OG1 3.1Å; Y53-T56 PolarHBondContact O-N 3.36Å; Y53-T56 PolarHBondContact O-OG1 3Å; Y53-F76 HydrophobicContact CD2-CE2 4.48Å; Y53-F76 AromaticContact CD2-CZ 3.95Å; Y53-F76 HydrophobicContact CD2-CZ 3.95Å; Y53-F76 HydrophobicContact CE2-CE2 4.21Å; Y53-F76 HydrophobicContact CE2-CZ 4.03Å; Y53-Y257 PolarHBondContact OH-OH 3.24Å; Y53-A292 HydrophobicContact CE1-CB 4.44Å
54G91.3Very high88.4Confident7 Ų751.7 Ų51.77%0.07227%0.267CS..G310 helixtrans57-126.5-177.800000112T56 K57 V159G54-T56 PolarHBondContact O-N 3.1Å; G54-T56 VanDerWaalsContact O-N 3.17Å; G54-K57 PolarHBondContact O-N 3.13Å; G54-V159 PolarHBondContact N-O 3.19Å
55K89.4Confident88.4Confident45 Ų4555.8 Ų55.820%0.19628%0.282CS..G310 helixtrans-60.4-27.2-176.270.7-174.3-177.6-176.70113.8Y53 K57 G58 H241 C296 F299 Y300Y53-K55 PolarHBondContact O-N 2.8Å; K55-K57 VanDerWaalsContact C-N 3.31Å; K55-K57 PolarHBondContact O-N 2.99Å; K55-G58 PolarHBondContact O-N 3.22Å; K55-H241 VanDerWaalsContact CB-NE2 3.32Å; K55-H241 WeakPolarHBondContact CB-NE2 3.27Å; K55-C296 WeakPolarHBondContact CE-SG 3.2Å; K55-C296 PolarHBondContact NZ-SG 3.43Å; K55-F299 HydrophobicContact CB-CD2 4.44Å; K55-F299 HydrophobicContact CB-CE1 4.32Å; K55-F299 HydrophobicContact CB-CE2 4.09Å; K55-F299 HydrophobicContact CB-CZ 4.03Å; K55-F299 HydrophobicContact CD-CD1 3.8Å; K55-F299 HydrophobicContact CD-CE1 3.75Å; K55-F299 HydrophobicContact CD-CG 4.41Å; K55-F299 HydrophobicContact CD-CZ 4.31Å; K55-F299 HydrophobicContact CG-CD1 4.13Å; K55-F299 HydrophobicContact CG-CD2 4.44Å; K55-F299 HydrophobicContact CG-CE1 4.2Å; K55-F299 HydrophobicContact CG-CE2 4.49Å; K55-F299 HydrophobicContact CG-CG 4.25Å; K55-F299 HydrophobicContact CG-CZ 4.37Å; K55-F299 WeakPolarHBondContact O-CD2 3.4Å; K55-F299 WeakPolarHBondContact O-CE2 2.91Å; K55-Y300 PolarHBondContact NZ-OH 3.48Å
56T90.3Very high88.2Confident9 Ų954.5 Ų54.56%0.05528%0.275CS..G310 helixtrans-79-14.6-176.464.50000113R52 Y53 G54 L295 F299R52-T56 VanDerWaalsContact CD-O 3.25Å; R52-T56 WeakPolarHBondContact CD-O 3.22Å; R52-T56 PolarHBondContact NH1-O 2.96Å; Y53-T56 PolarHBondContact N-OG1 2.86Å; Y53-T56 VanDerWaalsContact N-OG1 3.1Å; Y53-T56 PolarHBondContact O-N 3.36Å; Y53-T56 PolarHBondContact O-OG1 3Å; G54-T56 PolarHBondContact O-N 3.1Å; G54-T56 VanDerWaalsContact O-N 3.17Å; T56-L295 HydrophobicContact CG2-CB 4.08Å; T56-F299 HydrophobicContact CG2-CB 4.34Å
57K88.6Confident88.1Confident4 Ų457.3 Ų57.32%0.01728%0.281CS..G310 helixtrans-78.3-24.5171.8-80.4-173.1168.3-136.90113.3D49 R52 G54 K55 L60 D70 V159D49-K57 WeakPolarHBondContact O-CE 3.34Å; D49-K57 WeakPolarHBondContact OD1-CE 3.36Å; D49-K57 IonicContact OD1-NZ 3.12Å; D49-K57 PolarHBondContact OD1-NZ 3.1Å; D49-K57 IonicContact OD2-NZ 2.92Å; D49-K57 PolarHBondContact OD2-NZ 3.18Å; R52-K57 HydrophobicContact CB-CG 3.65Å; R52-K57 WeakPolarHBondContact O-CE 3.47Å; G54-K57 PolarHBondContact O-N 3.13Å; K55-K57 VanDerWaalsContact C-N 3.31Å; K55-K57 PolarHBondContact O-N 2.99Å; K57-L60 WeakPolarHBondContact O-CB 3.39Å; K57-L60 PolarHBondContact O-N 3.04Å; K57-L60 VanDerWaalsContact O-N 3.11Å; K57-D70 IonicContact NZ-OD1 3.28Å; K57-D70 PolarHBondContact NZ-OD1 2.97Å; K57-V159 HydrophobicContact CD-CG2 3.87Å
58G77.6Confident88Confident67 Ų6759.9 Ų59.969%0.69130%0.3SS*.THydrogen-bonded Turntrans-55.3-42.7-175.700000115.2K55 L60K55-G58 PolarHBondContact O-N 3.22Å; G58-L60 PolarHBondContact O-N 3.31Å
59P76.4Confident87.9Confident83 Ų8364.2 Ų64.254%0.53932%0.319SS..THydrogen-bonded Turntrans-68.6-14.5178.2-23.435.1000115.5F299P59-F299 HydrophobicContact CG-CD2 4.31Å
60L81.6Confident88Confident31 Ų3165.7 Ų65.716%0.16233%0.327CS..SBendtrans-84.9126.5-175-169.766.4000110.5Q48 D49 K57 G58 R62Q48-L60 HydrophobicContact CB-CD1 3.94Å; Q48-L60 HydrophobicContact CB-CD2 3.85Å; D49-L60 HydrophobicContact CB-CD2 3.97Å; K57-L60 WeakPolarHBondContact O-CB 3.39Å; K57-L60 PolarHBondContact O-N 3.04Å; K57-L60 VanDerWaalsContact O-N 3.11Å; G58-L60 PolarHBondContact O-N 3.31Å; L60-R62 HydrophobicContact CB-CG 4.07Å; L60-R62 HydrophobicContact CD2-CG 3.8Å; L60-R62 HydrophobicContact CG-CG 3.79Å; L60-R62 PolarHBondContact O-N 3.41Å
61K82.8Confident88.1Confident193 Ų19363.1 Ų63.184%0.83931%0.314SS*.  trans-75.1110.9168.5-69.6-176.5-178.6177.40108.6
62R87.2Confident88.1Confident34 Ų3464.3 Ų64.313%0.12832%0.322CS..  trans-118134.8-173.8-58.3-175.7-64152.67.5111.8D49 L60 L66 R67 D70D49-R62 WeakPolarHBondContact OD1-CD 3.37Å; D49-R62 IonicContact OD1-CZ 3.63Å; D49-R62 IonicContact OD1-NE 2.81Å; D49-R62 IonicContact OD1-NH1 3.22Å; D49-R62 PolarHBondContact OD1-NH1 2.78Å; L60-R62 HydrophobicContact CB-CG 4.07Å; L60-R62 HydrophobicContact CD2-CG 3.8Å; L60-R62 HydrophobicContact CG-CG 3.79Å; L60-R62 PolarHBondContact O-N 3.41Å; R62-L66 HydrophobicContact CB-CD1 4.41Å; R62-R67 PolarHBondContact O-NE 3.2Å; R62-R67 PolarHBondContact O-NH2 2.9Å; R62-D70 IonicContact CZ-OD2 3.17Å; R62-D70 VanDerWaalsContact CZ-OD2 3.25Å; R62-D70 IonicContact NH1-OD1 3.77Å; R62-D70 PolarHBondContact NH1-OD1 2.93Å; R62-D70 IonicContact NH1-OD2 3.53Å; R62-D70 PolarHBondContact NH1-OD2 2.97Å; R62-D70 IonicContact NH2-OD2 3.72Å; R62-D70 PolarHBondContact NH2-OD2 3.33Å
63D85.2Confident88Confident81 Ų8165.7 Ų65.743%0.43333%0.329SS..  trans-60.7158.4170.8-64-24000111.8W65 L66D63-W65 VanDerWaalsContact C-N 3.34Å; D63-W65 VanDerWaalsContact CB-CD1 3.42Å; D63-W65 HydrophobicContact CB-CG 4.43Å; D63-W65 PolarHBondContact O-N 3.27Å; D63-W65 PolarHBondContact OD2-NE1 2.87Å; D63-L66 PolarHBondContact O-N 3.45Å
64H87.9Confident88.1Confident157 Ų15768.7 Ų68.773%0.72734%0.34SS*.Hα-helixtrans-59.8-41.9-179.4-176.5-91.5000112.6L66 R67H64-L66 VanDerWaalsContact C-N 3.3Å; H64-L66 PolarHBondContact O-N 3.45Å; H64-R67 WeakPolarHBondContact O-CB 3.43Å; H64-R67 PolarHBondContact O-N 3.46Å
65W88.3Confident88.2Confident135 Ų13573.7 Ų73.751%0.51136%0.357SS..Hα-helixtrans-63.2-32.9-176.373.2-92.6000113.1L46 D63 R67 V68L46-W65 HydrophobicContact CD1-CH2 4.15Å; D63-W65 VanDerWaalsContact C-N 3.34Å; D63-W65 VanDerWaalsContact CB-CD1 3.42Å; D63-W65 HydrophobicContact CB-CG 4.43Å; D63-W65 PolarHBondContact O-N 3.27Å; D63-W65 PolarHBondContact OD2-NE1 2.87Å; W65-R67 PolarHBondContact O-N 3.41Å; W65-V68 WeakPolarHBondContact O-CB 3.43Å; W65-V68 PolarHBondContact O-N 3.44Å
66L86.1Confident88.3Confident2 Ų273.1 Ų73.11%0.0136%0.355CS..Hα-helixtrans-65.3-27175.9-73.9169.4000112.3I45 L46 R62 D63 H64I45-L66 HydrophobicContact CG2-CD1 3.88Å; L46-L66 HydrophobicContact CD1-CD2 3.87Å; R62-L66 HydrophobicContact CB-CD1 4.41Å; D63-L66 PolarHBondContact O-N 3.45Å; H64-L66 VanDerWaalsContact C-N 3.3Å; H64-L66 PolarHBondContact O-N 3.45Å
67R88.8Confident88.5Confident135 Ų13577.1 Ų77.151%0.50937%0.369SS..Hα-helixtrans-81.8-16-178.7-54.4179.1-165.5-171.53.1112.7R62 H64 W65 F69 D70R62-R67 PolarHBondContact O-NE 3.2Å; R62-R67 PolarHBondContact O-NH2 2.9Å; H64-R67 WeakPolarHBondContact O-CB 3.43Å; H64-R67 PolarHBondContact O-N 3.46Å; W65-R67 PolarHBondContact O-N 3.41Å; R67-F69 PolarHBondContact O-N 2.82Å; R67-D70 WeakPolarHBondContact O-CB 3.43Å; R67-D70 PolarHBondContact O-N 3.37Å; R67-D70 VanDerWaalsContact O-N 3.13Å
68V90.6Very high89Confident101 Ų10178.9 Ų78.961%0.61238%0.377SS*.THydrogen-bonded Turntrans-61.3-28.8176.7178.50000111.1W65W65-V68 WeakPolarHBondContact O-CB 3.43Å; W65-V68 PolarHBondContact O-N 3.44Å
69F89.8Confident89.9Confident93 Ų9376.4 Ų76.441%0.40835%0.347SS..THydrogen-bonded Turntrans-96.99.2-179.5-58.7-66.8000113.9R67 I162R67-F69 PolarHBondContact O-N 2.82Å; F69-I162 HydrophobicContact CB-CB 4.43Å; F69-I162 HydrophobicContact CB-CG2 3.8Å; F69-I162 HydrophobicContact CD1-CG2 3.98Å; F69-I162 HydrophobicContact CG-CG2 4.21Å; F69-I162 PolarHBondContact O-N 2.98Å
70D93.5Very high91Very high31 Ų3173.4 Ų73.417%0.16633%0.325CS..EExtended strand (participates in β ladder)trans-79.4126.1177.5-82.9-26.7000110.4K57 R62 R67 V159K57-D70 IonicContact NZ-OD1 3.28Å; K57-D70 PolarHBondContact NZ-OD1 2.97Å; R62-D70 IonicContact CZ-OD2 3.17Å; R62-D70 VanDerWaalsContact CZ-OD2 3.25Å; R62-D70 IonicContact NH1-OD1 3.77Å; R62-D70 PolarHBondContact NH1-OD1 2.93Å; R62-D70 IonicContact NH1-OD2 3.53Å; R62-D70 PolarHBondContact NH1-OD2 2.97Å; R62-D70 IonicContact NH2-OD2 3.72Å; R62-D70 PolarHBondContact NH2-OD2 3.33Å; R67-D70 WeakPolarHBondContact O-CB 3.43Å; R67-D70 PolarHBondContact O-N 3.37Å; R67-D70 VanDerWaalsContact O-N 3.13Å; D70-V159 HydrophobicContact CB-CB 3.82Å; D70-V159 HydrophobicContact CB-CG1 4.07Å; D70-V159 HydrophobicContact CB-CG2 4.08Å; D70-V159 VanDerWaalsContact CG-CG2 3.5Å; D70-V159 WeakPolarHBondContact OD2-CG2 3.5Å
71I94.6Very high91.8Very high22 Ų2273.5 Ų73.511%0.11333%0.331CS..EExtended strand (participates in β ladder)trans-104.6140.9174.5-63.9-177.5000108.8K73 W75 V159 I160 I162 Y165I71-K73 PolarHBondContact O-N 3.16Å; I71-W75 HydrophobicContact CG2-CD2 4.06Å; I71-W75 HydrophobicContact CG2-CE3 3.36Å; I71-W75 HydrophobicContact CG2-CZ3 3.87Å; I71-V159 CarbonylContact O-C 3.54Å; I71-V159 VanDerWaalsContact O-CA 3.29Å; I71-V159 WeakPolarHBondContact O-CA 3.35Å; I71-I160 HydrophobicContact CB-CG2 4.01Å; I71-I160 HydrophobicContact CG2-CG2 4.33Å; I71-I160 PolarHBondContact N-O 2.95Å; I71-I160 PolarHBondContact O-N 3.23Å; I71-I162 HydrophobicContact CD1-CB 4.02Å; I71-I162 HydrophobicContact CD1-CD1 4.41Å; I71-I162 HydrophobicContact CD1-CG1 3.86Å; I71-I162 HydrophobicContact CG1-CB 4.48Å; I71-Y165 HydrophobicContact CD1-CD1 3.61Å; I71-Y165 HydrophobicContact CD1-CD2 4.41Å; I71-Y165 HydrophobicContact CD1-CE1 4.28Å; I71-Y165 HydrophobicContact CD1-CG 3.7Å; I71-Y165 HydrophobicContact CG2-CD2 4.11Å; I71-Y165 HydrophobicContact CG2-CE2 4.37Å; I71-Y165 HydrophobicContact CG2-CG 4.41Å
72P94.8Very high92.5Very high44 Ų4467.5 Ų67.529%0.28631%0.307SS..EExtended strand (participates in β ladder)trans-57.6125.3175.8-26.135.6000112.4R74 W75P72-R74 HydrophobicContact CB-CG 3.88Å; P72-R74 PolarHBondContact O-N 3.45Å; P72-R74 VanDerWaalsContact O-N 3.09Å; P72-W75 WeakPolarHBondContact O-CB 3.44Å; P72-W75 PolarHBondContact O-N 2.91Å
73K91.8Very high93Very high56 Ų5665.9 Ų65.924%0.24330%0.301CS..G310 helixtrans-59.8-25.1177.5-176.7-179.7176.4-175.70112.6I71 W75 F76 G158I71-K73 PolarHBondContact O-N 3.16Å; K73-W75 PolarHBondContact O-N 3.42Å; K73-F76 HydrophobicContact CD-CE2 4.28Å; K73-F76 HydrophobicContact CD-CZ 4.43Å; K73-F76 HydrophobicContact CG-CD1 4.1Å; K73-F76 HydrophobicContact CG-CD2 4.07Å; K73-F76 HydrophobicContact CG-CE1 4Å; K73-F76 HydrophobicContact CG-CE2 3.99Å; K73-F76 HydrophobicContact CG-CG 4.16Å; K73-F76 HydrophobicContact CG-CZ 3.97Å; K73-F76 WeakPolarHBondContact O-CB 3.42Å; K73-F76 WeakPolarHBondContact O-CD1 3.41Å; K73-F76 WeakPolarHBondContact O-CG 3.33Å; K73-F76 PolarHBondContact O-N 2.94Å; K73-G158 WeakPolarHBondContact CB-O 3.16Å; K73-G158 PolarHBondContact N-O 2.54Å
74R92.9Very high93.7Very high113 Ų11363.2 Ų63.243%0.42629%0.287SS..G310 helixtrans-56.9-16.6175.475.4-174.891.3-138-0.4113.3P72 F76 W77 F155 D157P72-R74 HydrophobicContact CB-CG 3.88Å; P72-R74 PolarHBondContact O-N 3.45Å; P72-R74 VanDerWaalsContact O-N 3.09Å; R74-F76 VanDerWaalsContact C-N 3.26Å; R74-F76 PolarHBondContact O-N 3.45Å; R74-W77 VanDerWaalsContact O-CD1 3.27Å; R74-F155 HydrophobicContact CB-CB 3.85Å; R74-F155 HydrophobicContact CB-CD2 4.45Å; R74-F155 HydrophobicContact CB-CG 4.04Å; R74-D157 IonicContact CZ-OD1 3.81Å; R74-D157 IonicContact NH2-OD1 2.9Å; R74-D157 PolarHBondContact NH2-OD1 3.4Å
75W94.5Very high94.2Very high111 Ų11158 Ų5842%0.4228%0.275SS..G310 helixtrans-81.45.6174.3-66.21.2000114.3I71 P72 K73 W77 H78 Y165I71-W75 HydrophobicContact CG2-CD2 4.06Å; I71-W75 HydrophobicContact CG2-CE3 3.36Å; I71-W75 HydrophobicContact CG2-CZ3 3.87Å; P72-W75 WeakPolarHBondContact O-CB 3.44Å; P72-W75 PolarHBondContact O-N 2.91Å; K73-W75 PolarHBondContact O-N 3.42Å; W75-W77 PolarHBondContact O-N 2.82Å; W75-W77 VanDerWaalsContact O-N 3.09Å; W75-H78 AromaticContact CD2-CE1 3.73Å; W75-H78 AromaticContact CE3-CE1 3.97Å; W75-H78 AromaticContact CG-CE1 3.58Å; W75-H78 VanDerWaalsContact O-CB 3.28Å; W75-H78 WeakPolarHBondContact O-CB 3.46Å; W75-H78 VanDerWaalsContact O-CG 3.26Å; W75-H78 PolarHBondContact O-N 3.27Å; W75-H78 PolarHBondContact O-ND1 3.2Å; W75-Y165 HydrophobicContact CB-CE2 4.21Å
76F90.4Very high94.7Very high34 Ų3453.8 Ų53.815%0.14926%0.26CS..G310 helixtrans-55.3-25.7175.4-91.614.2000114.4Y53 K73 R74 H78 F79 Y80 F155 I160Y53-F76 HydrophobicContact CD2-CE2 4.48Å; Y53-F76 AromaticContact CD2-CZ 3.95Å; Y53-F76 HydrophobicContact CD2-CZ 3.95Å; Y53-F76 HydrophobicContact CE2-CE2 4.21Å; Y53-F76 HydrophobicContact CE2-CZ 4.03Å; K73-F76 HydrophobicContact CD-CE2 4.28Å; K73-F76 HydrophobicContact CD-CZ 4.43Å; K73-F76 HydrophobicContact CG-CD1 4.1Å; K73-F76 HydrophobicContact CG-CD2 4.07Å; K73-F76 HydrophobicContact CG-CE1 4Å; K73-F76 HydrophobicContact CG-CE2 3.99Å; K73-F76 HydrophobicContact CG-CG 4.16Å; K73-F76 HydrophobicContact CG-CZ 3.97Å; K73-F76 WeakPolarHBondContact O-CB 3.42Å; K73-F76 WeakPolarHBondContact O-CD1 3.41Å; K73-F76 WeakPolarHBondContact O-CG 3.33Å; K73-F76 PolarHBondContact O-N 2.94Å; R74-F76 VanDerWaalsContact C-N 3.26Å; R74-F76 PolarHBondContact O-N 3.45Å; F76-H78 PolarHBondContact O-N 3.42Å; F76-F79 HydrophobicContact CD1-CD2 4.1Å; F76-F79 AromaticContact CD1-CE2 3.4Å; F76-F79 HydrophobicContact CD1-CE2 3.4Å; F76-F79 HydrophobicContact CD1-CZ 4.13Å; F76-F79 AromaticContact CE1-CE2 3.6Å; F76-F79 HydrophobicContact CE1-CE2 3.6Å; F76-F79 HydrophobicContact CE1-CZ 4.26Å; F76-F79 HydrophobicContact CG-CD2 4.4Å; F76-F79 HydrophobicContact CG-CE2 4.12Å; F76-F79 HydrophobicContact CZ-CE2 4.45Å; F76-F79 PolarHBondContact O-N 3.36Å; F76-Y80 WeakPolarHBondContact O-CD2 3.28Å; F76-F155 HydrophobicContact CB-CE1 4.2Å; F76-F155 HydrophobicContact CB-CZ 4.47Å; F76-I160 HydrophobicContact CE1-CB 4.23Å; F76-I160 HydrophobicContact CE1-CD1 3.55Å; F76-I160 HydrophobicContact CE1-CG1 4.39Å; F76-I160 HydrophobicContact CE1-CG2 4.27Å; F76-I160 HydrophobicContact CZ-CD1 4.11Å
77W95.9Very high95.2Very high92 Ų9253.9 Ų53.935%0.34826%0.26SS..Hα-helixtrans-62.8-25.9175.572.6-97.7000112.5R74 W75 F79 Y80 A81 L146 C149 H150R74-W77 VanDerWaalsContact O-CD1 3.27Å; W75-W77 PolarHBondContact O-N 2.82Å; W75-W77 VanDerWaalsContact O-N 3.09Å; W77-F79 VanDerWaalsContact C-N 3.28Å; W77-F79 PolarHBondContact O-N 3.4Å; W77-Y80 PolarHBondContact O-N 2.97Å; W77-A81 HydrophobicContact CE3-CB 3.83Å; W77-A81 HydrophobicContact CZ3-CB 3.81Å; W77-A81 PolarHBondContact O-N 3.14Å; W77-L146 HydrophobicContact CB-CD1 4.14Å; W77-L146 HydrophobicContact CE3-CD1 4.19Å; W77-C149 HydrophobicContact CB-CB 3.75Å; W77-H150 AromaticContact CD2-CE1 3.92Å; W77-H150 AromaticContact CD2-NE2 3.85Å; W77-H150 AromaticContact CE3-NE2 3.79Å; W77-H150 AromaticContact CG-CE1 3.98Å; W77-H150 AromaticContact CG-NE2 3.94Å
78H97.9Very high95.7Very high41 Ų4148.2 Ų48.219%0.1924%0.244CC..Hα-helixtrans-58.3-39.5177.3-62.5163.8000112.3W75 F76 Y80 A81 I82 Y165 L169W75-H78 AromaticContact CD2-CE1 3.73Å; W75-H78 AromaticContact CE3-CE1 3.97Å; W75-H78 AromaticContact CG-CE1 3.58Å; W75-H78 VanDerWaalsContact O-CB 3.28Å; W75-H78 WeakPolarHBondContact O-CB 3.46Å; W75-H78 VanDerWaalsContact O-CG 3.26Å; W75-H78 PolarHBondContact O-N 3.27Å; W75-H78 PolarHBondContact O-ND1 3.2Å; F76-H78 PolarHBondContact O-N 3.42Å; H78-Y80 VanDerWaalsContact C-N 3.3Å; H78-Y80 PolarHBondContact O-N 2.86Å; H78-A81 PolarHBondContact O-N 3.41Å; H78-I82 WeakPolarHBondContact O-CG1 3.4Å; H78-I82 PolarHBondContact O-N 3.47Å; H78-Y165 AromaticContact ND1-CZ 3.81Å; H78-Y165 PolarHBondContact ND1-OH 2.75Å; H78-L169 HydrophobicContact CB-CD2 4.24Å
79F97.8Very high96Very high15 Ų1547.6 Ų47.67%0.06623%0.233CC..Hα-helixtrans-59.4-45.2178.9-53.5-36.4000111.2F76 W77 S83 I160 Y165 L169 Y172F76-F79 HydrophobicContact CD1-CD2 4.1Å; F76-F79 AromaticContact CD1-CE2 3.4Å; F76-F79 HydrophobicContact CD1-CE2 3.4Å; F76-F79 HydrophobicContact CD1-CZ 4.13Å; F76-F79 AromaticContact CE1-CE2 3.6Å; F76-F79 HydrophobicContact CE1-CE2 3.6Å; F76-F79 HydrophobicContact CE1-CZ 4.26Å; F76-F79 HydrophobicContact CG-CD2 4.4Å; F76-F79 HydrophobicContact CG-CE2 4.12Å; F76-F79 HydrophobicContact CZ-CE2 4.45Å; F76-F79 PolarHBondContact O-N 3.36Å; W77-F79 VanDerWaalsContact C-N 3.28Å; W77-F79 PolarHBondContact O-N 3.4Å; F79-S83 WeakPolarHBondContact O-CB 3.39Å; F79-S83 PolarHBondContact O-N 3.26Å; F79-I160 HydrophobicContact CE2-CD1 4.47Å; F79-I160 HydrophobicContact CZ-CD1 4.21Å; F79-Y165 HydrophobicContact CD1-CE2 4.47Å; F79-Y165 AromaticContact CE1-CD2 3.41Å; F79-Y165 HydrophobicContact CE1-CD2 3.41Å; F79-Y165 VanDerWaalsContact CE1-CD2 3.41Å; F79-Y165 AromaticContact CE1-CE2 3.6Å; F79-Y165 HydrophobicContact CE1-CE2 3.6Å; F79-Y165 HydrophobicContact CE1-CG 4.02Å; F79-Y165 VanDerWaalsContact CE1-O 3.25Å; F79-Y165 WeakPolarHBondContact CE1-O 3.37Å; F79-Y165 AromaticContact CZ-CD2 3.46Å; F79-Y165 HydrophobicContact CZ-CD2 3.46Å; F79-Y165 VanDerWaalsContact CZ-CD2 3.46Å; F79-Y165 AromaticContact CZ-CE2 3.98Å; F79-Y165 HydrophobicContact CZ-CE2 3.98Å; F79-Y165 HydrophobicContact CZ-CG 4.21Å; F79-L169 HydrophobicContact CD1-CD2 3.5Å; F79-L169 VanDerWaalsContact CD1-CD2 3.5Å; F79-L169 HydrophobicContact CD1-CG 3.95Å; F79-L169 HydrophobicContact CE1-CD2 3.94Å; F79-L169 HydrophobicContact CE1-CG 4.03Å; F79-Y172 HydrophobicContact CB-CD2 3.8Å; F79-Y172 HydrophobicContact CB-CE2 3.62Å; F79-Y172 WeakPolarHBondContact O-CD2 3.37Å
80Y98.1Very high96.3Very high21 Ų2143.2 Ų43.28%0.08221%0.214CC..Hα-helixtrans-75.1-33.8-179.6-57.2-65.4000112.3F76 W77 H78 S83 V84 R145 Y172F76-Y80 WeakPolarHBondContact O-CD2 3.28Å; W77-Y80 PolarHBondContact O-N 2.97Å; H78-Y80 VanDerWaalsContact C-N 3.3Å; H78-Y80 PolarHBondContact O-N 2.86Å; Y80-S83 WeakPolarHBondContact O-CB 3.39Å; Y80-S83 PolarHBondContact O-N 2.89Å; Y80-V84 WeakPolarHBondContact O-CB 3.23Å; Y80-V84 VanDerWaalsContact O-CG2 3.26Å; Y80-V84 WeakPolarHBondContact O-CG2 3.44Å; Y80-V84 PolarHBondContact O-N 2.96Å; Y80-R145 HydrophobicContact CD1-CB 3.35Å; Y80-R145 HydrophobicContact CD1-CG 4.16Å; Y80-R145 HydrophobicContact CD2-CB 4.09Å; Y80-R145 HydrophobicContact CE1-CB 3.29Å; Y80-R145 HydrophobicContact CE1-CG 3.7Å; Y80-R145 HydrophobicContact CE2-CB 4.05Å; Y80-R145 HydrophobicContact CG-CB 3.76Å; Y80-R145 PolarHBondContact OH-NE 3.49Å; Y80-R145 PolarHBondContact OH-NH2 3.22Å; Y80-Y172 HydrophobicContact CD1-CE2 4.36Å; Y80-Y172 AromaticContact CD1-CZ 3.96Å; Y80-Y172 HydrophobicContact CE1-CE2 4.31Å; Y80-Y172 AromaticContact CE1-CZ 3.75Å; Y80-Y172 WeakPolarHBondContact CE1-OH 3.3Å
81A98.4Very high96.5Very high33 Ų3342.7 Ų42.727%0.27321%0.211SC..Hα-helixtrans-62.7-46.2173.700000111.8W77 H78 S83 V84 G85 L146W77-A81 HydrophobicContact CE3-CB 3.83Å; W77-A81 HydrophobicContact CZ3-CB 3.81Å; W77-A81 PolarHBondContact O-N 3.14Å; H78-A81 PolarHBondContact O-N 3.41Å; A81-S83 VanDerWaalsContact C-N 3.33Å; A81-S83 PolarHBondContact O-N 3.27Å; A81-V84 PolarHBondContact O-N 3.17Å; A81-G85 PolarHBondContact O-N 3.21Å; A81-L146 HydrophobicContact CB-CD1 4.17Å
82I98.4Very high96.5Very high66 Ų6645.2 Ų45.234%0.33823%0.228SC..Hα-helixtrans-60.2-45.9172.7-70.3-171.6000110.3H78 V84 G85 W86 L169 I173H78-I82 WeakPolarHBondContact O-CG1 3.4Å; H78-I82 PolarHBondContact O-N 3.47Å; I82-V84 PolarHBondContact O-N 3.16Å; I82-G85 PolarHBondContact O-N 3.47Å; I82-W86 VanDerWaalsContact O-CB 3.23Å; I82-W86 WeakPolarHBondContact O-CB 3.2Å; I82-W86 PolarHBondContact O-N 3.15Å; I82-L169 HydrophobicContact CD1-CB 4.19Å; I82-L169 HydrophobicContact CD1-CD1 4.48Å; I82-L169 HydrophobicContact CD1-CD2 3.4Å; I82-L169 VanDerWaalsContact CD1-CD2 3.4Å; I82-L169 HydrophobicContact CD1-CG 4.2Å; I82-L169 HydrophobicContact CG1-CD2 4.34Å; I82-I173 HydrophobicContact CG2-CD1 3.6Å; I82-I173 HydrophobicContact CG2-CG1 4.19Å
83S98.2Very high96.4Very high0 Ų044.3 Ų44.30%022%0.22CC..Hα-helixtrans-58.8-46.7179.1-169.30000112.7F79 Y80 A81 N87 S142 Y172F79-S83 WeakPolarHBondContact O-CB 3.39Å; F79-S83 PolarHBondContact O-N 3.26Å; Y80-S83 WeakPolarHBondContact O-CB 3.39Å; Y80-S83 PolarHBondContact O-N 2.89Å; A81-S83 VanDerWaalsContact C-N 3.33Å; A81-S83 PolarHBondContact O-N 3.27Å; S83-N87 WeakPolarHBondContact O-CB 3.45Å; S83-N87 PolarHBondContact O-N 3.4Å; S83-N87 PolarHBondContact O-ND2 2.91Å; S83-N87 PolarHBondContact OG-ND2 3.34Å; S83-S142 WeakPolarHBondContact OG-CB 3.38Å; S83-S142 PolarHBondContact OG-OG 3.33Å; S83-Y172 VanDerWaalsContact CB-CD1 3.43Å; S83-Y172 WeakPolarHBondContact OG-CD1 3.22Å
84V98.6Very high96.4Very high26 Ų2641.6 Ų41.616%0.15821%0.208CC..Hα-helixtrans-62.5-45.3178.9168.30000110.8Y80 A81 I82 G88 W139 L143 L146Y80-V84 WeakPolarHBondContact O-CB 3.23Å; Y80-V84 VanDerWaalsContact O-CG2 3.26Å; Y80-V84 WeakPolarHBondContact O-CG2 3.44Å; Y80-V84 PolarHBondContact O-N 2.96Å; A81-V84 PolarHBondContact O-N 3.17Å; I82-V84 PolarHBondContact O-N 3.16Å; V84-G88 WeakPolarHBondContact O-CA 3.43Å; V84-G88 PolarHBondContact O-N 3.11Å; V84-W139 HydrophobicContact CG1-CZ2 4.3Å; V84-W139 PolarHBondContact O-NE1 2.74Å; V84-L143 HydrophobicContact CG2-CB 4.07Å; V84-L143 HydrophobicContact CG2-CD1 4.41Å; V84-L146 HydrophobicContact CG2-CD2 4.12Å
85G98.6Very high96.2Very high46 Ų4639.8 Ų39.847%0.47421%0.207SC..Hα-helixtrans-64.8-53.1178.400000112.4A81 I82 F89A81-G85 PolarHBondContact O-N 3.21Å; I82-G85 PolarHBondContact O-N 3.47Å; G85-F89 WeakPolarHBondContact O-CB 3.42Å; G85-F89 PolarHBondContact O-N 3Å
86W98.4Very high96Very high48 Ų4837 Ų3718%0.18220%0.2CC..Hα-helixtrans-65.2-52.3-177.4175.1-111.2000113I82 G88 F89 L90 W107 I173 L177I82-W86 VanDerWaalsContact O-CB 3.23Å; I82-W86 WeakPolarHBondContact O-CB 3.2Å; I82-W86 PolarHBondContact O-N 3.15Å; W86-G88 VanDerWaalsContact C-N 3.31Å; W86-G88 PolarHBondContact O-N 2.91Å; W86-F89 HydrophobicContact CE3-CD1 4.37Å; W86-F89 HydrophobicContact CZ3-CD1 4.27Å; W86-F89 WeakPolarHBondContact O-CB 3.46Å; W86-F89 PolarHBondContact O-N 3.05Å; W86-L90 HydrophobicContact CD2-CG 4.42Å; W86-L90 HydrophobicContact CH2-CD2 4.26Å; W86-L90 HydrophobicContact CZ2-CD1 4.04Å; W86-L90 HydrophobicContact CZ2-CD2 4Å; W86-L90 HydrophobicContact CZ2-CG 4.24Å; W86-L90 WeakPolarHBondContact O-CG 3.49Å; W86-L90 PolarHBondContact O-N 3.28Å; W86-W107 AromaticContact CH2-CH2 3.7Å; W86-W107 HydrophobicContact CH2-CH2 3.7Å; W86-W107 AromaticContact CH2-CZ3 3.86Å; W86-W107 HydrophobicContact CH2-CZ3 3.86Å; W86-W107 HydrophobicContact CZ3-CH2 4.04Å; W86-I173 HydrophobicContact CB-CD1 3.61Å; W86-I173 HydrophobicContact CD2-CD1 3.7Å; W86-I173 HydrophobicContact CD2-CG2 4.43Å; W86-I173 HydrophobicContact CE3-CD1 4.28Å; W86-I173 HydrophobicContact CG-CD1 3.38Å; W86-I173 HydrophobicContact CZ2-CG2 4.04Å; W86-I173 PolarHBondContact NE1-O 3.38Å; W86-L177 HydrophobicContact CZ2-CD2 3.84Å; W86-L177 HydrophobicContact CZ2-CG 4.03Å
87N98Very high95.7Very high3 Ų336.5 Ų36.52%0.01620%0.198CC..Hα-helixtrans-70.6-31.1-178.4-66.8-76000111.5S83 L90 I91 Y172 G176S83-N87 WeakPolarHBondContact O-CB 3.45Å; S83-N87 PolarHBondContact O-N 3.4Å; S83-N87 PolarHBondContact O-ND2 2.91Å; S83-N87 PolarHBondContact OG-ND2 3.34Å; N87-L90 PolarHBondContact O-N 3.47Å; N87-I91 VanDerWaalsContact O-CG1 3.28Å; N87-I91 WeakPolarHBondContact O-CG1 3.43Å; N87-I91 PolarHBondContact O-N 3.1Å; N87-Y172 PolarHBondContact ND2-O 3.17Å; N87-G176 WeakPolarHBondContact OD1-CA 3.32Å; N87-G176 PolarHBondContact OD1-N 2.79Å
88G98.2Very high95.1Very high17 Ų1735.6 Ų35.618%0.17520%0.199CC..Hα-helixtrans-62.5-44171.200000111.6V84 W86 I91 V92V84-G88 WeakPolarHBondContact O-CA 3.43Å; V84-G88 PolarHBondContact O-N 3.11Å; W86-G88 VanDerWaalsContact C-N 3.31Å; W86-G88 PolarHBondContact O-N 2.91Å; G88-I91 PolarHBondContact O-N 2.9Å; G88-V92 WeakPolarHBondContact O-CG2 3.47Å; G88-V92 PolarHBondContact O-N 3.29Å; G88-V92 VanDerWaalsContact O-N 3.1Å
89F98.1Very high94.5Very high87 Ų8738.2 Ų38.238%0.38222%0.218SC..Hα-helixtrans-60.9-45173.8172.3-107.5000112.4G85 W86 I91 V92 L93 W107G85-F89 WeakPolarHBondContact O-CB 3.42Å; G85-F89 PolarHBondContact O-N 3Å; W86-F89 HydrophobicContact CE3-CD1 4.37Å; W86-F89 HydrophobicContact CZ3-CD1 4.27Å; W86-F89 WeakPolarHBondContact O-CB 3.46Å; W86-F89 PolarHBondContact O-N 3.05Å; F89-I91 VanDerWaalsContact C-N 3.33Å; F89-I91 PolarHBondContact O-N 3.08Å; F89-V92 PolarHBondContact O-N 3.28Å; F89-L93 HydrophobicContact CD1-CD1 4.21Å; F89-L93 HydrophobicContact CE1-CD1 3.53Å; F89-L93 HydrophobicContact CE1-CG 4.17Å; F89-L93 HydrophobicContact CE2-CD1 4.33Å; F89-L93 HydrophobicContact CE2-CD2 4.16Å; F89-L93 HydrophobicContact CE2-CG 4.17Å; F89-L93 HydrophobicContact CZ-CD1 3.6Å; F89-L93 HydrophobicContact CZ-CD2 4.07Å; F89-L93 HydrophobicContact CZ-CG 3.94Å; F89-L93 PolarHBondContact O-N 3.38Å; F89-W107 HydrophobicContact CE1-CH2 4.01Å; F89-W107 AromaticContact CE1-CZ2 3.78Å; F89-W107 HydrophobicContact CE1-CZ2 3.78Å; F89-W107 HydrophobicContact CZ-CZ2 4.14Å
90L96.2Very high94Very high1 Ų146.5 Ų46.51%0.00525%0.249CC..Hα-helixtrans-62.3-37.1176.4-66.8-176.7000112.8W86 N87 L93 S94 L108 L180W86-L90 HydrophobicContact CD2-CG 4.42Å; W86-L90 HydrophobicContact CH2-CD2 4.26Å; W86-L90 HydrophobicContact CZ2-CD1 4.04Å; W86-L90 HydrophobicContact CZ2-CD2 4Å; W86-L90 HydrophobicContact CZ2-CG 4.24Å; W86-L90 WeakPolarHBondContact O-CG 3.49Å; W86-L90 PolarHBondContact O-N 3.28Å; N87-L90 PolarHBondContact O-N 3.47Å; L90-L93 HydrophobicContact CD2-CD1 4.41Å; L90-L93 PolarHBondContact O-N 3.46Å; L90-S94 PolarHBondContact O-N 3.13Å; L90-S94 PolarHBondContact O-OG 2.95Å; L90-L108 HydrophobicContact CD2-CD1 4.29Å; L90-L108 HydrophobicContact CD2-CD2 4.08Å; L90-L180 HydrophobicContact CD1-CD1 4.16Å; L90-L180 HydrophobicContact CD2-CD1 4.06Å
91I95.8Very high93.2Very high20 Ų2048.3 Ų48.310%0.10328%0.275CS..Hα-helixtrans-61-46.2173.5-70.3163.2000110.5N87 G88 F89 L93 S94 L95 Q135 V136 W139N87-I91 VanDerWaalsContact O-CG1 3.28Å; N87-I91 WeakPolarHBondContact O-CG1 3.43Å; N87-I91 PolarHBondContact O-N 3.1Å; G88-I91 PolarHBondContact O-N 2.9Å; F89-I91 VanDerWaalsContact C-N 3.33Å; F89-I91 PolarHBondContact O-N 3.08Å; I91-L93 VanDerWaalsContact C-N 3.29Å; I91-L93 PolarHBondContact O-N 3.25Å; I91-S94 PolarHBondContact O-N 3.34Å; I91-L95 HydrophobicContact CG2-CD1 3.81Å; I91-L95 HydrophobicContact CG2-CG 4.17Å; I91-L95 WeakPolarHBondContact O-CB 3.46Å; I91-L95 WeakPolarHBondContact O-CG 3.41Å; I91-L95 PolarHBondContact O-N 3.02Å; I91-Q135 HydrophobicContact CD1-CB 4.26Å; I91-Q135 HydrophobicContact CG1-CB 3.64Å; I91-V136 HydrophobicContact CD1-CG2 4.36Å; I91-W139 HydrophobicContact CD1-CB 3.61Å; I91-W139 HydrophobicContact CD1-CG 3.94Å
92V95.9Very high92.6Very high76 Ų7652.5 Ų52.546%0.46129%0.289SS..Hα-helixtrans-59.2-42.4178.2171.50000110.9G88 F89 L95 N96G88-V92 WeakPolarHBondContact O-CG2 3.47Å; G88-V92 PolarHBondContact O-N 3.29Å; G88-V92 VanDerWaalsContact O-N 3.1Å; F89-V92 PolarHBondContact O-N 3.28Å; V92-L95 PolarHBondContact O-N 2.95Å; V92-N96 WeakPolarHBondContact O-CB 3.45Å; V92-N96 PolarHBondContact O-N 3.37Å; V92-N96 PolarHBondContact O-ND2 3.11Å
93L93.1Very high91.9Very high24 Ų2457.8 Ų57.813%0.12631%0.309CS..Hα-helixtrans-62.5-46174.9-66.9-175.4000112.1F89 L90 I91 L95 N96 M97 F104 P105 L108F89-L93 HydrophobicContact CD1-CD1 4.21Å; F89-L93 HydrophobicContact CE1-CD1 3.53Å; F89-L93 HydrophobicContact CE1-CG 4.17Å; F89-L93 HydrophobicContact CE2-CD1 4.33Å; F89-L93 HydrophobicContact CE2-CD2 4.16Å; F89-L93 HydrophobicContact CE2-CG 4.17Å; F89-L93 HydrophobicContact CZ-CD1 3.6Å; F89-L93 HydrophobicContact CZ-CD2 4.07Å; F89-L93 HydrophobicContact CZ-CG 3.94Å; F89-L93 PolarHBondContact O-N 3.38Å; L90-L93 HydrophobicContact CD2-CD1 4.41Å; L90-L93 PolarHBondContact O-N 3.46Å; I91-L93 VanDerWaalsContact C-N 3.29Å; I91-L93 PolarHBondContact O-N 3.25Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L93-L95 PolarHBondContact O-N 2.85Å; L93-N96 PolarHBondContact O-N 2.93Å; L93-M97 PolarHBondContact O-N 3.19Å; L93-F104 HydrophobicContact CB-CD1 3.89Å; L93-F104 HydrophobicContact CB-CE1 3.76Å; L93-P105 HydrophobicContact CD1-CG 4.29Å; L93-P105 HydrophobicContact CD2-CG 4.27Å; L93-L108 HydrophobicContact CD1-CD2 3.58Å
94S90.4Very high91.5Very high0 Ų058.7 Ų58.70%031%0.313CS..Hα-helixtrans-59.3-44.6177.1-64.30000111.5L90 I91 M97 I98 Q135L90-S94 PolarHBondContact O-N 3.13Å; L90-S94 PolarHBondContact O-OG 2.95Å; I91-S94 PolarHBondContact O-N 3.34Å; S94-M97 PolarHBondContact O-N 2.79Å; S94-I98 VanDerWaalsContact O-CG1 3.31Å; S94-I98 WeakPolarHBondContact O-CG1 3.38Å; S94-I98 PolarHBondContact O-N 3.22Å; S94-Q135 PolarHBondContact OG-NE2 3.41Å; S94-Q135 PolarHBondContact OG-OE1 2.92Å
95L89.8Confident91.1Very high75 Ų7559.4 Ų59.439%0.39332%0.318SS..Hα-helixtrans-66.9-39.9178.7-69.1176.5000112.1I91 V92 L93 M97 I98 V99 V132I91-L95 HydrophobicContact CG2-CD1 3.81Å; I91-L95 HydrophobicContact CG2-CG 4.17Å; I91-L95 WeakPolarHBondContact O-CB 3.46Å; I91-L95 WeakPolarHBondContact O-CG 3.41Å; I91-L95 PolarHBondContact O-N 3.02Å; V92-L95 PolarHBondContact O-N 2.95Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L93-L95 PolarHBondContact O-N 2.85Å; L95-M97 VanDerWaalsContact C-N 3.27Å; L95-M97 PolarHBondContact O-N 3.46Å; L95-I98 PolarHBondContact O-N 3.15Å; L95-V99 WeakPolarHBondContact O-CB 3.28Å; L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 3.41Å; L95-V132 HydrophobicContact CD2-CG1 4.48Å
96N89.5Confident90.6Very high51 Ų5161.3 Ų61.327%0.27332%0.324SS..Hα-helixtrans-61.9-37.1175.2-80.3-31000112.1V92 L93 W100 G101 Q102V92-N96 WeakPolarHBondContact O-CB 3.45Å; V92-N96 PolarHBondContact O-N 3.37Å; V92-N96 PolarHBondContact O-ND2 3.11Å; L93-N96 PolarHBondContact O-N 2.93Å; N96-W100 CarbonylContact O-C 3.6Å; N96-W100 WeakPolarHBondContact O-CA 3.44Å; N96-W100 WeakPolarHBondContact O-CB 3.45Å; N96-W100 PolarHBondContact O-N 2.83Å; N96-G101 PolarHBondContact O-N 3.28Å; N96-Q102 PolarHBondContact O-N 3.18Å
97M85.3Confident90.3Very high25 Ų2564 Ų6412%0.12333%0.334CS..Hα-helixtrans-66.7-42.4173.9-174.6168.5-17200112.3L93 S94 L95 G101 Q102 F104 Q125 V126L93-M97 PolarHBondContact O-N 3.19Å; S94-M97 PolarHBondContact O-N 2.79Å; L95-M97 VanDerWaalsContact C-N 3.27Å; L95-M97 PolarHBondContact O-N 3.46Å; M97-G101 WeakPolarHBondContact O-CA 3.5Å; M97-G101 PolarHBondContact O-N 3.33Å; M97-G101 VanDerWaalsContact O-N 3.09Å; M97-Q102 WeakPolarHBondContact CA-O 3.26Å; M97-Q102 WeakPolarHBondContact CB-O 3.45Å; M97-Q102 VanDerWaalsContact CG-O 3.25Å; M97-Q102 WeakPolarHBondContact CG-O 3.37Å; M97-F104 HydrophobicContact SD-CD2 4.1Å; M97-F104 HydrophobicContact SD-CE1 4.47Å; M97-F104 HydrophobicContact SD-CE2 3.87Å; M97-F104 HydrophobicContact SD-CZ 4.07Å; M97-Q125 WeakPolarHBondContact CE-O 3.12Å; M97-V126 HydrophobicContact CE-CG2 4.23Å
98I82.9Confident90Very high72 Ų7263.9 Ų63.937%0.36933%0.334SS..Hα-helixtrans-70.7-46.3-178.7-68.6164.5000112S94 L95 V126 P127 V132S94-I98 VanDerWaalsContact O-CG1 3.31Å; S94-I98 WeakPolarHBondContact O-CG1 3.38Å; S94-I98 PolarHBondContact O-N 3.22Å; L95-I98 PolarHBondContact O-N 3.15Å; I98-V126 HydrophobicContact CG1-CG1 3.76Å; I98-P127 HydrophobicContact CD1-CB 4.39Å; I98-V132 HydrophobicContact CD1-CG2 3.57Å
99V85.7Confident89.4Confident97 Ų9764.4 Ų64.459%0.58833%0.333SS*.Hα-helixtrans-83.6-43.7-172.8177.50000111.6L95L95-V99 WeakPolarHBondContact O-CB 3.28Å; L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 3.41Å
100W86.4Confident88.9Confident188 Ų18864.4 Ų64.471%0.71234%0.338SS*.Hα-helixtrans-109.6-1.1-171.1-56.6107.7000113.5N96 Q102N96-W100 CarbonylContact O-C 3.6Å; N96-W100 WeakPolarHBondContact O-CA 3.44Å; N96-W100 WeakPolarHBondContact O-CB 3.45Å; N96-W100 PolarHBondContact O-N 2.83Å; W100-Q102 HydrophobicContact CB-CG 4.13Å; W100-Q102 PolarHBondContact O-N 3.02Å
101G81.6Confident88.6Confident60 Ų6067.6 Ų67.662%0.61935%0.354SS*.  trans65.815.7-17800000113.9N96 M97N96-G101 PolarHBondContact O-N 3.28Å; M97-G101 WeakPolarHBondContact O-CA 3.5Å; M97-G101 PolarHBondContact O-N 3.33Å; M97-G101 VanDerWaalsContact O-N 3.09Å
102Q85.9Confident88.2Confident121 Ų12166.7 Ų66.757%0.56535%0.349SS*.PPolyproline II helixtrans-70.2140.5179.1-68.5-157-1.200111N96 M97 W100N96-Q102 PolarHBondContact O-N 3.18Å; M97-Q102 WeakPolarHBondContact CA-O 3.26Å; M97-Q102 WeakPolarHBondContact CB-O 3.45Å; M97-Q102 VanDerWaalsContact CG-O 3.25Å; M97-Q102 WeakPolarHBondContact CG-O 3.37Å; W100-Q102 HydrophobicContact CB-CG 4.13Å; W100-Q102 PolarHBondContact O-N 3.02Å
103K84.3Confident87.7Confident176 Ų17663 Ų6377%0.76533%0.327SS*.PPolyproline II helixtrans-76.6150.8175-63.9177.9-176.6170.60110
104F88.1Confident87.4Confident19 Ų1967.5 Ų67.58%0.08335%0.346CS..PPolyproline II helixtrans-57.1148.1166.5-70.9-44.6000111.1L93 M97 L108 T109 P127 L180L93-F104 HydrophobicContact CB-CD1 3.89Å; L93-F104 HydrophobicContact CB-CE1 3.76Å; M97-F104 HydrophobicContact SD-CD2 4.1Å; M97-F104 HydrophobicContact SD-CE1 4.47Å; M97-F104 HydrophobicContact SD-CE2 3.87Å; M97-F104 HydrophobicContact SD-CZ 4.07Å; F104-L108 HydrophobicContact CB-CD2 4.22Å; F104-L108 HydrophobicContact CD1-CD2 3.97Å; F104-L108 HydrophobicContact CG-CD2 4.07Å; F104-T109 HydrophobicContact CB-CG2 3.74Å; F104-P127 HydrophobicContact CE2-CG 4.37Å; F104-P127 HydrophobicContact CZ-CG 3.84Å; F104-L180 HydrophobicContact CZ-CD2 4.27Å
105P90.8Very high87.3Confident42 Ų4268.2 Ų68.227%0.27335%0.35SS..PPolyproline II helixtrans-54.3145.6171.6-24.934.5000111.6L93 W107 L108 T109L93-P105 HydrophobicContact CD1-CG 4.29Å; L93-P105 HydrophobicContact CD2-CG 4.27Å; P105-W107 VanDerWaalsContact C-N 3.31Å; P105-W107 VanDerWaalsContact CB-CD1 3.49Å; P105-W107 HydrophobicContact CB-CG 4.3Å; P105-W107 PolarHBondContact O-N 3.02Å; P105-L108 WeakPolarHBondContact O-CB 3.41Å; P105-L108 PolarHBondContact O-N 3.4Å; P105-T109 PolarHBondContact O-N 2.93Å; P105-T109 VanDerWaalsContact O-N 3.09Å
106S88.8Confident87Confident85 Ų8565.2 Ų65.259%0.59433%0.334SS*.Hα-helixtrans-55.6-44.2-176.852.30000112.9L108 T109 D110S106-L108 PolarHBondContact O-N 2.88Å; S106-T109 WeakPolarHBondContact CA-OG1 3.42Å; S106-T109 PolarHBondContact O-N 3.24Å; S106-T109 VanDerWaalsContact O-N 3.14Å; S106-T109 PolarHBondContact O-OG1 3.46Å; S106-D110 WeakPolarHBondContact O-CB 3.32Å; S106-D110 PolarHBondContact O-N 2.92Å
107W91.8Very high86.1Confident105 Ų10566.6 Ų66.640%0.39835%0.345SS..Hα-helixtrans-57.1-35.3177.668.6-99.9000112.4W86 F89 P105 I111W86-W107 AromaticContact CH2-CH2 3.7Å; W86-W107 HydrophobicContact CH2-CH2 3.7Å; W86-W107 AromaticContact CH2-CZ3 3.86Å; W86-W107 HydrophobicContact CH2-CZ3 3.86Å; W86-W107 HydrophobicContact CZ3-CH2 4.04Å; F89-W107 HydrophobicContact CE1-CH2 4.01Å; F89-W107 AromaticContact CE1-CZ2 3.78Å; F89-W107 HydrophobicContact CE1-CZ2 3.78Å; F89-W107 HydrophobicContact CZ-CZ2 4.14Å; P105-W107 VanDerWaalsContact C-N 3.31Å; P105-W107 VanDerWaalsContact CB-CD1 3.49Å; P105-W107 HydrophobicContact CB-CG 4.3Å; P105-W107 PolarHBondContact O-N 3.02Å; W107-I111 HydrophobicContact CE3-CD1 3.82Å; W107-I111 HydrophobicContact CZ3-CD1 4.12Å; W107-I111 VanDerWaalsContact O-CG1 3.27Å; W107-I111 WeakPolarHBondContact O-CG1 3.14Å; W107-I111 PolarHBondContact O-N 2.9Å
108L90.8Very high85.1Confident0 Ų067.7 Ų67.70%036%0.363CS..Hα-helixtrans-76-43.3179.718059.1000110L90 L93 F104 P105 S106 D110 I111 L112 L177 L180L90-L108 HydrophobicContact CD2-CD1 4.29Å; L90-L108 HydrophobicContact CD2-CD2 4.08Å; L93-L108 HydrophobicContact CD1-CD2 3.58Å; F104-L108 HydrophobicContact CB-CD2 4.22Å; F104-L108 HydrophobicContact CD1-CD2 3.97Å; F104-L108 HydrophobicContact CG-CD2 4.07Å; P105-L108 WeakPolarHBondContact O-CB 3.41Å; P105-L108 PolarHBondContact O-N 3.4Å; S106-L108 PolarHBondContact O-N 2.88Å; L108-D110 VanDerWaalsContact C-N 3.26Å; L108-D110 PolarHBondContact O-N 3.22Å; L108-I111 PolarHBondContact O-N 3.5Å; L108-L112 HydrophobicContact CD1-CD1 4.19Å; L108-L112 HydrophobicContact CD1-CG 4.1Å; L108-L112 HydrophobicContact CG-CD1 4.01Å; L108-L112 HydrophobicContact CG-CG 4.34Å; L108-L112 WeakPolarHBondContact O-CB 3.5Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.38Å; L108-L112 PolarHBondContact O-N 3.46Å; L108-L177 HydrophobicContact CD1-CD2 3.73Å; L108-L180 HydrophobicContact CD2-CD1 4.44Å
109T86.4Confident83.8Confident28 Ų2865.3 Ų65.317%0.17236%0.356CS..Hα-helixtrans-62.2-35.5176540000112.3F104 P105 S106 L112 G113F104-T109 HydrophobicContact CB-CG2 3.74Å; P105-T109 PolarHBondContact O-N 2.93Å; P105-T109 VanDerWaalsContact O-N 3.09Å; S106-T109 WeakPolarHBondContact CA-OG1 3.42Å; S106-T109 PolarHBondContact O-N 3.24Å; S106-T109 VanDerWaalsContact O-N 3.14Å; S106-T109 PolarHBondContact O-OG1 3.46Å; T109-L112 PolarHBondContact O-N 2.9Å; T109-G113 PolarHBondContact O-N 2.7Å
110D86.8Confident82.2Confident88 Ų8866.4 Ų66.447%0.47137%0.365SS..Hα-helixtrans-67.5-44.1177.7-64-21.9000111.1S106 L108 G113 F114S106-D110 WeakPolarHBondContact O-CB 3.32Å; S106-D110 PolarHBondContact O-N 2.92Å; L108-D110 VanDerWaalsContact C-N 3.26Å; L108-D110 PolarHBondContact O-N 3.22Å; D110-G113 PolarHBondContact O-N 2.88Å; D110-F114 WeakPolarHBondContact O-CB 3.44Å; D110-F114 PolarHBondContact O-N 2.84Å
111I90.5Very high80.6Confident67 Ų6761.4 Ų61.434%0.34436%0.355SS..Hα-helixtrans-62.2-48.5174.8-70.4171.8000110.7W107 L108 F114 L115 L177W107-I111 HydrophobicContact CE3-CD1 3.82Å; W107-I111 HydrophobicContact CZ3-CD1 4.12Å; W107-I111 VanDerWaalsContact O-CG1 3.27Å; W107-I111 WeakPolarHBondContact O-CG1 3.14Å; W107-I111 PolarHBondContact O-N 2.9Å; L108-I111 PolarHBondContact O-N 3.5Å; I111-F114 PolarHBondContact O-N 3.05Å; I111-L115 HydrophobicContact CG2-CD1 3.87Å; I111-L115 HydrophobicContact CG2-CG 4.39Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.36Å; I111-L115 PolarHBondContact O-N 2.91Å; I111-L177 HydrophobicContact CG2-CD1 3.89Å; I111-L177 HydrophobicContact CG2-CD2 4.09Å
112L88.6Confident79.1Confident1 Ų161.7 Ų61.71%0.00535%0.351CS..Hα-helixtrans-63.2-43.8-179.7-66.7175.7000111.1L108 T109 F114 L115 T116 V123 L177 L180L108-L112 HydrophobicContact CD1-CD1 4.19Å; L108-L112 HydrophobicContact CD1-CG 4.1Å; L108-L112 HydrophobicContact CG-CD1 4.01Å; L108-L112 HydrophobicContact CG-CG 4.34Å; L108-L112 WeakPolarHBondContact O-CB 3.5Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.38Å; L108-L112 PolarHBondContact O-N 3.46Å; T109-L112 PolarHBondContact O-N 2.9Å; L112-F114 PolarHBondContact O-N 3.37Å; L112-L115 PolarHBondContact O-N 2.92Å; L112-T116 WeakPolarHBondContact O-CG2 3.44Å; L112-T116 PolarHBondContact O-N 3.36Å; L112-T116 PolarHBondContact O-OG1 3.4Å; L112-V123 HydrophobicContact CB-CG2 3.98Å; L112-L177 HydrophobicContact CD2-CD2 4.12Å; L112-L180 HydrophobicContact CD1-CB 4.14Å; L112-L180 HydrophobicContact CD1-CD1 4.22Å; L112-L180 HydrophobicContact CD2-CB 3.74Å; L112-L180 HydrophobicContact CD2-CD1 4.4Å
113G84.3Confident77.6Confident0 Ų057.2 Ų57.20%033%0.332CS..Hα-helixtrans-60.9-41.9176.400000112.4T109 D110 T117 G118 G119T109-G113 PolarHBondContact O-N 2.7Å; D110-G113 PolarHBondContact O-N 2.88Å; G113-T117 WeakPolarHBondContact O-CA 3.27Å; G113-T117 PolarHBondContact O-N 2.73Å; G113-T117 PolarHBondContact O-OG1 2.95Å; G113-G118 PolarHBondContact O-N 3.28Å; G113-G119 CarbonylContact C-O 3.03Å
114F87.1Confident76Confident118 Ų11858.7 Ų58.752%0.51833%0.333SS..Hα-helixtrans-61.9-45.5173.3177-99.7000112.1V9 D110 I111 L112 T116 G118V9-F114 HydrophobicContact CG1-CE1 4.19Å; D110-F114 WeakPolarHBondContact O-CB 3.44Å; D110-F114 PolarHBondContact O-N 2.84Å; I111-F114 PolarHBondContact O-N 3.05Å; L112-F114 PolarHBondContact O-N 3.37Å; F114-T116 PolarHBondContact O-N 3.44Å; F114-G118 WeakPolarHBondContact O-CA 3.24Å; F114-G118 PolarHBondContact O-N 2.96Å
115L88.8Confident74.7Confident15 Ų1561.3 Ų61.38%0.07935%0.345CS..Hα-helixtrans-68.4-32.2-177.9-73.1177.2000113.6V9 I10 I111 L112 L177V9-L115 HydrophobicContact CG1-CD2 4.46Å; V9-L115 PolarHBondContact N-O 3.41Å; I10-L115 HydrophobicContact CB-CB 4.31Å; I10-L115 HydrophobicContact CD1-CD2 4.35Å; I10-L115 PolarHBondContact N-O 2.88Å; I111-L115 HydrophobicContact CG2-CD1 3.87Å; I111-L115 HydrophobicContact CG2-CG 4.39Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.36Å; I111-L115 PolarHBondContact O-N 2.91Å; L112-L115 PolarHBondContact O-N 2.92Å; L115-L177 HydrophobicContact CD1-CB 4.08Å; L115-L177 HydrophobicContact CD1-CD1 4.12Å
116T82Confident73.5Confident11 Ų1163.4 Ų63.47%0.06736%0.357CS..Hα-helixtrans-94.5-55.7-179.457.40000112.3C8 L112 F114 C181C8-T116 WeakPolarHBondContact CB-O 3.48Å; C8-T116 PolarHBondContact SG-O 2.96Å; L112-T116 WeakPolarHBondContact O-CG2 3.44Å; L112-T116 PolarHBondContact O-N 3.36Å; L112-T116 PolarHBondContact O-OG1 3.4Å; F114-T116 PolarHBondContact O-N 3.44Å; T116-C181 HydrophobicContact CG2-CB 3.68Å
117T72.1Confident72.7Confident80 Ų8059.8 Ų59.849%0.49133%0.332SS..Hα-helixtrans-101.7-6-169.661.10000114.5G113 G119 V121G113-T117 WeakPolarHBondContact O-CA 3.27Å; G113-T117 PolarHBondContact O-N 2.73Å; G113-T117 PolarHBondContact O-OG1 2.95Å; T117-G119 VanDerWaalsContact C-N 3.26Å; T117-G119 PolarHBondContact O-N 3.18Å; T117-G119 PolarHBondContact OG1-O 3.09Å; T117-G119 VanDerWaalsContact OG1-O 3.08Å; T117-V121 HydrophobicContact CG2-CB 4.16Å; T117-V121 HydrophobicContact CG2-CG2 4.21Å; T117-V121 WeakPolarHBondContact OG1-CB 3.42Å; T117-V121 WeakPolarHBondContact OG1-CG2 3.21Å
118G63.2Low72Confident49 Ų4957 Ų5751%0.50532%0.323SS..SBendtrans71.219.3-176.100000113.8G113 F114G113-G118 PolarHBondContact O-N 3.28Å; F114-G118 WeakPolarHBondContact O-CA 3.24Å; F114-G118 PolarHBondContact O-N 2.96Å
119G56Low71.6Confident22 Ų2259 Ų5923%0.22734%0.336CS..SBendtrans-171.8174.6178.900000113.1G113 T117 V121G113-G119 CarbonylContact C-O 3.03Å; T117-G119 VanDerWaalsContact C-N 3.26Å; T117-G119 PolarHBondContact O-N 3.18Å; T117-G119 PolarHBondContact OG1-O 3.09Å; T117-G119 VanDerWaalsContact OG1-O 3.08Å; G119-V121 VanDerWaalsContact C-N 3.3Å; G119-V121 PolarHBondContact O-N 3.28Å
120P51.2Low71.5Confident119 Ų11958 Ų5877%0.77333%0.329SS*.  trans-74.283179.229.9-32.9000110.3
121V52.8Low71.5Confident84 Ų8454 Ų5451%0.50931%0.309SS..  trans-104.1128.6167.4-177.90000107.7T117 G119 V123T117-V121 HydrophobicContact CG2-CB 4.16Å; T117-V121 HydrophobicContact CG2-CG2 4.21Å; T117-V121 WeakPolarHBondContact OG1-CB 3.42Å; T117-V121 WeakPolarHBondContact OG1-CG2 3.21Å; G119-V121 VanDerWaalsContact C-N 3.3Å; G119-V121 PolarHBondContact O-N 3.28Å; V121-V123 PolarHBondContact O-N 2.87Å
122A50.3Low71.5Confident65 Ų6551.9 Ų51.954%0.53730%0.299SS..  trans-62.2104.4178.500000109.5R124A122-R124 HydrophobicContact CB-CG 3.99Å; A122-R124 PolarHBondContact O-N 2.79Å
123V54.1Low71.6Confident27 Ų2754.4 Ų54.416%0.16431%0.312CS..  trans-63.588167.1-178.30000107L112 V121 S184L112-V123 HydrophobicContact CB-CG2 3.98Å; V121-V123 PolarHBondContact O-N 2.87Å; V123-S184 WeakPolarHBondContact CG1-OG 3.46Å
124R52.2Low72Confident207 Ų20754.5 Ų54.578%0.78131%0.313SS*.  trans-102.665.9-179.9-77.9-172.4177.6-1722.1109.4A122A122-R124 HydrophobicContact CB-CG 3.99Å; A122-R124 PolarHBondContact O-N 2.79Å
125Q60.7Low72.4Confident74 Ų7449 Ų4935%0.34629%0.289SS..  trans-139.2135.2171.7-65.7-170.6-9.600110.1M97 I187M97-Q125 WeakPolarHBondContact CE-O 3.12Å; Q125-I187 PolarHBondContact NE2-O 3.47Å; Q125-I187 VanDerWaalsContact NE2-O 3.13Å
126V64.2Low72.8Confident87 Ų8751 Ų5153%0.52730%0.302SS..PPolyproline II helixtrans-67.8130.8170.6176.70000107.1M97 I98 Q128M97-V126 HydrophobicContact CE-CG2 4.23Å; I98-V126 HydrophobicContact CG1-CG1 3.76Å; V126-Q128 PolarHBondContact O-N 3.14Å
127P72.8Confident73.6Confident9 Ų951.5 Ų51.56%0.05830%0.304CS..PPolyproline II helixtrans-55.1133.1-178.7-2733.8000112.2I98 F104 V132 D183I98-P127 HydrophobicContact CD1-CB 4.39Å; F104-P127 HydrophobicContact CE2-CG 4.37Å; F104-P127 HydrophobicContact CZ-CG 3.84Å; P127-V132 HydrophobicContact CB-CG2 4.06Å; P127-D183 WeakPolarHBondContact CA-OD2 3.48Å
128Q78.1Confident74.8Confident46 Ų4647.7 Ų47.722%0.21528%0.28CS..PPolyproline II helixtrans-67.3157.1174.8-59.5178.115.200111.2V126 S130 A131 V132 D183 I187V126-Q128 PolarHBondContact O-N 3.14Å; Q128-S130 WeakPolarHBondContact CB-OG 3.23Å; Q128-S130 PolarHBondContact O-N 3.45Å; Q128-S130 PolarHBondContact OE1-OG 3.1Å; Q128-A131 PolarHBondContact O-N 2.98Å; Q128-A131 VanDerWaalsContact O-N 3.08Å; Q128-V132 PolarHBondContact O-N 3.08Å; Q128-V132 VanDerWaalsContact O-N 3.09Å; Q128-D183 WeakPolarHBondContact CB-OD1 3.45Å; Q128-D183 VanDerWaalsContact CD-OD1 3.27Å; Q128-D183 WeakPolarHBondContact CG-OD1 3.47Å; Q128-D183 PolarHBondContact N-OD1 3.2Å; Q128-D183 PolarHBondContact N-OD2 2.86Å; Q128-I187 VanDerWaalsContact NE2-CD1 3.29Å
129V81.6Confident76.5Confident43 Ų4349.2 Ų49.226%0.26127%0.271SS..Hα-helixtrans-56.8-38.1176177.40000111.5V132 L133 L196V129-V132 PolarHBondContact O-N 3.32Å; V129-L133 VanDerWaalsContact O-CB 3.3Å; V129-L133 WeakPolarHBondContact O-CB 3.34Å; V129-L133 PolarHBondContact O-N 3.04Å; V129-L196 HydrophobicContact CG1-CD2 3.84Å; V129-L196 HydrophobicContact CG2-CD2 3.92Å; V129-L196 HydrophobicContact CG2-CG 4.17Å
130S83.9Confident78.5Confident5 Ų551.2 Ų51.24%0.03528%0.278CS..Hα-helixtrans-59.6-46.417548.20000112Q128 L133 V134Q128-S130 WeakPolarHBondContact CB-OG 3.23Å; Q128-S130 PolarHBondContact O-N 3.45Å; Q128-S130 PolarHBondContact OE1-OG 3.1Å; S130-L133 PolarHBondContact O-N 3.42Å; S130-V134 WeakPolarHBondContact O-CG2 3.48Å; S130-V134 PolarHBondContact O-N 2.66Å
131A86.8Confident80.8Confident6 Ų645.5 Ų45.55%0.0524%0.241CC..Hα-helixtrans-63.7-46.6179.100000111.6Q128 L133 V134 Q135 D183Q128-A131 PolarHBondContact O-N 2.98Å; Q128-A131 VanDerWaalsContact O-N 3.08Å; A131-L133 VanDerWaalsContact C-N 3.31Å; A131-L133 PolarHBondContact O-N 3.17Å; A131-V134 PolarHBondContact O-N 3.01Å; A131-Q135 WeakPolarHBondContact O-CG 3.37Å; A131-Q135 PolarHBondContact O-N 3.22Å; A131-D183 HydrophobicContact CB-CB 3.71Å; A131-D183 WeakPolarHBondContact CB-OD1 3.37Å
132V89.8Confident82.9Confident22 Ų2241.5 Ų41.513%0.13322%0.217CC..Hα-helixtrans-61-41.9175.9178.90000111.1L95 I98 P127 Q128 V129 V134 Q135 V136L95-V132 HydrophobicContact CD2-CG1 4.48Å; I98-V132 HydrophobicContact CD1-CG2 3.57Å; P127-V132 HydrophobicContact CB-CG2 4.06Å; Q128-V132 PolarHBondContact O-N 3.08Å; Q128-V132 VanDerWaalsContact O-N 3.09Å; V129-V132 PolarHBondContact O-N 3.32Å; V132-V134 PolarHBondContact O-N 3.17Å; V132-Q135 WeakPolarHBondContact O-CB 3.35Å; V132-Q135 PolarHBondContact O-N 3.28Å; V132-V136 HydrophobicContact CG1-CG2 4.43Å; V132-V136 WeakPolarHBondContact O-CG2 3.39Å; V132-V136 PolarHBondContact O-N 3.12Å
133L91.2Very high85.2Confident54 Ų5441 Ų4128%0.28321%0.205SC..Hα-helixtrans-63-42177.1-176.358.2000111.7V129 S130 A131 V136 L137 Y204 V270V129-L133 VanDerWaalsContact O-CB 3.3Å; V129-L133 WeakPolarHBondContact O-CB 3.34Å; V129-L133 PolarHBondContact O-N 3.04Å; S130-L133 PolarHBondContact O-N 3.42Å; A131-L133 VanDerWaalsContact C-N 3.31Å; A131-L133 PolarHBondContact O-N 3.17Å; L133-V136 PolarHBondContact O-N 3.49Å; L133-L137 HydrophobicContact CD1-CD1 4.38Å; L133-L137 HydrophobicContact CD1-CG 4.3Å; L133-L137 HydrophobicContact CG-CD1 4.21Å; L133-L137 WeakPolarHBondContact O-CB 3.38Å; L133-L137 VanDerWaalsContact O-CG 3.3Å; L133-L137 WeakPolarHBondContact O-CG 3.49Å; L133-L137 PolarHBondContact O-N 3.26Å; L133-Y204 HydrophobicContact CD2-CD1 4.32Å; L133-Y204 HydrophobicContact CD2-CG 4.26Å; L133-V270 HydrophobicContact CB-CG1 4.07Å; L133-V270 HydrophobicContact CD2-CG1 3.6Å; L133-V270 HydrophobicContact CG-CG1 3.71Å
134V93.8Very high87.4Confident2 Ų241.7 Ų41.71%0.01221%0.205CC..Hα-helixtrans-62.8-43.5173.1172.50000111.2S130 A131 V132 V136 L137 L138 V179 L267 V270 W278S130-V134 WeakPolarHBondContact O-CG2 3.48Å; S130-V134 PolarHBondContact O-N 2.66Å; A131-V134 PolarHBondContact O-N 3.01Å; V132-V134 PolarHBondContact O-N 3.17Å; V134-V136 VanDerWaalsContact C-N 3.33Å; V134-V136 PolarHBondContact O-N 3.21Å; V134-L137 PolarHBondContact O-N 3.46Å; V134-L138 WeakPolarHBondContact O-CB 3.3Å; V134-L138 PolarHBondContact O-N 2.9Å; V134-V179 HydrophobicContact CB-CG1 4.04Å; V134-V179 HydrophobicContact CG1-CB 4.45Å; V134-V179 HydrophobicContact CG1-CG1 3.81Å; V134-V179 HydrophobicContact CG1-CG2 3.72Å; V134-L267 HydrophobicContact CG1-CB 4.35Å; V134-L267 HydrophobicContact CG1-CD2 4.35Å; V134-V270 HydrophobicContact CG2-CB 3.96Å; V134-V270 HydrophobicContact CG2-CG1 3.67Å; V134-W278 HydrophobicContact CG1-CH2 4.09Å; V134-W278 HydrophobicContact CG1-CZ2 4.32Å; V134-W278 HydrophobicContact CG1-CZ3 4.39Å
135Q95.3Very high89.5Confident3 Ų333 Ų331%0.01417%0.172CC..Hα-helixtrans-57.8-46.9175.6-68.8-179.3-55.500111I91 S94 A131 V132 L138 W139 V179I91-Q135 HydrophobicContact CD1-CB 4.26Å; I91-Q135 HydrophobicContact CG1-CB 3.64Å; S94-Q135 PolarHBondContact OG-NE2 3.41Å; S94-Q135 PolarHBondContact OG-OE1 2.92Å; A131-Q135 WeakPolarHBondContact O-CG 3.37Å; A131-Q135 PolarHBondContact O-N 3.22Å; V132-Q135 WeakPolarHBondContact O-CB 3.35Å; V132-Q135 PolarHBondContact O-N 3.28Å; Q135-L138 PolarHBondContact O-N 3.5Å; Q135-W139 WeakPolarHBondContact O-CB 3.32Å; Q135-W139 PolarHBondContact O-N 3.32Å; Q135-V179 HydrophobicContact CG-CB 4.22Å; Q135-V179 HydrophobicContact CG-CG1 3.55Å
136V97.3Very high91.3Very high57 Ų5730.8 Ų30.835%0.34516%0.162SC..Hα-helixtrans-63-49.2178.9170.50000111.2I91 V132 L133 V134 L138 W139 V140I91-V136 HydrophobicContact CD1-CG2 4.36Å; V132-V136 HydrophobicContact CG1-CG2 4.43Å; V132-V136 WeakPolarHBondContact O-CG2 3.39Å; V132-V136 PolarHBondContact O-N 3.12Å; L133-V136 PolarHBondContact O-N 3.49Å; V134-V136 VanDerWaalsContact C-N 3.33Å; V134-V136 PolarHBondContact O-N 3.21Å; V136-L138 VanDerWaalsContact C-N 3.32Å; V136-L138 PolarHBondContact O-N 3.29Å; V136-W139 PolarHBondContact O-N 3.38Å; V136-V140 HydrophobicContact CG1-CG2 4.4Å; V136-V140 WeakPolarHBondContact O-CG2 2.95Å; V136-V140 PolarHBondContact O-N 3.46Å
137L97.9Very high93Very high21 Ų2130.8 Ų30.811%0.1116%0.159CC..Hα-helixtrans-63-39.4179-69.2174.9000111.7L133 V134 W139 V140 H141 F211 L267 V270L133-L137 HydrophobicContact CD1-CD1 4.38Å; L133-L137 HydrophobicContact CD1-CG 4.3Å; L133-L137 HydrophobicContact CG-CD1 4.21Å; L133-L137 WeakPolarHBondContact O-CB 3.38Å; L133-L137 VanDerWaalsContact O-CG 3.3Å; L133-L137 WeakPolarHBondContact O-CG 3.49Å; L133-L137 PolarHBondContact O-N 3.26Å; V134-L137 PolarHBondContact O-N 3.46Å; L137-W139 VanDerWaalsContact C-N 3.35Å; L137-V140 PolarHBondContact O-N 3.22Å; L137-H141 WeakPolarHBondContact O-CB 3.24Å; L137-H141 PolarHBondContact O-N 3.25Å; L137-F211 HydrophobicContact CB-CD2 4.31Å; L137-F211 HydrophobicContact CB-CE2 4.02Å; L137-F211 HydrophobicContact CB-CZ 4.22Å; L137-F211 HydrophobicContact CD2-CD1 3.89Å; L137-F211 HydrophobicContact CD2-CE1 3.95Å; L137-F211 HydrophobicContact CD2-CG 4.22Å; L137-F211 HydrophobicContact CD2-CZ 4.33Å; L137-F211 VanDerWaalsContact O-CZ 3.23Å; L137-F211 WeakPolarHBondContact O-CZ 3.24Å; L137-L267 HydrophobicContact CB-CD2 3.45Å; L137-L267 VanDerWaalsContact CB-CD2 3.45Å; L137-L267 HydrophobicContact CD1-CD2 3.95Å; L137-L267 HydrophobicContact CG-CD2 4.37Å; L137-V270 HydrophobicContact CD1-CG1 4.39Å; L137-V270 HydrophobicContact CD1-CG2 3.89Å
138L97.9Very high94.1Very high0 Ų030.6 Ų30.60%016%0.157CC..Hα-helixtrans-63.3-40.8174.5176.462.5000112.2V134 Q135 V136 H141 S142 L175 V179 L267V134-L138 WeakPolarHBondContact O-CB 3.3Å; V134-L138 PolarHBondContact O-N 2.9Å; Q135-L138 PolarHBondContact O-N 3.5Å; V136-L138 VanDerWaalsContact C-N 3.32Å; V136-L138 PolarHBondContact O-N 3.29Å; L138-H141 PolarHBondContact O-N 3.17Å; L138-S142 WeakPolarHBondContact O-CB 3.46Å; L138-S142 PolarHBondContact O-N 3.33Å; L138-S142 PolarHBondContact O-OG 2.77Å; L138-L175 HydrophobicContact CD1-CD2 3.45Å; L138-L175 VanDerWaalsContact CD1-CD2 3.45Å; L138-L175 HydrophobicContact CD1-CG 4.15Å; L138-L175 HydrophobicContact CD2-CD2 4Å; L138-L175 HydrophobicContact CD2-CG 3.8Å; L138-L175 HydrophobicContact CG-CD2 4.36Å; L138-V179 HydrophobicContact CD2-CG2 4.16Å; L138-L267 HydrophobicContact CB-CD1 4.5Å; L138-L267 HydrophobicContact CD1-CD1 4.49Å
139W98.6Very high95Very high81 Ų8128.8 Ų28.831%0.30715%0.149SC..Hα-helixtrans-67.2-43.8176.5-176.383.9000111.5V84 I91 Q135 V136 L137 H141 S142 L143V84-W139 HydrophobicContact CG1-CZ2 4.3Å; V84-W139 PolarHBondContact O-NE1 2.74Å; I91-W139 HydrophobicContact CD1-CB 3.61Å; I91-W139 HydrophobicContact CD1-CG 3.94Å; Q135-W139 WeakPolarHBondContact O-CB 3.32Å; Q135-W139 PolarHBondContact O-N 3.32Å; V136-W139 PolarHBondContact O-N 3.38Å; L137-W139 VanDerWaalsContact C-N 3.35Å; W139-H141 VanDerWaalsContact C-N 3.34Å; W139-H141 PolarHBondContact O-N 3.45Å; W139-S142 PolarHBondContact O-N 3.38Å; W139-L143 HydrophobicContact CH2-CD2 3.68Å; W139-L143 HydrophobicContact CZ2-CD2 4.27Å; W139-L143 HydrophobicContact CZ3-CD2 3.85Å; W139-L143 WeakPolarHBondContact O-CB 3.45Å; W139-L143 PolarHBondContact O-N 2.84Å
140V98.7Very high95.7Very high63 Ų6332 Ų3238%0.38216%0.161SC..Hα-helixtrans-59.8-43.8174168.70000111.1V136 L137 L143 R144 F211V136-V140 HydrophobicContact CG1-CG2 4.4Å; V136-V140 WeakPolarHBondContact O-CG2 2.95Å; V136-V140 PolarHBondContact O-N 3.46Å; L137-V140 PolarHBondContact O-N 3.22Å; V140-L143 PolarHBondContact O-N 3.26Å; V140-R144 WeakPolarHBondContact O-CB 3.33Å; V140-R144 PolarHBondContact O-N 2.69Å; V140-F211 HydrophobicContact CG1-CE1 4.38Å
141H98.6Very high96.2Very high0 Ų038.4 Ų38.40%020%0.195CC..Hα-helixtrans-57-52.5173.3176.556.2000110.8L137 L138 W139 L143 R144 R145 F211 E260L137-H141 WeakPolarHBondContact O-CB 3.24Å; L137-H141 PolarHBondContact O-N 3.25Å; L138-H141 PolarHBondContact O-N 3.17Å; W139-H141 VanDerWaalsContact C-N 3.34Å; W139-H141 PolarHBondContact O-N 3.45Å; H141-L143 PolarHBondContact O-N 2.93Å; H141-R144 PolarHBondContact CE1-NH2 2.86Å; H141-R144 PolarHBondContact ND1-NH2 2.73Å; H141-R144 PolarHBondContact O-N 2.88Å; H141-R145 VanDerWaalsContact O-CG 3.24Å; H141-R145 WeakPolarHBondContact O-CG 3.47Å; H141-R145 PolarHBondContact O-N 3.23Å; H141-F211 HydrophobicContact CB-CE2 4.08Å; H141-F211 HydrophobicContact CB-CZ 3.98Å; H141-E260 IonicContact CE1-OE1 3.99Å; H141-E260 IonicContact CE1-OE2 3.58Å; H141-E260 PolarHBondContact CE1-OE2 3.35Å; H141-E260 IonicContact NE2-OE1 3.72Å; H141-E260 PolarHBondContact NE2-OE1 3.15Å; H141-E260 IonicContact NE2-OE2 2.7Å; H141-E260 PolarHBondContact NE2-OE2 3.41Å
142S98.3Very high96.6Very high0 Ų039.7 Ų39.70%020%0.202CC..Hα-helixtrans-60.8-42.2-179.1-59.90000112.8S83 L138 W139 R145 L146S83-S142 WeakPolarHBondContact OG-CB 3.38Å; S83-S142 PolarHBondContact OG-OG 3.33Å; L138-S142 WeakPolarHBondContact O-CB 3.46Å; L138-S142 PolarHBondContact O-N 3.33Å; L138-S142 PolarHBondContact O-OG 2.77Å; W139-S142 PolarHBondContact O-N 3.38Å; S142-R145 PolarHBondContact O-N 2.81Å; S142-L146 WeakPolarHBondContact O-CB 3.39Å; S142-L146 PolarHBondContact O-N 3.48Å
143L98.6Very high96.7Very high54 Ų5440.3 Ų40.328%0.28321%0.207SC..Hα-helixtrans-64.2-46.6176.9178.861.4000111.2V84 W139 V140 H141 R145 L146 L147V84-L143 HydrophobicContact CG2-CB 4.07Å; V84-L143 HydrophobicContact CG2-CD1 4.41Å; W139-L143 HydrophobicContact CH2-CD2 3.68Å; W139-L143 HydrophobicContact CZ2-CD2 4.27Å; W139-L143 HydrophobicContact CZ3-CD2 3.85Å; W139-L143 WeakPolarHBondContact O-CB 3.45Å; W139-L143 PolarHBondContact O-N 2.84Å; V140-L143 PolarHBondContact O-N 3.26Å; H141-L143 PolarHBondContact O-N 2.93Å; L143-R145 VanDerWaalsContact C-N 3.32Å; L143-R145 PolarHBondContact O-N 3.17Å; L143-L146 WeakPolarHBondContact O-CB 3.39Å; L143-L146 PolarHBondContact O-N 3.38Å; L143-L147 HydrophobicContact CD1-CD1 4.44Å; L143-L147 HydrophobicContact CD1-CG 4.36Å; L143-L147 HydrophobicContact CG-CD1 4.26Å; L143-L147 WeakPolarHBondContact O-CG 3.06Å; L143-L147 PolarHBondContact O-N 2.81Å
144R98.4Very high96.8Very high42 Ų4239 Ų3916%0.15820%0.201CC..Hα-helixtrans-57.3-46.7175.2177.5-176.762.397.4-2.7110.9V140 H141 L146 L147 E148 S215 I263V140-R144 WeakPolarHBondContact O-CB 3.33Å; V140-R144 PolarHBondContact O-N 2.69Å; H141-R144 PolarHBondContact CE1-NH2 2.86Å; H141-R144 PolarHBondContact ND1-NH2 2.73Å; H141-R144 PolarHBondContact O-N 2.88Å; R144-L146 VanDerWaalsContact C-N 3.34Å; R144-L146 PolarHBondContact O-N 2.91Å; R144-L147 PolarHBondContact O-N 3.13Å; R144-E148 HydrophobicContact CG-CG 4.37Å; R144-E148 WeakPolarHBondContact CG-OE1 3.49Å; R144-E148 IonicContact CZ-OE1 3.7Å; R144-E148 IonicContact NH1-OE1 3.11Å; R144-E148 PolarHBondContact NH1-OE1 3.4Å; R144-E148 IonicContact NH1-OE2 3.51Å; R144-E148 WeakPolarHBondContact O-CB 3.34Å; R144-E148 VanDerWaalsContact O-CG 3.27Å; R144-E148 WeakPolarHBondContact O-CG 3.39Å; R144-E148 PolarHBondContact O-N 3.15Å; R144-S215 PolarHBondContact NH1-O 2.91Å; R144-I263 VanDerWaalsContact NH2-CD1 3.35Å
145R98.1Very high96.5Very high25 Ų2541.5 Ų41.59%0.09421%0.212CC..Hα-helixtrans-63.3-38.7178.8-66-65.1-62.7125.63.2112.2Y80 H141 S142 L143 E148 C149Y80-R145 HydrophobicContact CD1-CB 3.35Å; Y80-R145 HydrophobicContact CD1-CG 4.16Å; Y80-R145 HydrophobicContact CD2-CB 4.09Å; Y80-R145 HydrophobicContact CE1-CB 3.29Å; Y80-R145 HydrophobicContact CE1-CG 3.7Å; Y80-R145 HydrophobicContact CE2-CB 4.05Å; Y80-R145 HydrophobicContact CG-CB 3.76Å; Y80-R145 PolarHBondContact OH-NE 3.49Å; Y80-R145 PolarHBondContact OH-NH2 3.22Å; H141-R145 VanDerWaalsContact O-CG 3.24Å; H141-R145 WeakPolarHBondContact O-CG 3.47Å; H141-R145 PolarHBondContact O-N 3.23Å; S142-R145 PolarHBondContact O-N 2.81Å; L143-R145 VanDerWaalsContact C-N 3.32Å; L143-R145 PolarHBondContact O-N 3.17Å; R145-E148 WeakPolarHBondContact CD-OE2 3.46Å; R145-E148 IonicContact CZ-OE2 2.77Å; R145-E148 IonicContact NE-OE2 2.79Å; R145-E148 IonicContact NH1-OE2 3.82Å; R145-E148 PolarHBondContact NH1-OE2 3.1Å; R145-E148 PolarHBondContact O-N 3.11Å; R145-C149 PolarHBondContact O-N 3.29Å; R145-C149 PolarHBondContact O-SG 3.31Å; R145-C149 VanDerWaalsContact O-SG 3.37Å
146L98.3Very high96.2Very high26 Ų2642.6 Ų42.614%0.13622%0.22CC..Hα-helixtrans-60.9-49.2173.4-179.459.2000111.3W77 A81 V84 S142 L143 R144 E148 C149 H150W77-L146 HydrophobicContact CB-CD1 4.14Å; W77-L146 HydrophobicContact CE3-CD1 4.19Å; A81-L146 HydrophobicContact CB-CD1 4.17Å; V84-L146 HydrophobicContact CG2-CD2 4.12Å; S142-L146 WeakPolarHBondContact O-CB 3.39Å; S142-L146 PolarHBondContact O-N 3.48Å; L143-L146 WeakPolarHBondContact O-CB 3.39Å; L143-L146 PolarHBondContact O-N 3.38Å; R144-L146 VanDerWaalsContact C-N 3.34Å; R144-L146 PolarHBondContact O-N 2.91Å; L146-E148 VanDerWaalsContact C-N 3.34Å; L146-E148 PolarHBondContact O-N 3.4Å; L146-C149 WeakPolarHBondContact O-CB 3.31Å; L146-C149 PolarHBondContact O-N 2.95Å; L146-C149 VanDerWaalsContact O-N 3.11Å; L146-H150 PolarHBondContact O-CD2 2.96Å; L146-H150 VanDerWaalsContact O-CD2 3.31Å; L146-H150 PolarHBondContact O-N 2.88Å
147L98.3Very high95.7Very high88 Ų8845.6 Ų45.646%0.46123%0.234SC..Hα-helixtrans-61.7-41.9177.2-66.7174.3000111.5L143 R144 C149 H150 L151L143-L147 HydrophobicContact CD1-CD1 4.44Å; L143-L147 HydrophobicContact CD1-CG 4.36Å; L143-L147 HydrophobicContact CG-CD1 4.26Å; L143-L147 WeakPolarHBondContact O-CG 3.06Å; L143-L147 PolarHBondContact O-N 2.81Å; R144-L147 PolarHBondContact O-N 3.13Å; L147-C149 VanDerWaalsContact C-N 3.27Å; L147-C149 PolarHBondContact O-N 3.25Å; L147-H150 PolarHBondContact O-N 3.27Å; L147-H150 VanDerWaalsContact O-N 3.15Å; L147-L151 HydrophobicContact CB-CD1 4.38Å; L147-L151 HydrophobicContact CD2-CD1 4.4Å; L147-L151 VanDerWaalsContact O-CB 3.28Å; L147-L151 WeakPolarHBondContact O-CB 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.45Å; L147-L151 PolarHBondContact O-N 3.07Å
148E97.7Very high95.4Very high4 Ų445.1 Ų45.12%0.01923%0.234CC..Hα-helixtrans-63-32174.5-73.3168174.600112.4R144 R145 L146 V152 S153 H219 L222R144-E148 HydrophobicContact CG-CG 4.37Å; R144-E148 WeakPolarHBondContact CG-OE1 3.49Å; R144-E148 IonicContact CZ-OE1 3.7Å; R144-E148 IonicContact NH1-OE1 3.11Å; R144-E148 PolarHBondContact NH1-OE1 3.4Å; R144-E148 IonicContact NH1-OE2 3.51Å; R144-E148 WeakPolarHBondContact O-CB 3.34Å; R144-E148 VanDerWaalsContact O-CG 3.27Å; R144-E148 WeakPolarHBondContact O-CG 3.39Å; R144-E148 PolarHBondContact O-N 3.15Å; R145-E148 WeakPolarHBondContact CD-OE2 3.46Å; R145-E148 IonicContact CZ-OE2 2.77Å; R145-E148 IonicContact NE-OE2 2.79Å; R145-E148 IonicContact NH1-OE2 3.82Å; R145-E148 PolarHBondContact NH1-OE2 3.1Å; R145-E148 PolarHBondContact O-N 3.11Å; L146-E148 VanDerWaalsContact C-N 3.34Å; L146-E148 PolarHBondContact O-N 3.4Å; E148-V152 HydrophobicContact CG-CG2 4.46Å; E148-V152 CarbonylContact O-C 3.57Å; E148-V152 WeakPolarHBondContact O-CA 3.32Å; E148-V152 WeakPolarHBondContact O-CB 3.4Å; E148-V152 PolarHBondContact O-N 3.15Å; E148-V152 VanDerWaalsContact O-N 3.13Å; E148-S153 WeakPolarHBondContact O-CB 3.38Å; E148-S153 PolarHBondContact O-N 3.41Å; E148-S153 PolarHBondContact O-OG 3.19Å; E148-H219 WeakPolarHBondContact OE1-CB 3.48Å; E148-H219 IonicContact OE1-CE1 3.95Å; E148-H219 IonicContact OE1-CG 3.45Å; E148-H219 IonicContact OE1-ND1 2.78Å; E148-H219 PolarHBondContact OE1-ND1 2.7Å; E148-L222 WeakPolarHBondContact OE2-CD1 3.45Å
149C96.6Very high95.2Very high8 Ų846.7 Ų46.75%0.05424%0.244CC..Hα-helixtrans-66.1-39.5172.6-74.70000112.4W77 R145 L146 L147 F155W77-C149 HydrophobicContact CB-CB 3.75Å; R145-C149 PolarHBondContact O-N 3.29Å; R145-C149 PolarHBondContact O-SG 3.31Å; R145-C149 VanDerWaalsContact O-SG 3.37Å; L146-C149 WeakPolarHBondContact O-CB 3.31Å; L146-C149 PolarHBondContact O-N 2.95Å; L146-C149 VanDerWaalsContact O-N 3.11Å; L147-C149 VanDerWaalsContact C-N 3.27Å; L147-C149 PolarHBondContact O-N 3.25Å; C149-F155 HydrophobicContact CB-CZ 4.29Å; C149-F155 WeakPolarHBondContact O-CE2 3.37Å
150H95.4Very high95Very high111 Ų11143.2 Ų43.251%0.51423%0.231SC..Hα-helixtrans-83.6-37-178.5-73.9-69.9000113.9W77 L146 L147W77-H150 AromaticContact CD2-CE1 3.92Å; W77-H150 AromaticContact CD2-NE2 3.85Å; W77-H150 AromaticContact CE3-NE2 3.79Å; W77-H150 AromaticContact CG-CE1 3.98Å; W77-H150 AromaticContact CG-NE2 3.94Å; L146-H150 PolarHBondContact O-CD2 2.96Å; L146-H150 VanDerWaalsContact O-CD2 3.31Å; L146-H150 PolarHBondContact O-N 2.88Å; L147-H150 PolarHBondContact O-N 3.27Å; L147-H150 VanDerWaalsContact O-N 3.15Å
151L95.1Very high94.8Very high140 Ų14041.1 Ų41.173%0.73322%0.217SC*.Hα-helixtrans-104.9-22.8-167.4-56178.4000113.6L147L147-L151 HydrophobicContact CB-CD1 4.38Å; L147-L151 HydrophobicContact CD2-CD1 4.4Å; L147-L151 VanDerWaalsContact O-CB 3.28Å; L147-L151 WeakPolarHBondContact O-CB 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.45Å; L147-L151 PolarHBondContact O-N 3.07Å
152V94.6Very high94.6Very high32 Ų3244 Ų4419%0.19423%0.232CC..THydrogen-bonded Turntrans-118.2-41-173.5-178.30000111.9E148 V154 V223 A226E148-V152 HydrophobicContact CG-CG2 4.46Å; E148-V152 CarbonylContact O-C 3.57Å; E148-V152 WeakPolarHBondContact O-CA 3.32Å; E148-V152 WeakPolarHBondContact O-CB 3.4Å; E148-V152 PolarHBondContact O-N 3.15Å; E148-V152 VanDerWaalsContact O-N 3.13Å; V152-V154 PolarHBondContact O-N 3.22Å; V152-V223 HydrophobicContact CG1-CB 4.5Å; V152-V223 HydrophobicContact CG1-CG2 3.85Å; V152-A226 HydrophobicContact CG1-CB 4Å; V152-A226 WeakPolarHBondContact O-CB 3.12Å
153S93.1Very high94.4Very high35 Ų3547.9 Ų47.925%0.24526%0.255CS..  trans-76120-167.5-60.90000112.2E148E148-S153 WeakPolarHBondContact O-CB 3.38Å; E148-S153 PolarHBondContact O-N 3.41Å; E148-S153 PolarHBondContact O-OG 3.19Å
154V92.3Very high94.2Very high27 Ų2746.7 Ų46.716%0.16425%0.248CC..  trans-91.5107168.8-176.80000109.1V152 R229 T230 V236 L239V152-V154 PolarHBondContact O-N 3.22Å; V154-R229 HydrophobicContact CB-CB 4.12Å; V154-R229 HydrophobicContact CG1-CB 3.96Å; V154-R229 HydrophobicContact CG2-CB 4.33Å; V154-R229 PolarHBondContact O-NH1 3.13Å; V154-T230 HydrophobicContact CG2-CG2 3.77Å; V154-V236 HydrophobicContact CG1-CG1 3.88Å; V154-V236 HydrophobicContact CG1-CG2 3.79Å; V154-V236 HydrophobicContact CG2-CG2 4.03Å; V154-L239 HydrophobicContact CG1-CD2 3.98Å
155F88.6Confident94.1Very high54 Ų5446.1 Ų46.124%0.23725%0.247CC..  trans-85.7139178-63-81.7000111.6R74 F76 C149R74-F155 HydrophobicContact CB-CB 3.85Å; R74-F155 HydrophobicContact CB-CD2 4.45Å; R74-F155 HydrophobicContact CB-CG 4.04Å; F76-F155 HydrophobicContact CB-CE1 4.2Å; F76-F155 HydrophobicContact CB-CZ 4.47Å; C149-F155 HydrophobicContact CB-CZ 4.29Å; C149-F155 WeakPolarHBondContact O-CE2 3.37Å
156S87.7Confident94Very high26 Ų2649.7 Ų49.718%0.18227%0.266CS..  trans-104.3-176.9168.359.60000109.7G158 R229S156-G158 PolarHBondContact O-N 3.12Å; S156-R229 PolarHBondContact OG-NH2 3.35Å
157D87.9Confident93.9Very high120 Ų12051.6 Ų51.664%0.64227%0.274SS*.SBendtrans-7431.3178.4-54.8-51.6000114.4R74R74-D157 IonicContact CZ-OD1 3.81Å; R74-D157 IonicContact NH2-OD1 2.9Å; R74-D157 PolarHBondContact NH2-OD1 3.4Å
158G90.1Very high93.8Very high11 Ų1148 Ų4811%0.11326%0.257CS..  trans-66.9153.7171.900000111.2K73 S156K73-G158 WeakPolarHBondContact CB-O 3.16Å; K73-G158 PolarHBondContact N-O 2.54Å; S156-G158 PolarHBondContact O-N 3.12Å
159V94.1Very high93.7Very high33 Ų3349.5 Ų49.520%0.227%0.266CS..EExtended strand (participates in β ladder)trans-126.7153.5-176.2-640000112.2G54 K57 D70 I71G54-V159 PolarHBondContact N-O 3.19Å; K57-V159 HydrophobicContact CD-CG2 3.87Å; D70-V159 HydrophobicContact CB-CB 3.82Å; D70-V159 HydrophobicContact CB-CG1 4.07Å; D70-V159 HydrophobicContact CB-CG2 4.08Å; D70-V159 VanDerWaalsContact CG-CG2 3.5Å; D70-V159 WeakPolarHBondContact OD2-CG2 3.5Å; I71-V159 CarbonylContact O-C 3.54Å; I71-V159 VanDerWaalsContact O-CA 3.29Å; I71-V159 WeakPolarHBondContact O-CA 3.35Å
160I94.3Very high93.8Very high9 Ų951.6 Ų51.65%0.04628%0.284CS..EExtended strand (participates in β ladder)trans-123.4144.2173.4-175.3174000108.3I71 F76 F79 Q164 Y165I71-I160 HydrophobicContact CB-CG2 4.01Å; I71-I160 HydrophobicContact CG2-CG2 4.33Å; I71-I160 PolarHBondContact N-O 2.95Å; I71-I160 PolarHBondContact O-N 3.23Å; F76-I160 HydrophobicContact CE1-CB 4.23Å; F76-I160 HydrophobicContact CE1-CD1 3.55Å; F76-I160 HydrophobicContact CE1-CG1 4.39Å; F76-I160 HydrophobicContact CE1-CG2 4.27Å; F76-I160 HydrophobicContact CZ-CD1 4.11Å; F79-I160 HydrophobicContact CE2-CD1 4.47Å; F79-I160 HydrophobicContact CZ-CD1 4.21Å; I160-Q164 HydrophobicContact CD1-CB 3.7Å; I160-Q164 HydrophobicContact CG1-CB 3.66Å; I160-Q164 HydrophobicContact CG1-CG 4.49Å; I160-Y165 HydrophobicContact CG2-CD2 4.39Å
161H94.3Very high93.9Very high19 Ų1947.3 Ų47.39%0.08826%0.263CS..EExtended strand (participates in β ladder)trans-71.8146.2177-169.7-95.4000111.2D49 V163 Q164 Y165D49-H161 IonicContact OD2-CD2 3.94Å; H161-V163 VanDerWaalsContact C-N 3.26Å; H161-V163 WeakPolarHBondContact ND1-CB 3.47Å; H161-V163 PolarHBondContact ND1-N 3.38Å; H161-V163 PolarHBondContact O-N 3.49Å; H161-Q164 HydrophobicContact CB-CG 4.18Å; H161-Q164 WeakPolarHBondContact O-CB 3.5Å; H161-Q164 PolarHBondContact O-N 2.86Å; H161-Y165 PolarHBondContact O-N 2.93Å
162I94.8Very high94Very high61 Ų6141.3 Ų41.331%0.31323%0.231SC..Hα-helixtrans-54.8-38.9-179-170162.7000113.5F69 I71 Q164 Y165 I166F69-I162 HydrophobicContact CB-CB 4.43Å; F69-I162 HydrophobicContact CB-CG2 3.8Å; F69-I162 HydrophobicContact CD1-CG2 3.98Å; F69-I162 HydrophobicContact CG-CG2 4.21Å; F69-I162 PolarHBondContact O-N 2.98Å; I71-I162 HydrophobicContact CD1-CB 4.02Å; I71-I162 HydrophobicContact CD1-CD1 4.41Å; I71-I162 HydrophobicContact CD1-CG1 3.86Å; I71-I162 HydrophobicContact CG1-CB 4.48Å; I162-Q164 PolarHBondContact O-N 3Å; I162-Y165 WeakPolarHBondContact O-CB 3.4Å; I162-Y165 PolarHBondContact O-N 3.42Å; I162-I166 HydrophobicContact CG1-CD1 3.94Å; I162-I166 HydrophobicContact CG1-CG1 4.3Å; I162-I166 WeakPolarHBondContact O-CG1 3.48Å; I162-I166 PolarHBondContact O-N 3.2Å
163V93.6Very high94.1Very high80 Ų8042.4 Ų42.449%0.48524%0.235SC..Hα-helixtrans-62.6-44.6177.6175.10000110.9L50 H161 Y165 F167L50-V163 HydrophobicContact CD1-CB 4.24Å; L50-V163 HydrophobicContact CD1-CG1 4.28Å; H161-V163 VanDerWaalsContact C-N 3.26Å; H161-V163 WeakPolarHBondContact ND1-CB 3.47Å; H161-V163 PolarHBondContact ND1-N 3.38Å; H161-V163 PolarHBondContact O-N 3.49Å; V163-Y165 VanDerWaalsContact C-N 3.28Å; V163-Y165 PolarHBondContact O-N 2.89Å; V163-F167 WeakPolarHBondContact O-CB 3.19Å; V163-F167 PolarHBondContact O-N 3.4Å
164Q94.6Very high94.3Very high30 Ų3042 Ų4214%0.1423%0.23CC..Hα-helixtrans-65.3-36.3176.4-61.4167.6-3600110.9L50 R52 I160 H161 I162 G168L50-Q164 PolarHBondContact O-NE2 3.04Å; R52-Q164 PolarHBondContact O-NE2 2.88Å; I160-Q164 HydrophobicContact CD1-CB 3.7Å; I160-Q164 HydrophobicContact CG1-CB 3.66Å; I160-Q164 HydrophobicContact CG1-CG 4.49Å; H161-Q164 HydrophobicContact CB-CG 4.18Å; H161-Q164 WeakPolarHBondContact O-CB 3.5Å; H161-Q164 PolarHBondContact O-N 2.86Å; I162-Q164 PolarHBondContact O-N 3Å; Q164-G168 PolarHBondContact O-N 3.34Å
165Y96.2Very high94.5Very high30 Ų3040.8 Ų40.812%0.11822%0.223CC..Hα-helixtrans-66.4-50.3178.1179.3-94.8000112.1I71 W75 H78 F79 I160 H161 I162 V163 F167 G168 L169I71-Y165 HydrophobicContact CD1-CD1 3.61Å; I71-Y165 HydrophobicContact CD1-CD2 4.41Å; I71-Y165 HydrophobicContact CD1-CE1 4.28Å; I71-Y165 HydrophobicContact CD1-CG 3.7Å; I71-Y165 HydrophobicContact CG2-CD2 4.11Å; I71-Y165 HydrophobicContact CG2-CE2 4.37Å; I71-Y165 HydrophobicContact CG2-CG 4.41Å; W75-Y165 HydrophobicContact CB-CE2 4.21Å; H78-Y165 AromaticContact ND1-CZ 3.81Å; H78-Y165 PolarHBondContact ND1-OH 2.75Å; F79-Y165 HydrophobicContact CD1-CE2 4.47Å; F79-Y165 AromaticContact CE1-CD2 3.41Å; F79-Y165 HydrophobicContact CE1-CD2 3.41Å; F79-Y165 VanDerWaalsContact CE1-CD2 3.41Å; F79-Y165 AromaticContact CE1-CE2 3.6Å; F79-Y165 HydrophobicContact CE1-CE2 3.6Å; F79-Y165 HydrophobicContact CE1-CG 4.02Å; F79-Y165 VanDerWaalsContact CE1-O 3.25Å; F79-Y165 WeakPolarHBondContact CE1-O 3.37Å; F79-Y165 AromaticContact CZ-CD2 3.46Å; F79-Y165 HydrophobicContact CZ-CD2 3.46Å; F79-Y165 VanDerWaalsContact CZ-CD2 3.46Å; F79-Y165 AromaticContact CZ-CE2 3.98Å; F79-Y165 HydrophobicContact CZ-CE2 3.98Å; F79-Y165 HydrophobicContact CZ-CG 4.21Å; I160-Y165 HydrophobicContact CG2-CD2 4.39Å; H161-Y165 PolarHBondContact O-N 2.93Å; I162-Y165 WeakPolarHBondContact O-CB 3.4Å; I162-Y165 PolarHBondContact O-N 3.42Å; V163-Y165 VanDerWaalsContact C-N 3.28Å; V163-Y165 PolarHBondContact O-N 2.89Å; Y165-F167 VanDerWaalsContact C-N 3.3Å; Y165-F167 PolarHBondContact O-N 3.25Å; Y165-G168 PolarHBondContact O-N 2.95Å; Y165-G168 VanDerWaalsContact O-N 3.13Å; Y165-L169 HydrophobicContact CD1-CD1 4.07Å; Y165-L169 HydrophobicContact CE1-CD1 3.55Å; Y165-L169 HydrophobicContact CE1-CG 4.23Å; Y165-L169 WeakPolarHBondContact O-CG 3.42Å; Y165-L169 PolarHBondContact O-N 3.31Å; Y165-L169 VanDerWaalsContact O-N 3.09Å
166I96.6Very high94.8Very high100 Ų10038.2 Ų38.251%0.51321%0.212SC..Hα-helixtrans-59.9-44.1175.7-67.1170.7000110.3I162 G168 L169 A170I162-I166 HydrophobicContact CG1-CD1 3.94Å; I162-I166 HydrophobicContact CG1-CG1 4.3Å; I162-I166 WeakPolarHBondContact O-CG1 3.48Å; I162-I166 PolarHBondContact O-N 3.2Å; I166-G168 VanDerWaalsContact C-N 3.31Å; I166-G168 PolarHBondContact O-N 2.81Å; I166-L169 PolarHBondContact O-N 2.96Å; I166-A170 PolarHBondContact O-N 3.4Å
167F95.8Very high95.2Very high65 Ų6537.7 Ų37.729%0.28521%0.207SC..Hα-helixtrans-57.5-43.3175.2175.5-94000111.9L17 F21 V163 Y165 L169 A170 Y171 Y284L17-F167 HydrophobicContact CD1-CE2 4.11Å; L17-F167 HydrophobicContact CD1-CZ 4.3Å; L17-F167 HydrophobicContact CD2-CE2 3.68Å; L17-F167 HydrophobicContact CD2-CZ 4.21Å; F21-F167 HydrophobicContact CE2-CZ 4.38Å; V163-F167 WeakPolarHBondContact O-CB 3.19Å; V163-F167 PolarHBondContact O-N 3.4Å; Y165-F167 VanDerWaalsContact C-N 3.3Å; Y165-F167 PolarHBondContact O-N 3.25Å; F167-L169 PolarHBondContact O-N 2.82Å; F167-A170 PolarHBondContact O-N 2.96Å; F167-Y171 VanDerWaalsContact O-CB 3.25Å; F167-Y171 WeakPolarHBondContact O-CB 3.22Å; F167-Y171 PolarHBondContact O-N 3.32Å; F167-Y284 WeakPolarHBondContact CE1-OH 3.3Å; F167-Y284 HydrophobicContact CZ-CE2 4.01Å; F167-Y284 AromaticContact CZ-CZ 3.86Å; F167-Y284 WeakPolarHBondContact CZ-OH 3.28Å
168G95.7Very high95.4Very high12 Ų1232 Ų3212%0.12418%0.176CC..Hα-helixtrans-62.3-36.7176.300000114Q164 Y165 I166 Y172Q164-G168 PolarHBondContact O-N 3.34Å; Y165-G168 PolarHBondContact O-N 2.95Å; Y165-G168 VanDerWaalsContact O-N 3.13Å; I166-G168 VanDerWaalsContact C-N 3.31Å; I166-G168 PolarHBondContact O-N 2.81Å; G168-Y172 WeakPolarHBondContact O-CD2 3.09Å
169L97.2Very high95.5Very high36 Ų3631.6 Ų31.619%0.18817%0.172CC..Hα-helixtrans-68.3-48.5174.2-59.3171.3000111H78 F79 I82 Y165 I166 F167 Y171 Y172H78-L169 HydrophobicContact CB-CD2 4.24Å; F79-L169 HydrophobicContact CD1-CD2 3.5Å; F79-L169 VanDerWaalsContact CD1-CD2 3.5Å; F79-L169 HydrophobicContact CD1-CG 3.95Å; F79-L169 HydrophobicContact CE1-CD2 3.94Å; F79-L169 HydrophobicContact CE1-CG 4.03Å; I82-L169 HydrophobicContact CD1-CB 4.19Å; I82-L169 HydrophobicContact CD1-CD1 4.48Å; I82-L169 HydrophobicContact CD1-CD2 3.4Å; I82-L169 VanDerWaalsContact CD1-CD2 3.4Å; I82-L169 HydrophobicContact CD1-CG 4.2Å; I82-L169 HydrophobicContact CG1-CD2 4.34Å; Y165-L169 HydrophobicContact CD1-CD1 4.07Å; Y165-L169 HydrophobicContact CE1-CD1 3.55Å; Y165-L169 HydrophobicContact CE1-CG 4.23Å; Y165-L169 WeakPolarHBondContact O-CG 3.42Å; Y165-L169 PolarHBondContact O-N 3.31Å; Y165-L169 VanDerWaalsContact O-N 3.09Å; I166-L169 PolarHBondContact O-N 2.96Å; F167-L169 PolarHBondContact O-N 2.82Å; L169-Y171 VanDerWaalsContact C-N 3.28Å; L169-Y171 PolarHBondContact O-N 3.32Å; L169-Y172 PolarHBondContact O-N 2.9Å
170A97.6Very high95.3Very high53 Ų5330.4 Ų30.444%0.43816%0.164SC..Hα-helixtrans-62.9-35.5179.800000112.3I166 F167 Y172 I173 L174I166-A170 PolarHBondContact O-N 3.4Å; F167-A170 PolarHBondContact O-N 2.96Å; A170-Y172 PolarHBondContact O-N 3.41Å; A170-I173 PolarHBondContact O-N 3.27Å; A170-L174 WeakPolarHBondContact O-CB 3.31Å; A170-L174 PolarHBondContact O-N 3.32Å
171Y97.3Very high94.9Very high21 Ų2130 Ų308%0.08216%0.162CC..Hα-helixtrans-54.5-46.6178.3172.8-99.9000112.6W14 F167 L169 I173 L174 L175 Y264 Y284W14-Y171 AromaticContact CH2-CD2 3.68Å; W14-Y171 HydrophobicContact CH2-CD2 3.68Å; W14-Y171 AromaticContact CH2-CE2 3.43Å; W14-Y171 HydrophobicContact CH2-CE2 3.43Å; W14-Y171 VanDerWaalsContact CH2-CE2 3.43Å; W14-Y171 AromaticContact CZ3-CD2 3.99Å; W14-Y171 HydrophobicContact CZ3-CD2 3.99Å; W14-Y171 AromaticContact CZ3-CE2 3.66Å; W14-Y171 HydrophobicContact CZ3-CE2 3.66Å; F167-Y171 VanDerWaalsContact O-CB 3.25Å; F167-Y171 WeakPolarHBondContact O-CB 3.22Å; F167-Y171 PolarHBondContact O-N 3.32Å; L169-Y171 VanDerWaalsContact C-N 3.28Å; L169-Y171 PolarHBondContact O-N 3.32Å; Y171-I173 PolarHBondContact O-N 2.88Å; Y171-L174 PolarHBondContact O-N 3.18Å; Y171-L175 HydrophobicContact CE1-CD2 4.06Å; Y171-L175 WeakPolarHBondContact O-CB 3.46Å; Y171-L175 PolarHBondContact O-N 3.49Å; Y171-Y264 WeakPolarHBondContact OH-CE1 3.32Å; Y171-Y264 PolarHBondContact OH-OH 2.96Å; Y171-Y284 AromaticContact CD2-CE1 3.94Å; Y171-Y284 HydrophobicContact CD2-CE1 3.94Å; Y171-Y284 AromaticContact CE2-CD1 3.95Å; Y171-Y284 HydrophobicContact CE2-CD1 3.95Å; Y171-Y284 AromaticContact CE2-CE1 3.35Å; Y171-Y284 HydrophobicContact CE2-CE1 3.35Å
172Y97Very high94.1Very high13 Ų1329.4 Ų29.45%0.05116%0.16CC..Hα-helixtrans-73.5-26.5-178.3-77.7-67.7000113.7F79 Y80 S83 N87 G168 L169 A170 L175F79-Y172 HydrophobicContact CB-CD2 3.8Å; F79-Y172 HydrophobicContact CB-CE2 3.62Å; F79-Y172 WeakPolarHBondContact O-CD2 3.37Å; Y80-Y172 HydrophobicContact CD1-CE2 4.36Å; Y80-Y172 AromaticContact CD1-CZ 3.96Å; Y80-Y172 HydrophobicContact CE1-CE2 4.31Å; Y80-Y172 AromaticContact CE1-CZ 3.75Å; Y80-Y172 WeakPolarHBondContact CE1-OH 3.3Å; S83-Y172 VanDerWaalsContact CB-CD1 3.43Å; S83-Y172 WeakPolarHBondContact OG-CD1 3.22Å; N87-Y172 PolarHBondContact ND2-O 3.17Å; G168-Y172 WeakPolarHBondContact O-CD2 3.09Å; L169-Y172 PolarHBondContact O-N 2.9Å; A170-Y172 PolarHBondContact O-N 3.41Å; Y172-L175 HydrophobicContact CD1-CD2 4.47Å
173I97.7Very high92.8Very high55 Ų5527 Ų2728%0.28215%0.148SC..Hα-helixtrans-67.1-52.2169.7-59.8-57.4000110I82 W86 A170 Y171 L175 G176 L177I82-I173 HydrophobicContact CG2-CD1 3.6Å; I82-I173 HydrophobicContact CG2-CG1 4.19Å; W86-I173 HydrophobicContact CB-CD1 3.61Å; W86-I173 HydrophobicContact CD2-CD1 3.7Å; W86-I173 HydrophobicContact CD2-CG2 4.43Å; W86-I173 HydrophobicContact CE3-CD1 4.28Å; W86-I173 HydrophobicContact CG-CD1 3.38Å; W86-I173 HydrophobicContact CZ2-CG2 4.04Å; W86-I173 PolarHBondContact NE1-O 3.38Å; A170-I173 PolarHBondContact O-N 3.27Å; Y171-I173 PolarHBondContact O-N 2.88Å; I173-L175 VanDerWaalsContact C-N 3.3Å; I173-L175 PolarHBondContact O-N 3.14Å; I173-G176 PolarHBondContact O-N 3.47Å; I173-L177 HydrophobicContact CG2-CD1 4.33Å; I173-L177 PolarHBondContact O-N 2.96Å
174L97.3Very high91Very high28 Ų2824.7 Ų24.715%0.14714%0.135CC..Hα-helixtrans-60.9-38.3-179.2-178.767.5000112.1I10 L13 W14 A170 Y171 G176 L177 T178I10-L174 HydrophobicContact CD1-CD1 3.54Å; I10-L174 HydrophobicContact CD1-CG 4.32Å; L13-L174 HydrophobicContact CD1-CD1 4.2Å; L13-L174 HydrophobicContact CD1-CD2 4.23Å; L13-L174 HydrophobicContact CD2-CD2 3.4Å; L13-L174 HydrophobicContact CG-CD2 4.48Å; W14-L174 HydrophobicContact CH2-CD2 3.83Å; W14-L174 HydrophobicContact CH2-CG 4.32Å; W14-L174 HydrophobicContact CZ2-CB 4.46Å; W14-L174 HydrophobicContact CZ2-CD2 3.55Å; W14-L174 HydrophobicContact CZ2-CG 3.68Å; W14-L174 HydrophobicContact CZ3-CD2 4.46Å; A170-L174 WeakPolarHBondContact O-CB 3.31Å; A170-L174 PolarHBondContact O-N 3.32Å; Y171-L174 PolarHBondContact O-N 3.18Å; L174-G176 VanDerWaalsContact C-N 3.34Å; L174-G176 PolarHBondContact O-N 3.35Å; L174-L177 PolarHBondContact O-N 3.49Å; L174-T178 WeakPolarHBondContact O-CB 3.43Å; L174-T178 PolarHBondContact O-N 3.22Å; L174-T178 PolarHBondContact O-OG1 2.93Å
175L96.2Very high89Confident0 Ų027.5 Ų27.50%015%0.151CC..Hα-helixtrans-62-42.5179.3-169.461.1000111.6W14 L138 Y171 Y172 I173 T178 V179 Y264 W278 V281W14-L175 HydrophobicContact CZ2-CD1 4.45Å; L138-L175 HydrophobicContact CD1-CD2 3.45Å; L138-L175 VanDerWaalsContact CD1-CD2 3.45Å; L138-L175 HydrophobicContact CD1-CG 4.15Å; L138-L175 HydrophobicContact CD2-CD2 4Å; L138-L175 HydrophobicContact CD2-CG 3.8Å; L138-L175 HydrophobicContact CG-CD2 4.36Å; Y171-L175 HydrophobicContact CE1-CD2 4.06Å; Y171-L175 WeakPolarHBondContact O-CB 3.46Å; Y171-L175 PolarHBondContact O-N 3.49Å; Y172-L175 HydrophobicContact CD1-CD2 4.47Å; I173-L175 VanDerWaalsContact C-N 3.3Å; I173-L175 PolarHBondContact O-N 3.14Å; L175-T178 WeakPolarHBondContact O-CB 3.4Å; L175-T178 PolarHBondContact O-N 3.38Å; L175-V179 WeakPolarHBondContact O-CG2 3.44Å; L175-V179 PolarHBondContact O-N 3.19Å; L175-V179 VanDerWaalsContact O-N 3.17Å; L175-Y264 HydrophobicContact CD1-CE1 3.94Å; L175-Y264 HydrophobicContact CD2-CE1 3.81Å; L175-Y264 VanDerWaalsContact CD2-OH 3.3Å; L175-Y264 WeakPolarHBondContact CD2-OH 3.09Å; L175-W278 HydrophobicContact CD1-CH2 3.69Å; L175-W278 HydrophobicContact CD1-CZ3 3.89Å; L175-W278 HydrophobicContact CG-CH2 4.34Å; L175-V281 HydrophobicContact CD1-CG1 3.74Å; L175-V281 HydrophobicContact CD1-CG2 4.5Å
176G95.4Very high86.8Confident1 Ų129.1 Ų29.11%0.0116%0.161CC..Hα-helixtrans-63-43.3174.700000113.3N87 I173 L174 T178 V179N87-G176 WeakPolarHBondContact OD1-CA 3.32Å; N87-G176 PolarHBondContact OD1-N 2.79Å; I173-G176 PolarHBondContact O-N 3.47Å; L174-G176 VanDerWaalsContact C-N 3.34Å; L174-G176 PolarHBondContact O-N 3.35Å; G176-T178 VanDerWaalsContact C-N 3.3Å; G176-T178 PolarHBondContact O-N 3.46Å; G176-V179 PolarHBondContact O-N 2.99Å
177L94.7Very high84.4Confident14 Ų1427.6 Ų27.67%0.07315%0.153CC..Hα-helixtrans-62.6-38.9173.8-66.9173.4000111.5W86 L108 I111 L112 L115 I173 L174 V179 L180 C181W86-L177 HydrophobicContact CZ2-CD2 3.84Å; W86-L177 HydrophobicContact CZ2-CG 4.03Å; L108-L177 HydrophobicContact CD1-CD2 3.73Å; I111-L177 HydrophobicContact CG2-CD1 3.89Å; I111-L177 HydrophobicContact CG2-CD2 4.09Å; L112-L177 HydrophobicContact CD2-CD2 4.12Å; L115-L177 HydrophobicContact CD1-CB 4.08Å; L115-L177 HydrophobicContact CD1-CD1 4.12Å; I173-L177 HydrophobicContact CG2-CD1 4.33Å; I173-L177 PolarHBondContact O-N 2.96Å; L174-L177 PolarHBondContact O-N 3.49Å; L177-V179 VanDerWaalsContact C-N 3.31Å; L177-V179 PolarHBondContact O-N 3.36Å; L177-L180 PolarHBondContact O-N 2.95Å; L177-L180 VanDerWaalsContact O-N 3.15Å; L177-C181 PolarHBondContact O-N 3.29Å; L177-C181 PolarHBondContact O-SG 2.76Å
178T93.8Very high81.6Confident0 Ų034.2 Ų34.20%019%0.185CC..Hα-helixtrans-61.9-38.3179.7-57.80000112I10 W14 L174 L175 G176 L180 C181 S182 T277 W278 V281I10-T178 HydrophobicContact CG1-CG2 4.37Å; W14-T178 PolarHBondContact NE1-OG1 3.37Å; L174-T178 WeakPolarHBondContact O-CB 3.43Å; L174-T178 PolarHBondContact O-N 3.22Å; L174-T178 PolarHBondContact O-OG1 2.93Å; L175-T178 WeakPolarHBondContact O-CB 3.4Å; L175-T178 PolarHBondContact O-N 3.38Å; G176-T178 VanDerWaalsContact C-N 3.3Å; G176-T178 PolarHBondContact O-N 3.46Å; T178-L180 VanDerWaalsContact C-N 3.32Å; T178-L180 PolarHBondContact O-N 3.34Å; T178-C181 PolarHBondContact O-N 2.81Å; T178-S182 WeakPolarHBondContact O-CB 3.46Å; T178-S182 PolarHBondContact O-N 2.86Å; T178-S182 PolarHBondContact O-OG 3.37Å; T178-T277 HydrophobicContact CG2-CG2 3.68Å; T178-W278 HydrophobicContact CG2-CE3 4.22Å; T178-W278 HydrophobicContact CG2-CZ3 4.43Å; T178-V281 HydrophobicContact CG2-CG2 3.82Å
179V92.1Very high78.9Confident4 Ų437.7 Ų37.72%0.02422%0.221CC..Hα-helixtrans-60.7-44.2175.8-1790000110.6V134 Q135 L138 L175 G176 L177 S182 D183 W278V134-V179 HydrophobicContact CB-CG1 4.04Å; V134-V179 HydrophobicContact CG1-CB 4.45Å; V134-V179 HydrophobicContact CG1-CG1 3.81Å; V134-V179 HydrophobicContact CG1-CG2 3.72Å; Q135-V179 HydrophobicContact CG-CB 4.22Å; Q135-V179 HydrophobicContact CG-CG1 3.55Å; L138-V179 HydrophobicContact CD2-CG2 4.16Å; L175-V179 WeakPolarHBondContact O-CG2 3.44Å; L175-V179 PolarHBondContact O-N 3.19Å; L175-V179 VanDerWaalsContact O-N 3.17Å; G176-V179 PolarHBondContact O-N 2.99Å; L177-V179 VanDerWaalsContact C-N 3.31Å; L177-V179 PolarHBondContact O-N 3.36Å; V179-S182 PolarHBondContact O-N 2.74Å; V179-D183 PolarHBondContact O-N 3Å; V179-W278 HydrophobicContact CG2-CE3 4.4Å; V179-W278 HydrophobicContact CG2-CH2 3.9Å; V179-W278 HydrophobicContact CG2-CZ3 3.46Å; V179-W278 VanDerWaalsContact CG2-CZ3 3.46Å
180L88.7Confident75.9Confident8 Ų838.8 Ų38.84%0.04224%0.241CC..Hα-helixtrans-68.7-37.1178.1-66.8176.3000112.6L90 F104 L108 L112 L177 T178 S184L90-L180 HydrophobicContact CD1-CD1 4.16Å; L90-L180 HydrophobicContact CD2-CD1 4.06Å; F104-L180 HydrophobicContact CZ-CD2 4.27Å; L108-L180 HydrophobicContact CD2-CD1 4.44Å; L112-L180 HydrophobicContact CD1-CB 4.14Å; L112-L180 HydrophobicContact CD1-CD1 4.22Å; L112-L180 HydrophobicContact CD2-CB 3.74Å; L112-L180 HydrophobicContact CD2-CD1 4.4Å; L177-L180 PolarHBondContact O-N 2.95Å; L177-L180 VanDerWaalsContact O-N 3.15Å; T178-L180 VanDerWaalsContact C-N 3.32Å; T178-L180 PolarHBondContact O-N 3.34Å; L180-S184 PolarHBondContact O-OG 2.94Å
181C86Confident73.1Confident0 Ų041.5 Ų41.50%026%0.257CS..Hα-helixtrans-67.4-37.9174.5-67.20000112.4I10 T116 L177 T178 D183 S184I10-C181 HydrophobicContact CG2-CB 4.26Å; T116-C181 HydrophobicContact CG2-CB 3.68Å; L177-C181 PolarHBondContact O-N 3.29Å; L177-C181 PolarHBondContact O-SG 2.76Å; T178-C181 PolarHBondContact O-N 2.81Å; C181-D183 PolarHBondContact O-N 3.08Å; C181-S184 PolarHBondContact O-N 2.77Å
182S78.1Confident70.8Confident7 Ų746.3 Ų46.35%0.04929%0.29CS..Hα-helixtrans-65.8-28.7-178.8-60.20000112.1T178 V179 I186T178-S182 WeakPolarHBondContact O-CB 3.46Å; T178-S182 PolarHBondContact O-N 2.86Å; T178-S182 PolarHBondContact O-OG 3.37Å; V179-S182 PolarHBondContact O-N 2.74Å; S182-I186 WeakPolarHBondContact O-CD1 3.5Å; S182-I186 WeakPolarHBondContact O-CG1 3.05Å
183D66.8Low68.4Low10 Ų1050.4 Ų50.45%0.05333%0.327CS..Hα-helixtrans-72.7-39.2175.8-163.149.6000112.7P127 Q128 A131 V179 C181 L185 I186P127-D183 WeakPolarHBondContact CA-OD2 3.48Å; Q128-D183 WeakPolarHBondContact CB-OD1 3.45Å; Q128-D183 VanDerWaalsContact CD-OD1 3.27Å; Q128-D183 WeakPolarHBondContact CG-OD1 3.47Å; Q128-D183 PolarHBondContact N-OD1 3.2Å; Q128-D183 PolarHBondContact N-OD2 2.86Å; A131-D183 HydrophobicContact CB-CB 3.71Å; A131-D183 WeakPolarHBondContact CB-OD1 3.37Å; V179-D183 PolarHBondContact O-N 3Å; C181-D183 PolarHBondContact O-N 3.08Å; D183-L185 PolarHBondContact O-N 3.42Å; D183-L185 VanDerWaalsContact O-N 3.1Å; D183-I186 PolarHBondContact O-N 3.33Å
184S56.1Low66.1Low32 Ų3255 Ų5522%0.22435%0.345CS..Hα-helixtrans-64.8-16.5-177.7-57.70000113.6V123 L180 C181V123-S184 WeakPolarHBondContact CG1-OG 3.46Å; L180-S184 PolarHBondContact O-OG 2.94Å; C181-S184 PolarHBondContact O-N 2.77Å
185L52Low64.1Low88 Ų8858 Ų5846%0.46137%0.366SS..THydrogen-bonded Turntrans-93.4-7.6-177.9-65.3172.8000113.4D183D183-L185 PolarHBondContact O-N 3.42Å; D183-L185 VanDerWaalsContact O-N 3.1Å
186I50.1Low62.1Low65 Ų6564 Ų6433%0.33340%0.398SS..SBendtrans-91.6-16.3-166.3-68.1176.2000114.2S182 D183 A275S182-I186 WeakPolarHBondContact O-CD1 3.5Å; S182-I186 WeakPolarHBondContact O-CG1 3.05Å; D183-I186 PolarHBondContact O-N 3.33Å; I186-A275 HydrophobicContact CD1-CB 4.42Å
187I46.2Very low60Low67 Ų6771.3 Ų71.334%0.34444%0.435SS..  trans-143.7111.9-176.5-60.4-176000115.1Q125 Q128 G189 G190Q125-I187 PolarHBondContact NE2-O 3.47Å; Q125-I187 VanDerWaalsContact NE2-O 3.13Å; Q128-I187 VanDerWaalsContact NE2-CD1 3.29Å; I187-G189 VanDerWaalsContact CG2-N 3.29Å; I187-G190 VanDerWaalsContact CG2-N 3.32Å
188E36.9Very low58.1Low205 Ų20574.8 Ų74.896%0.95846%0.461SS*.SBend-77.7119.6129.7-76.2-171157.600108.3
189G38.9Very low56.7Low85 Ų8577.9 Ų77.988%0.87648%0.475SS*.SBendtrans95.652.8160.100000120.8I187I187-G189 VanDerWaalsContact CG2-N 3.29Å
190G35.8Very low55.6Low59 Ų5983.4 Ų83.461%0.60850%0.504SS*.  trans-139.3112.7171.800000115.1I187I187-G190 VanDerWaalsContact CG2-N 3.32Å
191S39Very low55.3Low110 Ų11089.9 Ų89.977%0.76953%0.528SS*.  trans-59159.1176-60.10000114.4
192P47.3Very low55.3Low121 Ų12199.4 Ų99.479%0.78656%0.564SS**SBendtrans-79.4150.4-171.733-33.6000113.3
193A47.1Very low55.7Low99 Ų99101 Ų10182%0.81857%0.569SS**  trans62.973.7154.600000118.1
194F48.8Very low56.8Low153 Ų153101.3 Ų101.367%0.67157%0.57SS**  trans-89.3154.4151.4-75.3-78.5000110.5L196 Q199F194-L196 PolarHBondContact O-N 2.86Å; F194-Q199 PolarHBondContact O-NE2 2.91Å
195P56.3Low58.4Low89 Ų89103.4 Ų103.458%0.57858%0.581SS**  trans-53.9134179.9-14.620.3000112.1L197 S198P195-L197 PolarHBondContact O-N 3.37Å; P195-S198 PolarHBondContact O-N 3.45Å; P195-S198 PolarHBondContact O-OG 3.43Å
196L54.8Low60.5Low128 Ų128101.1 Ų101.167%0.6757%0.574SS**G310 helixtrans-50.8-35.5-177.4-110.6132000113.6V129 F194 Q199V129-L196 HydrophobicContact CG1-CD2 3.84Å; V129-L196 HydrophobicContact CG2-CD2 3.92Å; V129-L196 HydrophobicContact CG2-CG 4.17Å; F194-L196 PolarHBondContact O-N 2.86Å; L196-Q199 PolarHBondContact O-N 2.87Å
197L51.6Low62.6Low154 Ų15498 Ų9881%0.80656%0.559SS**G310 helixtrans-75.1-31.5-179-75.7164000113.7P195 Q199 L200P195-L197 PolarHBondContact O-N 3.37Å; L197-Q199 PolarHBondContact O-N 2.84Å; L197-L200 PolarHBondContact O-N 3.42Å
198S54.5Low65Low86 Ų8696.4 Ų96.460%0.60156%0.556SS**G310 helixtrans-74.9-6.717757.50000112.8P195P195-S198 PolarHBondContact O-N 3.45Å; P195-S198 PolarHBondContact O-OG 3.43Å
199Q63.8Low67.9Low66 Ų6691.1 Ų91.131%0.30854%0.537SS..G310 helixtrans-96.30.1174.8-59.4-173.711.600113F194 L196 L197 R201 Y204F194-Q199 PolarHBondContact O-NE2 2.91Å; L196-Q199 PolarHBondContact O-N 2.87Å; L197-Q199 PolarHBondContact O-N 2.84Å; Q199-R201 WeakPolarHBondContact O-CG 3.39Å; Q199-R201 PolarHBondContact O-N 3.24Å; Q199-Y204 VanDerWaalsContact O-CE2 3.23Å; Q199-Y204 WeakPolarHBondContact O-CE2 3.45Å
200L69.1Low70.7Confident119 Ų11989.2 Ų89.262%0.62351%0.506SS*.  trans-63.8105.1-178-169.475.7000110.2L197 Y204 V205L197-L200 PolarHBondContact O-N 3.42Å; L200-Y204 HydrophobicContact CD1-CD2 4.31Å; L200-V205 HydrophobicContact CD2-CG2 4.42Å
201R81.9Confident73.7Confident144 Ų14486.9 Ų86.954%0.54348%0.48SS..  trans-93.8147.9179.6-50.7-129.2-162.6-171.5-3.9109.9Q199 Y203 Y204Q199-R201 WeakPolarHBondContact O-CG 3.39Å; Q199-R201 PolarHBondContact O-N 3.24Å; R201-Y203 HydrophobicContact CB-CD1 3.71Å; R201-Y203 HydrophobicContact CB-CD2 4.27Å; R201-Y203 HydrophobicContact CB-CE1 3.38Å; R201-Y203 HydrophobicContact CB-CE2 3.97Å; R201-Y203 HydrophobicContact CB-CG 4.14Å; R201-Y203 VanDerWaalsContact CB-CZ 3.49Å; R201-Y203 VanDerWaalsContact CD-CE1 3.45Å; R201-Y203 WeakPolarHBondContact CD-OH 3.38Å; R201-Y203 HydrophobicContact CG-CE1 3.85Å; R201-Y203 HydrophobicContact CG-CE2 4.41Å; R201-Y203 PolarHBondContact NE-OH 3.31Å; R201-Y203 PolarHBondContact O-N 3.3Å; R201-Y203 VanDerWaalsContact O-N 3.1Å; R201-Y204 HydrophobicContact CB-CD2 4.04Å; R201-Y204 HydrophobicContact CB-CE2 3.97Å; R201-Y204 HydrophobicContact CB-CG 4.45Å; R201-Y204 HydrophobicContact CG-CD2 4.36Å; R201-Y204 HydrophobicContact CG-CE2 3.8Å; R201-Y204 VanDerWaalsContact N-CD2 3.28Å; R201-Y204 WeakPolarHBondContact O-CB 3.46Å; R201-Y204 PolarHBondContact O-N 2.93Å
202W86.3Confident76.5Confident200 Ų20085 Ų8576%0.75847%0.467SS*.Hα-helixtrans-55.4-32.5-179.671.3-96.2000112.5Y204 V205 A206W202-Y204 VanDerWaalsContact C-N 3.34Å; W202-Y204 PolarHBondContact O-N 3.23Å; W202-V205 PolarHBondContact O-N 3.41Å; W202-A206 HydrophobicContact CE3-CB 4.01Å; W202-A206 HydrophobicContact CZ3-CB 4.01Å; W202-A206 PolarHBondContact O-N 3.07Å
203Y85.9Confident79Confident40 Ų4085.5 Ų85.516%0.15745%0.453CS..Hα-helixtrans-71.8-24.2179.957.3-105.4000113.4R201 G207 I269R201-Y203 HydrophobicContact CB-CD1 3.71Å; R201-Y203 HydrophobicContact CB-CD2 4.27Å; R201-Y203 HydrophobicContact CB-CE1 3.38Å; R201-Y203 HydrophobicContact CB-CE2 3.97Å; R201-Y203 HydrophobicContact CB-CG 4.14Å; R201-Y203 VanDerWaalsContact CB-CZ 3.49Å; R201-Y203 VanDerWaalsContact CD-CE1 3.45Å; R201-Y203 WeakPolarHBondContact CD-OH 3.38Å; R201-Y203 HydrophobicContact CG-CE1 3.85Å; R201-Y203 HydrophobicContact CG-CE2 4.41Å; R201-Y203 PolarHBondContact NE-OH 3.31Å; R201-Y203 PolarHBondContact O-N 3.3Å; R201-Y203 VanDerWaalsContact O-N 3.1Å; Y203-G207 PolarHBondContact O-N 3.23Å; Y203-I269 WeakPolarHBondContact CD2-O 3.26Å; Y203-I269 WeakPolarHBondContact O-CG2 3.27Å
204Y89.6Confident81.4Confident18 Ų1880.8 Ų80.87%0.07141%0.414CS..Hα-helixtrans-64.3-44.1169.7-58.9-32.6000110.9L133 Q199 L200 R201 W202 A208 V270L133-Y204 HydrophobicContact CD2-CD1 4.32Å; L133-Y204 HydrophobicContact CD2-CG 4.26Å; Q199-Y204 VanDerWaalsContact O-CE2 3.23Å; Q199-Y204 WeakPolarHBondContact O-CE2 3.45Å; L200-Y204 HydrophobicContact CD1-CD2 4.31Å; R201-Y204 HydrophobicContact CB-CD2 4.04Å; R201-Y204 HydrophobicContact CB-CE2 3.97Å; R201-Y204 HydrophobicContact CB-CG 4.45Å; R201-Y204 HydrophobicContact CG-CD2 4.36Å; R201-Y204 HydrophobicContact CG-CE2 3.8Å; R201-Y204 VanDerWaalsContact N-CD2 3.28Å; R201-Y204 WeakPolarHBondContact O-CB 3.46Å; R201-Y204 PolarHBondContact O-N 2.93Å; W202-Y204 VanDerWaalsContact C-N 3.34Å; W202-Y204 PolarHBondContact O-N 3.23Å; Y204-A208 VanDerWaalsContact O-CB 3.27Å; Y204-A208 WeakPolarHBondContact O-CB 3.42Å; Y204-A208 PolarHBondContact O-N 3.45Å; Y204-V270 HydrophobicContact CD1-CG1 4.28Å; Y204-V270 WeakPolarHBondContact CD1-O 3.47Å; Y204-V270 VanDerWaalsContact CE1-O 3.31Å; Y204-V270 WeakPolarHBondContact CE1-O 3.29Å
205V91.4Very high83.8Confident75 Ų7574 Ų7446%0.45539%0.386SS..Hα-helixtrans-67.4-48.2178-178.50000110.3L200 W202 G207 A208 V209L200-V205 HydrophobicContact CD2-CG2 4.42Å; W202-V205 PolarHBondContact O-N 3.41Å; V205-G207 VanDerWaalsContact C-N 3.33Å; V205-G207 PolarHBondContact O-N 3.43Å; V205-A208 PolarHBondContact O-N 3Å; V205-V209 HydrophobicContact CG1-CG2 4.41Å; V205-V209 WeakPolarHBondContact O-CG2 3.19Å; V205-V209 PolarHBondContact O-N 3.31Å
206A94.3Very high85.8Confident40 Ų4073.1 Ų73.133%0.33138%0.376SS..Hα-helixtrans-59-44.7178.300000111.8W202 V209 L210W202-A206 HydrophobicContact CE3-CB 4.01Å; W202-A206 HydrophobicContact CZ3-CB 4.01Å; W202-A206 PolarHBondContact O-N 3.07Å; A206-V209 PolarHBondContact O-N 3.38Å; A206-L210 WeakPolarHBondContact O-CB 3.37Å; A206-L210 PolarHBondContact O-N 3.27Å
207G95.8Very high87.9Confident0 Ų067.7 Ų67.70%035%0.347CS..Hα-helixtrans-62.6-46.4174.700000112.5Y203 V205 V209 L210 F211 S266Y203-G207 PolarHBondContact O-N 3.23Å; V205-G207 VanDerWaalsContact C-N 3.33Å; V205-G207 PolarHBondContact O-N 3.43Å; G207-V209 PolarHBondContact O-N 3.01Å; G207-L210 PolarHBondContact O-N 3.28Å; G207-F211 VanDerWaalsContact O-CB 3.3Å; G207-F211 WeakPolarHBondContact O-CB 3.45Å; G207-F211 PolarHBondContact O-N 3.03Å; G207-S266 WeakPolarHBondContact O-CB 3.46Å
208A95.6Very high90.1Very high34 Ų3460.7 Ų60.728%0.28131%0.31SS..Hα-helixtrans-63.8-37.2178.100000113.2Y204 V205 S212Y204-A208 VanDerWaalsContact O-CB 3.27Å; Y204-A208 WeakPolarHBondContact O-CB 3.42Å; Y204-A208 PolarHBondContact O-N 3.45Å; V205-A208 PolarHBondContact O-N 3Å; A208-S212 WeakPolarHBondContact O-CB 3.39Å; A208-S212 PolarHBondContact O-N 3.11Å; A208-S212 PolarHBondContact O-OG 3.05Å
209V97.8Very high92.2Very high94 Ų9459.7 Ų59.757%0.5730%0.296SS*.Hα-helixtrans-64.4-48.5174168.70000110.5V205 A206 G207 F211 S212 W213V205-V209 HydrophobicContact CG1-CG2 4.41Å; V205-V209 WeakPolarHBondContact O-CG2 3.19Å; V205-V209 PolarHBondContact O-N 3.31Å; A206-V209 PolarHBondContact O-N 3.38Å; G207-V209 PolarHBondContact O-N 3.01Å; V209-F211 VanDerWaalsContact C-N 3.35Å; V209-F211 PolarHBondContact O-N 3.19Å; V209-S212 PolarHBondContact O-N 3.46Å; V209-W213 WeakPolarHBondContact O-CB 3.34Å; V209-W213 PolarHBondContact O-N 3.04Å
210L98.5Very high93.9Very high44 Ų4463.5 Ų63.523%0.2331%0.308CS..Hα-helixtrans-61.8-43.3177.2-179.161.3000111.6A206 G207 S212 W213 A214 V265 I269A206-L210 WeakPolarHBondContact O-CB 3.37Å; A206-L210 PolarHBondContact O-N 3.27Å; G207-L210 PolarHBondContact O-N 3.28Å; L210-S212 VanDerWaalsContact C-N 3.33Å; L210-S212 PolarHBondContact O-N 2.7Å; L210-W213 PolarHBondContact O-N 3.16Å; L210-A214 WeakPolarHBondContact O-CB 3.16Å; L210-A214 PolarHBondContact O-N 3.14Å; L210-V265 HydrophobicContact CD2-CG1 4.1Å; L210-I269 HydrophobicContact CD2-CD1 3.88Å
211F98.6Very high95.2Very high10 Ų1058 Ų584%0.04428%0.279CS..Hα-helixtrans-56.3-47.5176178.4-90.8000111.4L137 V140 H141 G207 V209 S215 I263 S266 L267L137-F211 HydrophobicContact CB-CD2 4.31Å; L137-F211 HydrophobicContact CB-CE2 4.02Å; L137-F211 HydrophobicContact CB-CZ 4.22Å; L137-F211 HydrophobicContact CD2-CD1 3.89Å; L137-F211 HydrophobicContact CD2-CE1 3.95Å; L137-F211 HydrophobicContact CD2-CG 4.22Å; L137-F211 HydrophobicContact CD2-CZ 4.33Å; L137-F211 VanDerWaalsContact O-CZ 3.23Å; L137-F211 WeakPolarHBondContact O-CZ 3.24Å; V140-F211 HydrophobicContact CG1-CE1 4.38Å; H141-F211 HydrophobicContact CB-CE2 4.08Å; H141-F211 HydrophobicContact CB-CZ 3.98Å; G207-F211 VanDerWaalsContact O-CB 3.3Å; G207-F211 WeakPolarHBondContact O-CB 3.45Å; G207-F211 PolarHBondContact O-N 3.03Å; V209-F211 VanDerWaalsContact C-N 3.35Å; V209-F211 PolarHBondContact O-N 3.19Å; F211-S215 VanDerWaalsContact O-CB 3.22Å; F211-S215 WeakPolarHBondContact O-CB 3.44Å; F211-S215 PolarHBondContact O-N 3.19Å; F211-S215 PolarHBondContact O-OG 2.85Å; F211-I263 HydrophobicContact CD2-CG2 3.92Å; F211-I263 HydrophobicContact CE2-CG2 3.74Å; F211-S266 WeakPolarHBondContact CA-OG 3.45Å; F211-S266 VanDerWaalsContact CB-OG 3.27Å; F211-S266 WeakPolarHBondContact CB-OG 3.17Å; F211-L267 HydrophobicContact CD2-CD2 4.19Å; F211-L267 HydrophobicContact CE2-CD2 4.34Å
212S98.6Very high96Very high72 Ų7252.1 Ų52.150%0.50326%0.259SS..Hα-helixtrans-67.1-45.7-177.9-590000111.4A208 V209 L210 S215 L216A208-S212 WeakPolarHBondContact O-CB 3.39Å; A208-S212 PolarHBondContact O-N 3.11Å; A208-S212 PolarHBondContact O-OG 3.05Å; V209-S212 PolarHBondContact O-N 3.46Å; L210-S212 VanDerWaalsContact C-N 3.33Å; L210-S212 PolarHBondContact O-N 2.7Å; S212-S215 PolarHBondContact O-N 2.8Å; S212-L216 WeakPolarHBondContact O-CB 3.46Å; S212-L216 PolarHBondContact O-N 2.79Å
213W98.7Very high96.5Very high130 Ų13044 Ų4449%0.49223%0.231SC..Hα-helixtrans-60.1-48.7175.6173.2-103.3000111.9V209 L210 L216 L217V209-W213 WeakPolarHBondContact O-CB 3.34Å; V209-W213 PolarHBondContact O-N 3.04Å; L210-W213 PolarHBondContact O-N 3.16Å; W213-L216 PolarHBondContact O-N 3.1Å; W213-L217 PolarHBondContact O-N 3.35Å
214A98.7Very high97Very high0 Ų044.4 Ų44.40%024%0.235CC..Hα-helixtrans-64.7-41.5179.700000111.5L210 L216 L217 Q218 A259 L262 I263L210-A214 WeakPolarHBondContact O-CB 3.16Å; L210-A214 PolarHBondContact O-N 3.14Å; A214-L216 VanDerWaalsContact C-N 3.33Å; A214-L216 PolarHBondContact O-N 3.41Å; A214-L217 PolarHBondContact O-N 2.89Å; A214-Q218 WeakPolarHBondContact O-CB 3.39Å; A214-Q218 PolarHBondContact O-N 3.49Å; A214-A259 WeakPolarHBondContact O-CB 3.42Å; A214-L262 HydrophobicContact CB-CB 3.66Å; A214-I263 HydrophobicContact CB-CG1 3.7Å
215S98.8Very high97.3Very high12 Ų1245.5 Ų45.58%0.08424%0.242CC..Hα-helixtrans-59.4-43.1174.1-66.80000112R144 F211 S212 Q218 H219R144-S215 PolarHBondContact NH1-O 2.91Å; F211-S215 VanDerWaalsContact O-CB 3.22Å; F211-S215 WeakPolarHBondContact O-CB 3.44Å; F211-S215 PolarHBondContact O-N 3.19Å; F211-S215 PolarHBondContact O-OG 2.85Å; S212-S215 PolarHBondContact O-N 2.8Å; S215-Q218 PolarHBondContact O-N 2.89Å; S215-H219 WeakPolarHBondContact O-CB 3.37Å; S215-H219 PolarHBondContact O-N 3.28Å
216L98.5Very high97.4Very high70 Ų7042.5 Ų42.537%0.36623%0.225SC..Hα-helixtrans-64.8-44176.4-179.362.1000112S212 W213 A214 Q218 H219 R220S212-L216 WeakPolarHBondContact O-CB 3.46Å; S212-L216 PolarHBondContact O-N 2.79Å; W213-L216 PolarHBondContact O-N 3.1Å; A214-L216 VanDerWaalsContact C-N 3.33Å; A214-L216 PolarHBondContact O-N 3.41Å; L216-Q218 VanDerWaalsContact C-N 3.3Å; L216-Q218 PolarHBondContact O-N 3.41Å; L216-H219 PolarHBondContact O-N 3.3Å; L216-R220 HydrophobicContact CD1-CG 4.19Å; L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 VanDerWaalsContact O-CG 3.3Å; L216-R220 WeakPolarHBondContact O-CG 3.19Å; L216-R220 PolarHBondContact O-N 2.97Å
217L98.4Very high97.5Very high13 Ų1348.4 Ų48.47%0.06824%0.239CC..Hα-helixtrans-58.9-44175.6174.759.8000111.2W213 A214 S221 W248 A259W213-L217 PolarHBondContact O-N 3.35Å; A214-L217 PolarHBondContact O-N 2.89Å; L217-S221 WeakPolarHBondContact O-CB 3.46Å; L217-S221 PolarHBondContact O-N 3.41Å; L217-S221 PolarHBondContact O-OG 3.09Å; L217-W248 HydrophobicContact CD1-CB 3.98Å; L217-W248 HydrophobicContact CD1-CD2 3.98Å; L217-W248 HydrophobicContact CD1-CG 3.49Å; L217-W248 VanDerWaalsContact CD1-CG 3.49Å; L217-W248 HydrophobicContact CD2-CD2 4.17Å; L217-W248 HydrophobicContact CD2-CE3 4.45Å; L217-A259 HydrophobicContact CB-CB 4.2Å; L217-A259 HydrophobicContact CD2-CB 4.07Å; L217-A259 HydrophobicContact CG-CB 3.97Å
218Q98.6Very high97.4Very high7 Ų750 Ų503%0.03325%0.248CC..Hα-helixtrans-64.4-49.8178.2-165.2177.346.500111.6A214 S215 L216 R220 S221 L222 H256 A259 E260A214-Q218 WeakPolarHBondContact O-CB 3.39Å; A214-Q218 PolarHBondContact O-N 3.49Å; S215-Q218 PolarHBondContact O-N 2.89Å; L216-Q218 VanDerWaalsContact C-N 3.3Å; L216-Q218 PolarHBondContact O-N 3.41Å; Q218-R220 PolarHBondContact O-N 3.32Å; Q218-S221 WeakPolarHBondContact O-CB 3.32Å; Q218-S221 PolarHBondContact O-N 2.89Å; Q218-S221 VanDerWaalsContact O-N 3.17Å; Q218-L222 HydrophobicContact CG-CD1 4.03Å; Q218-L222 WeakPolarHBondContact O-CG 3.48Å; Q218-L222 PolarHBondContact O-N 3.34Å; Q218-H256 HydrophobicContact CG-CB 4.1Å; Q218-H256 PolarHBondContact NE2-O 2.97Å; Q218-A259 HydrophobicContact CB-CB 3.56Å; Q218-A259 HydrophobicContact CG-CB 4.17Å; Q218-E260 PolarHBondContact NE2-OE2 3.43Å; Q218-E260 PolarHBondContact OE1-OE2 2.75Å
219H98.3Very high97.3Very high66 Ų6650 Ų5031%0.30624%0.24SC..Hα-helixtrans-57.2-49.9179.7-177.972.8000111.4E148 S215 L216 S221 L222 V223E148-H219 WeakPolarHBondContact OE1-CB 3.48Å; E148-H219 IonicContact OE1-CE1 3.95Å; E148-H219 IonicContact OE1-CG 3.45Å; E148-H219 IonicContact OE1-ND1 2.78Å; E148-H219 PolarHBondContact OE1-ND1 2.7Å; S215-H219 WeakPolarHBondContact O-CB 3.37Å; S215-H219 PolarHBondContact O-N 3.28Å; L216-H219 PolarHBondContact O-N 3.3Å; H219-S221 VanDerWaalsContact C-N 3.28Å; H219-S221 PolarHBondContact O-N 3.39Å; H219-L222 PolarHBondContact O-N 2.96Å; H219-L222 VanDerWaalsContact O-N 3.1Å; H219-V223 WeakPolarHBondContact O-CG2 3.49Å; H219-V223 PolarHBondContact O-N 3.06Å
220R98Very high97Very high145 Ų14547.1 Ų47.155%0.54722%0.223SC..Hα-helixtrans-57.7-41.8177.1-74.3177.8175.9-178.5-0.3112L216 Q218 L222 V223 L224L216-R220 HydrophobicContact CD1-CG 4.19Å; L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 VanDerWaalsContact O-CG 3.3Å; L216-R220 WeakPolarHBondContact O-CG 3.19Å; L216-R220 PolarHBondContact O-N 2.97Å; Q218-R220 PolarHBondContact O-N 3.32Å; R220-L222 VanDerWaalsContact C-N 3.32Å; R220-L222 PolarHBondContact O-N 3.38Å; R220-V223 PolarHBondContact O-N 3.44Å; R220-L224 WeakPolarHBondContact O-CG 3.42Å; R220-L224 PolarHBondContact O-N 3.06Å
221S98.1Very high96.4Very high3 Ų345.6 Ų45.62%0.02122%0.218CC..Hα-helixtrans-62.3-39.9177.6-60.80000112L217 Q218 H219 L225 F249L217-S221 WeakPolarHBondContact O-CB 3.46Å; L217-S221 PolarHBondContact O-N 3.41Å; L217-S221 PolarHBondContact O-OG 3.09Å; Q218-S221 WeakPolarHBondContact O-CB 3.32Å; Q218-S221 PolarHBondContact O-N 2.89Å; Q218-S221 VanDerWaalsContact O-N 3.17Å; H219-S221 VanDerWaalsContact C-N 3.28Å; H219-S221 PolarHBondContact O-N 3.39Å; S221-L225 WeakPolarHBondContact O-CG 3.42Å; S221-L225 PolarHBondContact O-N 2.84Å; S221-L225 VanDerWaalsContact O-N 3.08Å; S221-F249 WeakPolarHBondContact O-CE2 3.41Å
222L97Very high95.5Very high22 Ų2249.7 Ų49.712%0.11526%0.263CS..Hα-helixtrans-71.7-39.4178.5-67.1160.6000112.3E148 Q218 H219 R220 L224 L225 A226E148-L222 WeakPolarHBondContact OE2-CD1 3.45Å; Q218-L222 HydrophobicContact CG-CD1 4.03Å; Q218-L222 WeakPolarHBondContact O-CG 3.48Å; Q218-L222 PolarHBondContact O-N 3.34Å; H219-L222 PolarHBondContact O-N 2.96Å; H219-L222 VanDerWaalsContact O-N 3.1Å; R220-L222 VanDerWaalsContact C-N 3.32Å; R220-L222 PolarHBondContact O-N 3.38Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L222-L224 PolarHBondContact O-N 3.44Å; L222-L225 PolarHBondContact O-N 3.19Å; L222-A226 WeakPolarHBondContact O-CB 3.27Å; L222-A226 PolarHBondContact O-N 2.87Å
223V96.7Very high94.6Very high29 Ų2950.7 Ų50.718%0.17627%0.27CS..Hα-helixtrans-60.6-44173.3170.50000110.7V152 H219 R220 L225 A226 R227V152-V223 HydrophobicContact CG1-CB 4.5Å; V152-V223 HydrophobicContact CG1-CG2 3.85Å; H219-V223 WeakPolarHBondContact O-CG2 3.49Å; H219-V223 PolarHBondContact O-N 3.06Å; R220-V223 PolarHBondContact O-N 3.44Å; V223-L225 VanDerWaalsContact C-N 3.34Å; V223-L225 PolarHBondContact O-N 3.04Å; V223-A226 PolarHBondContact O-N 3.47Å; V223-R227 HydrophobicContact CG1-CG 4.45Å; V223-R227 VanDerWaalsContact O-CG 3.32Å; V223-R227 WeakPolarHBondContact O-CG 3.28Å; V223-R227 PolarHBondContact O-N 3.32Å
224L96.4Very high93.8Very high48 Ų4846.9 Ų46.925%0.25127%0.271SS..Hα-helixtrans-61-42.4175-72.8172.6000111.8R220 L222 A226 R227 L228 F249R220-L224 WeakPolarHBondContact O-CG 3.42Å; R220-L224 PolarHBondContact O-N 3.06Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L222-L224 PolarHBondContact O-N 3.44Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 3.49Å; L224-R227 PolarHBondContact O-N 3.15Å; L224-L228 PolarHBondContact O-N 2.61Å; L224-F249 HydrophobicContact CB-CD2 4.4Å; L224-F249 HydrophobicContact CB-CE2 4Å; L224-F249 HydrophobicContact CD1-CD2 3.96Å; L224-F249 HydrophobicContact CD1-CE2 4.18Å
225L96.1Very high93.2Very high41 Ų4150.9 Ų50.922%0.21530%0.296CS..Hα-helixtrans-63.8-37.3175.5-71.5170.4000112.8S221 L222 V223 L228 P244 F249S221-L225 WeakPolarHBondContact O-CG 3.42Å; S221-L225 PolarHBondContact O-N 2.84Å; S221-L225 VanDerWaalsContact O-N 3.08Å; L222-L225 PolarHBondContact O-N 3.19Å; V223-L225 VanDerWaalsContact C-N 3.34Å; V223-L225 PolarHBondContact O-N 3.04Å; L225-L228 HydrophobicContact CD2-CD1 4.26Å; L225-L228 PolarHBondContact O-N 2.76Å; L225-P244 HydrophobicContact CD2-CB 4.07Å; L225-P244 HydrophobicContact CD2-CG 4.3Å; L225-F249 HydrophobicContact CD1-CZ 4Å; L225-F249 HydrophobicContact CD2-CE1 4.16Å; L225-F249 HydrophobicContact CD2-CZ 3.82Å; L225-F249 HydrophobicContact CG-CE1 4.45Å; L225-F249 HydrophobicContact CG-CE2 4.35Å; L225-F249 HydrophobicContact CG-CZ 3.66Å
226A95.3Very high92.9Very high12 Ų1254.3 Ų54.310%0.09932%0.316CS..Hα-helixtrans-66.5-43.6175.700000111.7V152 L222 V223 L224 L228 R229 T230V152-A226 HydrophobicContact CG1-CB 4Å; V152-A226 WeakPolarHBondContact O-CB 3.12Å; L222-A226 WeakPolarHBondContact O-CB 3.27Å; L222-A226 PolarHBondContact O-N 2.87Å; V223-A226 PolarHBondContact O-N 3.47Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 3.49Å; A226-L228 PolarHBondContact O-N 3.4Å; A226-L228 VanDerWaalsContact O-N 3.14Å; A226-R229 WeakPolarHBondContact O-CA 3.24Å; A226-R229 WeakPolarHBondContact O-CB 3.46Å; A226-R229 PolarHBondContact O-N 2.78Å; A226-T230 PolarHBondContact O-N 2.93Å; A226-T230 PolarHBondContact O-OG1 2.8Å
227R94.9Very high92.5Very high165 Ų16557 Ų5762%0.62333%0.327SS*.Hα-helixtrans-61.2-20.3177.3-74175.9-178.3-176.90.6114.3V223 L224 R229 T230V223-R227 HydrophobicContact CG1-CG 4.45Å; V223-R227 VanDerWaalsContact O-CG 3.32Å; V223-R227 WeakPolarHBondContact O-CG 3.28Å; V223-R227 PolarHBondContact O-N 3.32Å; L224-R227 PolarHBondContact O-N 3.15Å; R227-R229 PolarHBondContact O-N 3.16Å; R227-T230 WeakPolarHBondContact CA-OG1 3.44Å
228L94.4Very high92.2Very high34 Ų3458 Ų5818%0.17833%0.334CS..THydrogen-bonded Turntrans-67.5-16.8171.2-64.2175.5000113.2L224 L225 A226 R242 P244L224-L228 PolarHBondContact O-N 2.61Å; L225-L228 HydrophobicContact CD2-CD1 4.26Å; L225-L228 PolarHBondContact O-N 2.76Å; A226-L228 PolarHBondContact O-N 3.4Å; A226-L228 VanDerWaalsContact O-N 3.14Å; L228-R242 HydrophobicContact CB-CB 4.42Å; L228-R242 HydrophobicContact CD1-CB 4.46Å; L228-R242 HydrophobicContact CD2-CB 4.26Å; L228-P244 HydrophobicContact CD1-CB 3.92Å
229R93.1Very high91.7Very high34 Ų3461.4 Ų61.413%0.12835%0.351CS..THydrogen-bonded Turntrans-116.7-12.2-174-65.8179.9164.4-176.7-14.8113V154 S156 A226 R227 V236 E237 T238 L239 H241V154-R229 HydrophobicContact CB-CB 4.12Å; V154-R229 HydrophobicContact CG1-CB 3.96Å; V154-R229 HydrophobicContact CG2-CB 4.33Å; V154-R229 PolarHBondContact O-NH1 3.13Å; S156-R229 PolarHBondContact OG-NH2 3.35Å; A226-R229 WeakPolarHBondContact O-CA 3.24Å; A226-R229 WeakPolarHBondContact O-CB 3.46Å; A226-R229 PolarHBondContact O-N 2.78Å; R227-R229 PolarHBondContact O-N 3.16Å; R229-V236 WeakPolarHBondContact O-CA 3.38Å; R229-E237 PolarHBondContact O-N 3.02Å; R229-T238 WeakPolarHBondContact CA-O 3.49Å; R229-T238 VanDerWaalsContact CB-O 3.24Å; R229-T238 WeakPolarHBondContact CB-O 3.48Å; R229-T238 WeakPolarHBondContact CG-O 3.25Å; R229-T238 PolarHBondContact O-N 3.45Å; R229-L239 PolarHBondContact NH2-O 3.31Å; R229-H241 PolarHBondContact NH2-CE1 3.35Å; R229-H241 PolarHBondContact NH2-ND1 3.2Å
230T92.1Very high91.3Very high32 Ų3260.8 Ų60.820%0.19636%0.358CS..BIsolated β-bridgetrans-113.4147-179.658.50000112V154 A226 R227 T235 V236V154-T230 HydrophobicContact CG2-CG2 3.77Å; A226-T230 PolarHBondContact O-N 2.93Å; A226-T230 PolarHBondContact O-OG1 2.8Å; R227-T230 WeakPolarHBondContact CA-OG1 3.44Å; T230-T235 CarbonylContact C-O 3.56Å; T230-T235 VanDerWaalsContact CA-O 3.22Å; T230-T235 WeakPolarHBondContact CA-O 3.37Å; T230-V236 HydrophobicContact CG2-CG2 4.31Å
231G85.7Confident90.9Very high13 Ų1356 Ų5613%0.13434%0.342CS..  trans-79.1-178.9173.800000113.7S233 G234 T235 E237G231-S233 PolarHBondContact O-N 3.43Å; G231-G234 PolarHBondContact O-N 3.04Å; G231-T235 PolarHBondContact N-O 3.45Å; G231-E237 WeakPolarHBondContact CA-OE1 3.25Å
232G79.6Confident90.6Very high96 Ų9661.9 Ų61.999%0.9936%0.363SS*.THydrogen-bonded Turntrans-60.3-24.2176.100000114.3G234G232-G234 VanDerWaalsContact C-N 3.35Å
233S80.1Confident90.5Very high92 Ų9262.5 Ų62.564%0.64337%0.368SS*.THydrogen-bonded Turntrans-82.5-6.2174.356.40000114.1G231 T235G231-S233 PolarHBondContact O-N 3.43Å; S233-T235 VanDerWaalsContact C-N 3.29Å; S233-T235 PolarHBondContact O-N 3.49Å; S233-T235 PolarHBondContact OG-OG1 3.42Å
234G80.3Confident90.4Very high51 Ų5161.2 Ų61.253%0.52636%0.36SS..SBendtrans81.6-2.9-174.400000115G231 G232G231-G234 PolarHBondContact O-N 3.04Å; G232-G234 VanDerWaalsContact C-N 3.35Å
235T87.3Confident90.3Very high83 Ų8362.5 Ų62.551%0.50937%0.373SS..  trans-74.5145.8175.255.10000111.5T230 G231 S233 E237T230-T235 CarbonylContact C-O 3.56Å; T230-T235 VanDerWaalsContact CA-O 3.22Å; T230-T235 WeakPolarHBondContact CA-O 3.37Å; G231-T235 PolarHBondContact N-O 3.45Å; S233-T235 VanDerWaalsContact C-N 3.29Å; S233-T235 PolarHBondContact O-N 3.49Å; S233-T235 PolarHBondContact OG-OG1 3.42Å; T235-E237 PolarHBondContact O-N 3.02Å
236V91.3Very high90.2Very high85 Ų8561.9 Ų61.952%0.51538%0.377SS..BIsolated β-bridgetrans-69.3116176.5-179.80000109.6V154 R229 T230 L239V154-V236 HydrophobicContact CG1-CG1 3.88Å; V154-V236 HydrophobicContact CG1-CG2 3.79Å; V154-V236 HydrophobicContact CG2-CG2 4.03Å; R229-V236 WeakPolarHBondContact O-CA 3.38Å; T230-V236 HydrophobicContact CG2-CG2 4.31Å; V236-L239 HydrophobicContact CG1-CD2 3.98Å
237E91.5Very high90.2Very high126 Ų12664.2 Ų64.259%0.58940%0.402SS*.  trans-98.7-30.2179.5-68.9-177.2165.700112.1R229 G231 T235R229-E237 PolarHBondContact O-N 3.02Å; G231-E237 WeakPolarHBondContact CA-OE1 3.25Å; T235-E237 PolarHBondContact O-N 3.02Å
238T91.3Very high90.2Very high35 Ų3560.7 Ų60.722%0.21539%0.389CS..  trans-153.9148-177.8-171.10000112.6R229 A240R229-T238 WeakPolarHBondContact CA-O 3.49Å; R229-T238 VanDerWaalsContact CB-O 3.24Å; R229-T238 WeakPolarHBondContact CB-O 3.48Å; R229-T238 WeakPolarHBondContact CG-O 3.25Å; R229-T238 PolarHBondContact O-N 3.45Å; T238-A240 WeakPolarHBondContact OG1-CB 3.39Å; T238-A240 PolarHBondContact OG1-N 2.87Å; T238-A240 VanDerWaalsContact OG1-N 3.13Å
239L88.8Confident90.4Very high77 Ų7759 Ų5940%0.40338%0.38SS..  trans-100-4.4170-60.4-179.3000112.7V154 R229 V236V154-L239 HydrophobicContact CG1-CD2 3.98Å; R229-L239 PolarHBondContact NH2-O 3.31Å; V236-L239 HydrophobicContact CG1-CD2 3.98Å
240A88.4Confident90.5Very high53 Ų5361 Ų6144%0.43839%0.391SS..SBendtrans-59.3146.2179.500000111.3T238T238-A240 WeakPolarHBondContact OG1-CB 3.39Å; T238-A240 PolarHBondContact OG1-N 2.87Å; T238-A240 VanDerWaalsContact OG1-N 3.13Å
241H90.1Very high90.7Very high46 Ų4662.4 Ų62.421%0.21340%0.397CS..  trans-76.8134.9173.8-68.6-55.8000109.8K55 R229 F299 F304K55-H241 VanDerWaalsContact CB-NE2 3.32Å; K55-H241 WeakPolarHBondContact CB-NE2 3.27Å; R229-H241 PolarHBondContact NH2-CE1 3.35Å; R229-H241 PolarHBondContact NH2-ND1 3.2Å; H241-F299 HydrophobicContact CB-CE1 4.22Å; H241-F299 HydrophobicContact CB-CZ 4.14Å; H241-F299 AromaticContact CD2-CZ 3.5Å; H241-F299 AromaticContact CG-CZ 3.83Å; H241-F304 HydrophobicContact CB-CZ 4.02Å; H241-F304 VanDerWaalsContact O-CZ 3.26Å; H241-F304 WeakPolarHBondContact O-CZ 3.16Å
242R93.1Very high91.3Very high126 Ų12661.8 Ų61.848%0.47539%0.39SS..  trans-126.3158.7172.4-63.1-178.9179.6175.9-1.8109.5L228 P244L228-R242 HydrophobicContact CB-CB 4.42Å; L228-R242 HydrophobicContact CD1-CB 4.46Å; L228-R242 HydrophobicContact CD2-CB 4.26Å; R242-P244 WeakPolarHBondContact O-CD 3.47Å
243V94.8Very high92.2Very high34 Ų3457.3 Ų57.321%0.20634%0.344CS..  trans-75.5121.2175-179.70000108.5F304 Y307V243-F304 HydrophobicContact CG2-CB 3.7Å; V243-F304 HydrophobicContact CG2-CD1 3.83Å; V243-F304 HydrophobicContact CG2-CD2 3.62Å; V243-F304 HydrophobicContact CG2-CE1 4.34Å; V243-F304 HydrophobicContact CG2-CE2 4.17Å; V243-F304 HydrophobicContact CG2-CG 3.43Å; V243-F304 VanDerWaalsContact CG2-CG 3.43Å; V243-F304 HydrophobicContact CG2-CZ 4.5Å; V243-Y307 HydrophobicContact CG1-CD2 3.76Å; V243-Y307 HydrophobicContact CG1-CE2 3.96Å; V243-Y307 HydrophobicContact CG2-CD2 4.12Å
244P94.5Very high93Very high2 Ų252.9 Ų52.91%0.01331%0.313CS..  trans-68.3141.1175.627.2-32.7000111L225 L228 R242 F249 R311L225-P244 HydrophobicContact CD2-CB 4.07Å; L225-P244 HydrophobicContact CD2-CG 4.3Å; L228-P244 HydrophobicContact CD1-CB 3.92Å; R242-P244 WeakPolarHBondContact O-CD 3.47Å; P244-F249 HydrophobicContact CB-CB 4.31Å; P244-F249 HydrophobicContact CB-CD1 3.57Å; P244-F249 HydrophobicContact CB-CD2 4.04Å; P244-F249 HydrophobicContact CB-CE1 3.75Å; P244-F249 HydrophobicContact CB-CE2 4.23Å; P244-F249 HydrophobicContact CB-CG 3.72Å; P244-F249 HydrophobicContact CB-CZ 4.1Å; P244-F249 HydrophobicContact CG-CD1 3.44Å; P244-F249 VanDerWaalsContact CG-CD1 3.44Å; P244-F249 HydrophobicContact CG-CE1 3.63Å; P244-F249 HydrophobicContact CG-CG 4.07Å; P244-F249 HydrophobicContact CG-CZ 4.44Å; P244-R311 PolarHBondContact O-NH1 3.47Å; P244-R311 PolarHBondContact O-NH2 3.09Å
245S93.6Very high93.9Very high76 Ų7650.5 Ų50.553%0.53129%0.288SS..  trans-134.4161.4173.556.50000110.5E250S245-E250 WeakPolarHBondContact CA-OE1 3.14Å; S245-E250 WeakPolarHBondContact CB-OE1 3.33Å
246G93.9Very high94.4Very high28 Ų2847.5 Ų47.529%0.28927%0.268SS..SBendtrans92.5148.4-17900000114.3W248 F249 E250G246-W248 PolarHBondContact O-N 3.45Å; G246-F249 WeakPolarHBondContact O-CB 3.48Å; G246-F249 PolarHBondContact O-N 3.37Å; G246-E250 PolarHBondContact N-OE1 2.92Å
247G94.7Very high94.8Very high61 Ų6145.1 Ų45.163%0.62925%0.25SS*.G310 helixtrans57.5-135.2179.800000112.4F249 E250G247-F249 PolarHBondContact O-N 2.97Å; G247-E250 PolarHBondContact O-N 3.31Å
248W96.6Very high95.1Very high90 Ų9039.7 Ų39.734%0.34123%0.225SC..G310 helixtrans-73.1-9.8-177.3-76.363.9000114.2L217 G246 E250 L251 V252 P255 L258 P316L217-W248 HydrophobicContact CD1-CB 3.98Å; L217-W248 HydrophobicContact CD1-CD2 3.98Å; L217-W248 HydrophobicContact CD1-CG 3.49Å; L217-W248 VanDerWaalsContact CD1-CG 3.49Å; L217-W248 HydrophobicContact CD2-CD2 4.17Å; L217-W248 HydrophobicContact CD2-CE3 4.45Å; G246-W248 PolarHBondContact O-N 3.45Å; W248-E250 PolarHBondContact O-N 3.49Å; W248-L251 HydrophobicContact CE3-CD1 4.44Å; W248-L251 PolarHBondContact O-N 3.48Å; W248-L251 VanDerWaalsContact O-N 3.11Å; W248-V252 PolarHBondContact O-N 2.89Å; W248-V252 VanDerWaalsContact O-N 3.15Å; W248-P255 HydrophobicContact CB-CB 3.5Å; W248-P255 VanDerWaalsContact CB-CB 3.5Å; W248-P255 HydrophobicContact CB-CG 4.19Å; W248-L258 HydrophobicContact CE3-CD2 3.94Å; W248-L258 HydrophobicContact CZ3-CD2 3.59Å; W248-P316 HydrophobicContact CE3-CG 4.45Å; W248-P316 HydrophobicContact CZ3-CG 4Å
249F97.5Very high95.4Very high0 Ų038 Ų380%022%0.215CC..G310 helixtrans-63.9-21.5171.7-75.4-74.3000112.3S221 L224 L225 P244 G246 G247 L251 V252 S253 P255 R311S221-F249 WeakPolarHBondContact O-CE2 3.41Å; L224-F249 HydrophobicContact CB-CD2 4.4Å; L224-F249 HydrophobicContact CB-CE2 4Å; L224-F249 HydrophobicContact CD1-CD2 3.96Å; L224-F249 HydrophobicContact CD1-CE2 4.18Å; L225-F249 HydrophobicContact CD1-CZ 4Å; L225-F249 HydrophobicContact CD2-CE1 4.16Å; L225-F249 HydrophobicContact CD2-CZ 3.82Å; L225-F249 HydrophobicContact CG-CE1 4.45Å; L225-F249 HydrophobicContact CG-CE2 4.35Å; L225-F249 HydrophobicContact CG-CZ 3.66Å; P244-F249 HydrophobicContact CB-CB 4.31Å; P244-F249 HydrophobicContact CB-CD1 3.57Å; P244-F249 HydrophobicContact CB-CD2 4.04Å; P244-F249 HydrophobicContact CB-CE1 3.75Å; P244-F249 HydrophobicContact CB-CE2 4.23Å; P244-F249 HydrophobicContact CB-CG 3.72Å; P244-F249 HydrophobicContact CB-CZ 4.1Å; P244-F249 HydrophobicContact CG-CD1 3.44Å; P244-F249 VanDerWaalsContact CG-CD1 3.44Å; P244-F249 HydrophobicContact CG-CE1 3.63Å; P244-F249 HydrophobicContact CG-CG 4.07Å; P244-F249 HydrophobicContact CG-CZ 4.44Å; G246-F249 WeakPolarHBondContact O-CB 3.48Å; G246-F249 PolarHBondContact O-N 3.37Å; G247-F249 PolarHBondContact O-N 2.97Å; F249-L251 PolarHBondContact O-N 3.36Å; F249-V252 CarbonylContact C-O 3.58Å; F249-V252 WeakPolarHBondContact CA-O 3.24Å; F249-S253 WeakPolarHBondContact CD1-O 3.48Å; F249-S253 VanDerWaalsContact CE1-O 3.26Å; F249-S253 WeakPolarHBondContact CE1-O 3.36Å; F249-P255 VanDerWaalsContact CD1-CD 3.41Å; F249-P255 HydrophobicContact CD1-CG 3.66Å; F249-P255 HydrophobicContact CD2-CG 3.93Å; F249-P255 HydrophobicContact CE1-CG 3.61Å; F249-P255 HydrophobicContact CE2-CG 3.86Å; F249-P255 HydrophobicContact CG-CG 3.83Å; F249-P255 HydrophobicContact CZ-CG 3.68Å; F249-R311 WeakPolarHBondContact O-CD 3.43Å; F249-R311 PolarHBondContact O-NE 3.19Å; F249-R311 PolarHBondContact O-NH1 3.4Å; F249-R311 PolarHBondContact O-NH2 3.02Å
250E96.3Very high95.9Very high75 Ų7535 Ų3535%0.3520%0.199SC..G310 helixtrans-68.2-23.5174.4-59.7-48.5141.500113.3S245 G246 G247 W248 H310 R311S245-E250 WeakPolarHBondContact CA-OE1 3.14Å; S245-E250 WeakPolarHBondContact CB-OE1 3.33Å; G246-E250 PolarHBondContact N-OE1 2.92Å; G247-E250 PolarHBondContact O-N 3.31Å; W248-E250 PolarHBondContact O-N 3.49Å; E250-H310 PolarHBondContact O-NE2 3.36Å; E250-H310 VanDerWaalsContact O-NE2 3.13Å; E250-R311 VanDerWaalsContact CD-NH2 3.27Å; E250-R311 WeakPolarHBondContact O-CG 3.03Å; E250-R311 IonicContact OE1-NH2 3.65Å; E250-R311 PolarHBondContact OE1-NH2 3.39Å; E250-R311 IonicContact OE2-CZ 3.58Å; E250-R311 IonicContact OE2-NE 3Å; E250-R311 IonicContact OE2-NH2 2.93Å; E250-R311 PolarHBondContact OE2-NH2 3.31Å
251L96.4Very high96.4Very high62 Ų6233.1 Ų33.133%0.32518%0.182SC..THydrogen-bonded Turntrans-96.4-39.1178.5-59.9176.6000111.9W248 F249 R311 K312W248-L251 HydrophobicContact CE3-CD1 4.44Å; W248-L251 PolarHBondContact O-N 3.48Å; W248-L251 VanDerWaalsContact O-N 3.11Å; F249-L251 PolarHBondContact O-N 3.36Å; L251-R311 WeakPolarHBondContact O-CA 3.5Å; L251-K312 PolarHBondContact O-N 3.4Å
252V97.9Very high96.8Very high0 Ų033.1 Ų33.10%018%0.183CC..BIsolated β-bridgetrans-142.6152.9-171.3-61.10000113.4W248 F249 C254 P255 K312 P316W248-V252 PolarHBondContact O-N 2.89Å; W248-V252 VanDerWaalsContact O-N 3.15Å; F249-V252 CarbonylContact C-O 3.58Å; F249-V252 WeakPolarHBondContact CA-O 3.24Å; V252-C254 VanDerWaalsContact C-N 3.34Å; V252-C254 PolarHBondContact O-N 3.23Å; V252-P255 HydrophobicContact CG2-CB 3.92Å; V252-K312 CarbonylContact C-O 3.41Å; V252-K312 WeakPolarHBondContact CA-O 3.19Å; V252-K312 HydrophobicContact CG1-CB 4.18Å; V252-P316 HydrophobicContact CG1-CB 4.33Å; V252-P316 HydrophobicContact CG1-CG 3.93Å
253S97.9Very high97.1Very high1 Ų127.1 Ų27.11%0.00716%0.16CC..SBendtrans-66-35177.6-58.30000113.4F249 P255 H297 Y307 K312 A313F249-S253 WeakPolarHBondContact CD1-O 3.48Å; F249-S253 VanDerWaalsContact CE1-O 3.26Å; F249-S253 WeakPolarHBondContact CE1-O 3.36Å; S253-P255 VanDerWaalsContact C-CD 3.49Å; S253-H297 PolarHBondContact OG-ND1 2.72Å; S253-Y307 PolarHBondContact OG-OH 3.4Å; S253-K312 PolarHBondContact N-O 3.24Å; S253-K312 PolarHBondContact OG-O 2.85Å; S253-A313 WeakPolarHBondContact CB-O 3.25Å; S253-A313 PolarHBondContact N-O 2.89Å
254C98Very high97.2Very high0 Ų025.5 Ų25.50%015%0.15CC..  trans-130.362.6-168.8-480000112.5V252 H256 Y257 L258 A293 C296 A313 F314V252-C254 VanDerWaalsContact C-N 3.34Å; V252-C254 PolarHBondContact O-N 3.23Å; C254-H256 PolarHBondContact O-N 3.04Å; C254-Y257 HydrophobicContact CB-CD2 3.32Å; C254-Y257 HydrophobicContact CB-CE2 3.94Å; C254-Y257 HydrophobicContact CB-CG 3.87Å; C254-Y257 WeakPolarHBondContact O-CB 3.49Å; C254-Y257 PolarHBondContact O-N 3.01Å; C254-L258 PolarHBondContact O-N 3.47Å; C254-A293 HydrophobicContact CB-CB 4.19Å; C254-C296 VanDerWaalsContact SG-CB 3.57Å; C254-C296 PolarHBondContact SG-SG 2.83Å; C254-A313 WeakPolarHBondContact CB-O 3.44Å; C254-A313 PolarHBondContact N-O 3.45Å; C254-F314 HydrophobicContact CB-CB 4.17Å
255P98.1Very high97.4Very high0 Ų027 Ų270%016%0.159CC..Hα-helixtrans-61.9-25.7179.727.1-35.2000113.3W248 F249 V252 S253 Y257 L258 A259W248-P255 HydrophobicContact CB-CB 3.5Å; W248-P255 VanDerWaalsContact CB-CB 3.5Å; W248-P255 HydrophobicContact CB-CG 4.19Å; F249-P255 VanDerWaalsContact CD1-CD 3.41Å; F249-P255 HydrophobicContact CD1-CG 3.66Å; F249-P255 HydrophobicContact CD2-CG 3.93Å; F249-P255 HydrophobicContact CE1-CG 3.61Å; F249-P255 HydrophobicContact CE2-CG 3.86Å; F249-P255 HydrophobicContact CG-CG 3.83Å; F249-P255 HydrophobicContact CZ-CG 3.68Å; V252-P255 HydrophobicContact CG2-CB 3.92Å; S253-P255 VanDerWaalsContact C-CD 3.49Å; P255-Y257 VanDerWaalsContact C-N 3.3Å; P255-Y257 PolarHBondContact O-N 3.13Å; P255-L258 WeakPolarHBondContact O-CB 3.45Å; P255-L258 PolarHBondContact O-N 2.77Å; P255-A259 WeakPolarHBondContact O-CB 3.07Å; P255-A259 PolarHBondContact O-N 3.09Å
256H98.1Very high97.6Very high20 Ų2023.3 Ų23.39%0.09313%0.134CC..Hα-helixtrans-68-25.6174.155-77000113.6Q218 C254 E260Q218-H256 HydrophobicContact CG-CB 4.1Å; Q218-H256 PolarHBondContact NE2-O 2.97Å; C254-H256 PolarHBondContact O-N 3.04Å; H256-E260 PolarHBondContact O-N 2.83Å; H256-E260 VanDerWaalsContact O-N 3.15Å
257Y98.4Very high97.7Very high35 Ų3522 Ų2214%0.13712%0.12CC..Hα-helixtrans-79.9-35.9173.7-65.6-19.7000111.5Y53 C254 P255 A259 E260 L261 A292 A293Y53-Y257 PolarHBondContact OH-OH 3.24Å; C254-Y257 HydrophobicContact CB-CD2 3.32Å; C254-Y257 HydrophobicContact CB-CE2 3.94Å; C254-Y257 HydrophobicContact CB-CG 3.87Å; C254-Y257 WeakPolarHBondContact O-CB 3.49Å; C254-Y257 PolarHBondContact O-N 3.01Å; P255-Y257 VanDerWaalsContact C-N 3.3Å; P255-Y257 PolarHBondContact O-N 3.13Å; Y257-A259 VanDerWaalsContact C-N 3.33Å; Y257-E260 PolarHBondContact O-N 3.25Å; Y257-L261 PolarHBondContact O-N 3.31Å; Y257-L261 VanDerWaalsContact O-N 3.1Å; Y257-A292 HydrophobicContact CD2-CB 4.33Å; Y257-A292 HydrophobicContact CE2-CB 3.79Å; Y257-A293 HydrophobicContact CD2-CB 3.9Å
258L98.4Very high97.6Very high13 Ų1319.1 Ų19.17%0.0689%0.09CC..Hα-helixtrans-61-46.1169.2176.559.9000111W248 C254 P255 E260 L261 L262 F314 L315 P316W248-L258 HydrophobicContact CE3-CD2 3.94Å; W248-L258 HydrophobicContact CZ3-CD2 3.59Å; C254-L258 PolarHBondContact O-N 3.47Å; P255-L258 WeakPolarHBondContact O-CB 3.45Å; P255-L258 PolarHBondContact O-N 2.77Å; L258-E260 VanDerWaalsContact C-N 3.31Å; L258-E260 PolarHBondContact O-N 3.13Å; L258-L261 WeakPolarHBondContact O-CB 3.4Å; L258-L261 PolarHBondContact O-N 3.29Å; L258-L262 HydrophobicContact CD1-CD1 4.49Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.29Å; L258-L262 WeakPolarHBondContact O-CG 3.47Å; L258-L262 PolarHBondContact O-N 3.09Å; L258-F314 HydrophobicContact CB-CD2 3.97Å; L258-F314 HydrophobicContact CD1-CD2 4.41Å; L258-L315 HydrophobicContact CD1-CD2 3.79Å; L258-P316 HydrophobicContact CD2-CG 4.39Å
259A98.5Very high97.5Very high0 Ų016.6 Ų16.60%08%0.083CC..Hα-helixtrans-60.4-40.3177.400000112.1A214 L217 Q218 P255 Y257 L262 I263A214-A259 WeakPolarHBondContact O-CB 3.42Å; L217-A259 HydrophobicContact CB-CB 4.2Å; L217-A259 HydrophobicContact CD2-CB 4.07Å; L217-A259 HydrophobicContact CG-CB 3.97Å; Q218-A259 HydrophobicContact CB-CB 3.56Å; Q218-A259 HydrophobicContact CG-CB 4.17Å; P255-A259 WeakPolarHBondContact O-CB 3.07Å; P255-A259 PolarHBondContact O-N 3.09Å; Y257-A259 VanDerWaalsContact C-N 3.33Å; A259-L262 PolarHBondContact O-N 2.82Å; A259-I263 WeakPolarHBondContact O-CG1 3.31Å; A259-I263 PolarHBondContact O-N 2.75Å
260E98.6Very high97.1Very high12 Ų1216.6 Ų16.66%0.0568%0.083CC..Hα-helixtrans-59.3-47.9173.5-167.973.8178.300111.2H141 Q218 H256 Y257 L258 L262 I263 Y264 V285H141-E260 IonicContact CE1-OE1 3.99Å; H141-E260 IonicContact CE1-OE2 3.58Å; H141-E260 PolarHBondContact CE1-OE2 3.35Å; H141-E260 IonicContact NE2-OE1 3.72Å; H141-E260 PolarHBondContact NE2-OE1 3.15Å; H141-E260 IonicContact NE2-OE2 2.7Å; H141-E260 PolarHBondContact NE2-OE2 3.41Å; Q218-E260 PolarHBondContact NE2-OE2 3.43Å; Q218-E260 PolarHBondContact OE1-OE2 2.75Å; H256-E260 PolarHBondContact O-N 2.83Å; H256-E260 VanDerWaalsContact O-N 3.15Å; Y257-E260 PolarHBondContact O-N 3.25Å; L258-E260 VanDerWaalsContact C-N 3.31Å; L258-E260 PolarHBondContact O-N 3.13Å; E260-L262 VanDerWaalsContact C-N 3.3Å; E260-L262 PolarHBondContact O-N 3.41Å; E260-I263 WeakPolarHBondContact O-CB 3.47Å; E260-I263 PolarHBondContact O-N 2.94Å; E260-I263 VanDerWaalsContact O-N 3.14Å; E260-Y264 HydrophobicContact CG-CD2 4.31Å; E260-Y264 HydrophobicContact CG-CE2 4.09Å; E260-Y264 VanDerWaalsContact O-CD2 3.31Å; E260-Y264 WeakPolarHBondContact O-CD2 3.4Å; E260-Y264 PolarHBondContact O-N 3.45Å; E260-Y264 WeakPolarHBondContact OE1-CE2 3.24Å; E260-V285 HydrophobicContact CG-CG1 4.44Å
261L98.7Very high96.6Very high15 Ų1513.7 Ų13.78%0.0797%0.071CC..Hα-helixtrans-55.8-46176.3174.563000111.7Y257 L258 I263 Y264 V265 V282 V285 L286 F314Y257-L261 PolarHBondContact O-N 3.31Å; Y257-L261 VanDerWaalsContact O-N 3.1Å; L258-L261 WeakPolarHBondContact O-CB 3.4Å; L258-L261 PolarHBondContact O-N 3.29Å; L261-I263 VanDerWaalsContact C-N 3.31Å; L261-I263 PolarHBondContact O-N 3.32Å; L261-Y264 PolarHBondContact O-N 3.49Å; L261-Y264 VanDerWaalsContact O-N 3.16Å; L261-V265 HydrophobicContact CD1-CG2 4.37Å; L261-V265 HydrophobicContact CG-CG2 4.48Å; L261-V265 WeakPolarHBondContact O-CG2 3.25Å; L261-V265 PolarHBondContact O-N 2.86Å; L261-V282 HydrophobicContact CD1-CG1 4.1Å; L261-V285 HydrophobicContact CD1-CG1 4.39Å; L261-L286 HydrophobicContact CD1-CB 3.9Å; L261-L286 HydrophobicContact CD1-CD1 4.43Å; L261-L286 HydrophobicContact CD2-CD1 3.59Å; L261-F314 HydrophobicContact CD2-CE2 4.06Å
262L98.6Very high95.6Very high45 Ų4511.3 Ų11.324%0.2366%0.061CC..Hα-helixtrans-65.7-31.9179.6-66.9177.6000112.9A214 L258 A259 E260 S266A214-L262 HydrophobicContact CB-CB 3.66Å; L258-L262 HydrophobicContact CD1-CD1 4.49Å; L258-L262 HydrophobicContact CD1-CG 4.4Å; L258-L262 HydrophobicContact CG-CD1 4.29Å; L258-L262 WeakPolarHBondContact O-CG 3.47Å; L258-L262 PolarHBondContact O-N 3.09Å; A259-L262 PolarHBondContact O-N 2.82Å; E260-L262 VanDerWaalsContact C-N 3.3Å; E260-L262 PolarHBondContact O-N 3.41Å; L262-S266 WeakPolarHBondContact O-CB 3.37Å; L262-S266 PolarHBondContact O-N 3.31Å
263I98.8Very high94.5Very high0 Ų013.8 Ų13.80%08%0.078CC..Hα-helixtrans-61.3-46.9171.5-71166.6000109.7R144 F211 A214 A259 E260 L261 S266 L267R144-I263 VanDerWaalsContact NH2-CD1 3.35Å; F211-I263 HydrophobicContact CD2-CG2 3.92Å; F211-I263 HydrophobicContact CE2-CG2 3.74Å; A214-I263 HydrophobicContact CB-CG1 3.7Å; A259-I263 WeakPolarHBondContact O-CG1 3.31Å; A259-I263 PolarHBondContact O-N 2.75Å; E260-I263 WeakPolarHBondContact O-CB 3.47Å; E260-I263 PolarHBondContact O-N 2.94Å; E260-I263 VanDerWaalsContact O-N 3.14Å; L261-I263 VanDerWaalsContact C-N 3.31Å; L261-I263 PolarHBondContact O-N 3.32Å; I263-S266 WeakPolarHBondContact O-CB 3.45Å; I263-S266 PolarHBondContact O-N 3.18Å; I263-S266 PolarHBondContact O-OG 3.1Å; I263-L267 WeakPolarHBondContact O-CG 3.07Å; I263-L267 PolarHBondContact O-N 2.96Å; I263-L267 VanDerWaalsContact O-N 3.11Å
264Y98.4Very high93.2Very high1 Ų121.9 Ų21.90%0.00412%0.116CC..Hα-helixtrans-69.1-37.5179.9-79.8-105.2000112.9Y171 L175 E260 L261 S266 L267 G268 W278 V281 V285Y171-Y264 WeakPolarHBondContact OH-CE1 3.32Å; Y171-Y264 PolarHBondContact OH-OH 2.96Å; L175-Y264 HydrophobicContact CD1-CE1 3.94Å; L175-Y264 HydrophobicContact CD2-CE1 3.81Å; L175-Y264 VanDerWaalsContact CD2-OH 3.3Å; L175-Y264 WeakPolarHBondContact CD2-OH 3.09Å; E260-Y264 HydrophobicContact CG-CD2 4.31Å; E260-Y264 HydrophobicContact CG-CE2 4.09Å; E260-Y264 VanDerWaalsContact O-CD2 3.31Å; E260-Y264 WeakPolarHBondContact O-CD2 3.4Å; E260-Y264 PolarHBondContact O-N 3.45Å; E260-Y264 WeakPolarHBondContact OE1-CE2 3.24Å; L261-Y264 PolarHBondContact O-N 3.49Å; L261-Y264 VanDerWaalsContact O-N 3.16Å; Y264-S266 VanDerWaalsContact C-N 3.29Å; Y264-S266 PolarHBondContact O-N 3Å; Y264-L267 PolarHBondContact O-N 3.03Å; Y264-G268 PolarHBondContact O-N 3.27Å; Y264-G268 VanDerWaalsContact O-N 3.08Å; Y264-W278 HydrophobicContact CD1-CZ2 4.3Å; Y264-W278 PolarHBondContact O-NE1 3.03Å; Y264-W278 VanDerWaalsContact O-NE1 3.1Å; Y264-V281 HydrophobicContact CD1-CG1 3.67Å; Y264-V281 HydrophobicContact CE1-CG1 3.82Å; Y264-V285 HydrophobicContact CD1-CG2 3.69Å; Y264-V285 HydrophobicContact CD2-CG1 4.24Å; Y264-V285 HydrophobicContact CD2-CG2 4.15Å; Y264-V285 HydrophobicContact CE1-CG2 3.85Å; Y264-V285 HydrophobicContact CE2-CG2 4.32Å; Y264-V285 HydrophobicContact CG-CB 4.43Å; Y264-V285 HydrophobicContact CG-CG1 4.38Å; Y264-V285 HydrophobicContact CG-CG2 3.83Å
265V98.2Very high92.3Very high32 Ų3222.2 Ų22.219%0.19412%0.119CC..Hα-helixtrans-58.5-44.3171.1170.70000110.2L210 L261 L267 G268 I269 W279 V282L210-V265 HydrophobicContact CD2-CG1 4.1Å; L261-V265 HydrophobicContact CD1-CG2 4.37Å; L261-V265 HydrophobicContact CG-CG2 4.48Å; L261-V265 WeakPolarHBondContact O-CG2 3.25Å; L261-V265 PolarHBondContact O-N 2.86Å; V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 2.65Å; V265-G268 WeakPolarHBondContact O-CA 3.2Å; V265-G268 PolarHBondContact O-N 3.38Å; V265-I269 HydrophobicContact CG1-CD1 4.14Å; V265-I269 WeakPolarHBondContact O-CG1 3.37Å; V265-I269 PolarHBondContact O-N 2.98Å; V265-W279 HydrophobicContact CG1-CH2 4.37Å; V265-W279 HydrophobicContact CG1-CZ3 4.38Å; V265-V282 HydrophobicContact CG2-CG1 3.69Å
266S98Very high91.8Very high0 Ų026.1 Ų26.10%014%0.139CC..Hα-helixtrans-60.7-40.4178.778.80000112.5G207 F211 L262 I263 Y264 G268 I269 V270G207-S266 WeakPolarHBondContact O-CB 3.46Å; F211-S266 WeakPolarHBondContact CA-OG 3.45Å; F211-S266 VanDerWaalsContact CB-OG 3.27Å; F211-S266 WeakPolarHBondContact CB-OG 3.17Å; L262-S266 WeakPolarHBondContact O-CB 3.37Å; L262-S266 PolarHBondContact O-N 3.31Å; I263-S266 WeakPolarHBondContact O-CB 3.45Å; I263-S266 PolarHBondContact O-N 3.18Å; I263-S266 PolarHBondContact O-OG 3.1Å; Y264-S266 VanDerWaalsContact C-N 3.29Å; Y264-S266 PolarHBondContact O-N 3Å; S266-G268 VanDerWaalsContact C-N 3.28Å; S266-G268 PolarHBondContact O-N 3.22Å; S266-I269 PolarHBondContact O-N 3.14Å; S266-V270 WeakPolarHBondContact O-CG2 3.42Å; S266-V270 PolarHBondContact O-N 3.11Å
267L95.9Very high91.4Very high0 Ų025.2 Ų25.20%014%0.135CC..Hα-helixtrans-64.8-33.1174.8-63.1176.7000111.9V134 L137 L138 F211 I263 Y264 V265 V270 S271 W278V134-L267 HydrophobicContact CG1-CB 4.35Å; V134-L267 HydrophobicContact CG1-CD2 4.35Å; L137-L267 HydrophobicContact CB-CD2 3.45Å; L137-L267 VanDerWaalsContact CB-CD2 3.45Å; L137-L267 HydrophobicContact CD1-CD2 3.95Å; L137-L267 HydrophobicContact CG-CD2 4.37Å; L138-L267 HydrophobicContact CB-CD1 4.5Å; L138-L267 HydrophobicContact CD1-CD1 4.49Å; F211-L267 HydrophobicContact CD2-CD2 4.19Å; F211-L267 HydrophobicContact CE2-CD2 4.34Å; I263-L267 WeakPolarHBondContact O-CG 3.07Å; I263-L267 PolarHBondContact O-N 2.96Å; I263-L267 VanDerWaalsContact O-N 3.11Å; Y264-L267 PolarHBondContact O-N 3.03Å; V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 2.65Å; L267-V270 PolarHBondContact O-N 3.37Å; L267-S271 PolarHBondContact O-N 2.93Å; L267-S271 PolarHBondContact O-OG 3.03Å; L267-W278 HydrophobicContact CB-CZ2 3.43Å; L267-W278 VanDerWaalsContact CB-CZ2 3.43Å; L267-W278 HydrophobicContact CD1-CH2 4.21Å; L267-W278 HydrophobicContact CD1-CZ2 3.59Å; L267-W278 HydrophobicContact CG-CZ2 4.13Å
268G93.4Very high91.1Very high0 Ų023.7 Ų23.70%013%0.129CC..Hα-helixtrans-69.5-33.8173.900000113.7Y264 V265 S266 S271 S273 W278Y264-G268 PolarHBondContact O-N 3.27Å; Y264-G268 VanDerWaalsContact O-N 3.08Å; V265-G268 WeakPolarHBondContact O-CA 3.2Å; V265-G268 PolarHBondContact O-N 3.38Å; S266-G268 VanDerWaalsContact C-N 3.28Å; S266-G268 PolarHBondContact O-N 3.22Å; G268-S271 WeakPolarHBondContact CA-OG 3.26Å; G268-S271 PolarHBondContact O-OG 3.41Å; G268-S273 WeakPolarHBondContact O-CA 3.46Å; G268-S273 PolarHBondContact O-N 3.47Å; G268-W278 VanDerWaalsContact N-NE1 3.11Å
269I92.8Very high90.9Very high37 Ų3727.1 Ų27.119%0.1914%0.141CC..Hα-helixtrans-68.2-43.2172-63.7169.2000109.9Y203 L210 V265 S266 S271 G272Y203-I269 WeakPolarHBondContact CD2-O 3.26Å; Y203-I269 WeakPolarHBondContact O-CG2 3.27Å; L210-I269 HydrophobicContact CD2-CD1 3.88Å; V265-I269 HydrophobicContact CG1-CD1 4.14Å; V265-I269 WeakPolarHBondContact O-CG1 3.37Å; V265-I269 PolarHBondContact O-N 2.98Å; S266-I269 PolarHBondContact O-N 3.14Å; I269-S271 VanDerWaalsContact C-N 3.29Å; I269-S271 PolarHBondContact O-N 3.45Å; I269-G272 PolarHBondContact O-N 3.11Å
270V90.8Very high90.8Very high0 Ų027.7 Ų27.70%014%0.144CC..Hα-helixtrans-62.6-35.4177.31760000111.8L133 V134 L137 Y204 S266 L267 G272L133-V270 HydrophobicContact CB-CG1 4.07Å; L133-V270 HydrophobicContact CD2-CG1 3.6Å; L133-V270 HydrophobicContact CG-CG1 3.71Å; V134-V270 HydrophobicContact CG2-CB 3.96Å; V134-V270 HydrophobicContact CG2-CG1 3.67Å; L137-V270 HydrophobicContact CD1-CG1 4.39Å; L137-V270 HydrophobicContact CD1-CG2 3.89Å; Y204-V270 HydrophobicContact CD1-CG1 4.28Å; Y204-V270 WeakPolarHBondContact CD1-O 3.47Å; Y204-V270 VanDerWaalsContact CE1-O 3.31Å; Y204-V270 WeakPolarHBondContact CE1-O 3.29Å; S266-V270 WeakPolarHBondContact O-CG2 3.42Å; S266-V270 PolarHBondContact O-N 3.11Å; L267-V270 PolarHBondContact O-N 3.37Å; V270-G272 PolarHBondContact O-N 2.68Å; V270-G272 VanDerWaalsContact O-N 3.16Å
271S84.3Confident90.7Very high14 Ų1427.1 Ų27.110%0.09814%0.141CC..THydrogen-bonded Turntrans-74.35.6175660000114.1L267 G268 I269L267-S271 PolarHBondContact O-N 2.93Å; L267-S271 PolarHBondContact O-OG 3.03Å; G268-S271 WeakPolarHBondContact CA-OG 3.26Å; G268-S271 PolarHBondContact O-OG 3.41Å; I269-S271 VanDerWaalsContact C-N 3.29Å; I269-S271 PolarHBondContact O-N 3.45Å
272G76.3Confident90.7Very high12 Ų1227 Ų2712%0.12414%0.142CC..THydrogen-bonded Turntrans88.213.4175.300000114.5I269 V270 H274I269-G272 PolarHBondContact O-N 3.11Å; V270-G272 PolarHBondContact O-N 2.68Å; V270-G272 VanDerWaalsContact O-N 3.16Å; G272-H274 PolarHBondContact O-CD2 3.23Å; G272-H274 PolarHBondContact O-N 2.97Å
273S73.9Confident90.7Very high52 Ų5227.7 Ų27.736%0.36415%0.145SC..SBendtrans60.5-4.3175.2-58.30000117.1G268 W279G268-S273 WeakPolarHBondContact O-CA 3.46Å; G268-S273 PolarHBondContact O-N 3.47Å; S273-W279 PolarHBondContact O-NE1 3.04Å
274H70.9Confident90.7Very high172 Ų17227.9 Ų27.980%0.79615%0.146SC*.  trans-98.6-10.1180-61.7-65000113.5G272 L276G272-H274 PolarHBondContact O-CD2 3.23Å; G272-H274 PolarHBondContact O-N 2.97Å; H274-L276 PolarHBondContact O-N 2.77Å
275A79.2Confident90.7Very high7 Ų728 Ų286%0.05815%0.147CC..  trans-73.294.6178.600000111.3I186 T277 W278 W279I186-A275 HydrophobicContact CD1-CB 4.42Å; A275-T277 VanDerWaalsContact C-N 3.27Å; A275-T277 PolarHBondContact O-N 2.79Å; A275-W278 HydrophobicContact CB-CB 4.17Å; A275-W278 PolarHBondContact O-N 3.21Å; A275-W278 VanDerWaalsContact O-N 3.12Å; A275-W279 PolarHBondContact O-N 3.11Å
276L87Confident90.7Very high82 Ų8228.8 Ų28.843%0.42915%0.15SC..Hα-helixtrans-50.3-48.1177.717662.6000111.7F7 H274 W278 W279 L280F7-L276 HydrophobicContact CE1-CD2 4.21Å; F7-L276 HydrophobicContact CE2-CD2 4.46Å; F7-L276 HydrophobicContact CZ-CD2 4.1Å; H274-L276 PolarHBondContact O-N 2.77Å; L276-W278 PolarHBondContact O-N 3.34Å; L276-W279 PolarHBondContact O-N 3.4Å; L276-L280 HydrophobicContact CD1-CG 4.43Å; L276-L280 HydrophobicContact CG-CD1 4.28Å; L276-L280 WeakPolarHBondContact O-CG 3.37Å; L276-L280 PolarHBondContact O-N 2.89Å
277T89.9Confident90.7Very high1 Ų130.6 Ų30.61%0.00616%0.157CC..Hα-helixtrans-52.3-44.3-179.7-43.60000112I10 D11 T178 A275 L280 V281I10-T277 HydrophobicContact CB-CG2 4.36Å; I10-T277 HydrophobicContact CG1-CG2 3.82Å; I10-T277 HydrophobicContact CG2-CG2 3.74Å; D11-T277 WeakPolarHBondContact OD1-CA 3.32Å; D11-T277 WeakPolarHBondContact OD1-CB 3.43Å; D11-T277 VanDerWaalsContact OD1-CG2 3.32Å; D11-T277 WeakPolarHBondContact OD1-CG2 3.46Å; D11-T277 PolarHBondContact OD1-OG1 3.05Å; T178-T277 HydrophobicContact CG2-CG2 3.68Å; A275-T277 VanDerWaalsContact C-N 3.27Å; A275-T277 PolarHBondContact O-N 2.79Å; T277-L280 WeakPolarHBondContact O-CB 3.2Å; T277-L280 PolarHBondContact O-N 3Å; T277-V281 PolarHBondContact O-N 3.19Å; T277-V281 VanDerWaalsContact O-N 3.15Å
278W92.6Very high90.8Very high2 Ų232.4 Ų32.41%0.00817%0.167CC..Hα-helixtrans-70.1-36.3-179-164.8-90.3000112.3V134 L175 T178 V179 Y264 L267 G268 A275 L276 L280 V281 V282V134-W278 HydrophobicContact CG1-CH2 4.09Å; V134-W278 HydrophobicContact CG1-CZ2 4.32Å; V134-W278 HydrophobicContact CG1-CZ3 4.39Å; L175-W278 HydrophobicContact CD1-CH2 3.69Å; L175-W278 HydrophobicContact CD1-CZ3 3.89Å; L175-W278 HydrophobicContact CG-CH2 4.34Å; T178-W278 HydrophobicContact CG2-CE3 4.22Å; T178-W278 HydrophobicContact CG2-CZ3 4.43Å; V179-W278 HydrophobicContact CG2-CE3 4.4Å; V179-W278 HydrophobicContact CG2-CH2 3.9Å; V179-W278 HydrophobicContact CG2-CZ3 3.46Å; V179-W278 VanDerWaalsContact CG2-CZ3 3.46Å; Y264-W278 HydrophobicContact CD1-CZ2 4.3Å; Y264-W278 PolarHBondContact O-NE1 3.03Å; Y264-W278 VanDerWaalsContact O-NE1 3.1Å; L267-W278 HydrophobicContact CB-CZ2 3.43Å; L267-W278 VanDerWaalsContact CB-CZ2 3.43Å; L267-W278 HydrophobicContact CD1-CH2 4.21Å; L267-W278 HydrophobicContact CD1-CZ2 3.59Å; L267-W278 HydrophobicContact CG-CZ2 4.13Å; G268-W278 VanDerWaalsContact N-NE1 3.11Å; A275-W278 HydrophobicContact CB-CB 4.17Å; A275-W278 PolarHBondContact O-N 3.21Å; A275-W278 VanDerWaalsContact O-N 3.12Å; L276-W278 PolarHBondContact O-N 3.34Å; W278-L280 VanDerWaalsContact C-N 3.26Å; W278-L280 PolarHBondContact O-N 2.9Å; W278-V281 HydrophobicContact CE3-CG2 4.34Å; W278-V281 WeakPolarHBondContact O-CA 3.5Å; W278-V281 VanDerWaalsContact O-CB 3.25Å; W278-V281 WeakPolarHBondContact O-CB 3.45Å; W278-V281 PolarHBondContact O-N 2.9Å; W278-V281 VanDerWaalsContact O-N 3.07Å; W278-V282 PolarHBondContact O-N 3.44Å
279W94.5Very high91Very high85 Ų8533.5 Ų33.532%0.32217%0.172SC..Hα-helixtrans-67.3-28.1173.5-70115.9000112.8V265 S273 A275 L276 V281 V282 L283V265-W279 HydrophobicContact CG1-CH2 4.37Å; V265-W279 HydrophobicContact CG1-CZ3 4.38Å; S273-W279 PolarHBondContact O-NE1 3.04Å; A275-W279 PolarHBondContact O-N 3.11Å; L276-W279 PolarHBondContact O-N 3.4Å; W279-V281 VanDerWaalsContact C-N 3.35Å; W279-V282 HydrophobicContact CE3-CB 3.96Å; W279-V282 HydrophobicContact CE3-CG1 4.08Å; W279-V282 HydrophobicContact CE3-CG2 3.84Å; W279-V282 HydrophobicContact CZ3-CB 4.46Å; W279-V282 HydrophobicContact CZ3-CG1 4.22Å; W279-V282 HydrophobicContact CZ3-CG2 4.13Å; W279-V282 WeakPolarHBondContact O-CB 3.28Å; W279-V282 PolarHBondContact O-N 2.89Å; W279-L283 WeakPolarHBondContact O-CB 3.1Å; W279-L283 PolarHBondContact O-N 3.47Å
280L96Very high91.3Very high12 Ų1232 Ų326%0.06317%0.165CC..Hα-helixtrans-66.9-35.9168.8-62.3172.4000111.8F7 D11 W14 L15 L276 T277 W278 L283 Y284F7-L280 HydrophobicContact CE1-CD1 4.12Å; D11-L280 HydrophobicContact CB-CD1 3.66Å; D11-L280 WeakPolarHBondContact O-CD1 3.33Å; W14-L280 HydrophobicContact CB-CB 3.65Å; L15-L280 HydrophobicContact CB-CD1 4.4Å; L15-L280 HydrophobicContact CB-CD2 4.19Å; L15-L280 HydrophobicContact CD1-CD2 4.05Å; L276-L280 HydrophobicContact CD1-CG 4.43Å; L276-L280 HydrophobicContact CG-CD1 4.28Å; L276-L280 WeakPolarHBondContact O-CG 3.37Å; L276-L280 PolarHBondContact O-N 2.89Å; T277-L280 WeakPolarHBondContact O-CB 3.2Å; T277-L280 PolarHBondContact O-N 3Å; W278-L280 VanDerWaalsContact C-N 3.26Å; W278-L280 PolarHBondContact O-N 2.9Å; L280-L283 PolarHBondContact O-N 3.46Å; L280-Y284 WeakPolarHBondContact O-CB 3.17Å; L280-Y284 PolarHBondContact O-N 2.81Å
281V97.2Very high91.6Very high0 Ų032.2 Ų32.20%017%0.166CC..Hα-helixtrans-60.7-47.3169.1-175.40000110.5W14 L175 T178 Y264 T277 W278 W279 L283 Y284 V285W14-V281 HydrophobicContact CD2-CG2 3.76Å; W14-V281 HydrophobicContact CE3-CG2 4.31Å; W14-V281 HydrophobicContact CG-CG2 4.03Å; W14-V281 HydrophobicContact CH2-CG1 4.43Å; W14-V281 HydrophobicContact CZ2-CG2 3.98Å; W14-V281 HydrophobicContact CZ3-CG1 4.49Å; L175-V281 HydrophobicContact CD1-CG1 3.74Å; L175-V281 HydrophobicContact CD1-CG2 4.5Å; T178-V281 HydrophobicContact CG2-CG2 3.82Å; Y264-V281 HydrophobicContact CD1-CG1 3.67Å; Y264-V281 HydrophobicContact CE1-CG1 3.82Å; T277-V281 PolarHBondContact O-N 3.19Å; T277-V281 VanDerWaalsContact O-N 3.15Å; W278-V281 HydrophobicContact CE3-CG2 4.34Å; W278-V281 WeakPolarHBondContact O-CA 3.5Å; W278-V281 VanDerWaalsContact O-CB 3.25Å; W278-V281 WeakPolarHBondContact O-CB 3.45Å; W278-V281 PolarHBondContact O-N 2.9Å; W278-V281 VanDerWaalsContact O-N 3.07Å; W279-V281 VanDerWaalsContact C-N 3.35Å; V281-L283 VanDerWaalsContact C-N 3.31Å; V281-L283 PolarHBondContact O-N 2.8Å; V281-Y284 WeakPolarHBondContact O-CB 3.43Å; V281-Y284 PolarHBondContact O-N 3.24Å; V281-V285 HydrophobicContact CG1-CG2 4.44Å; V281-V285 WeakPolarHBondContact O-CG2 3.44Å; V281-V285 PolarHBondContact O-N 2.86Å
282V98.1Very high92.2Very high14 Ų1431.9 Ų31.99%0.08517%0.165CC..Hα-helixtrans-59-43.8177.7173.70000110.9L261 V265 W278 W279 V285 L286L261-V282 HydrophobicContact CD1-CG1 4.1Å; V265-V282 HydrophobicContact CG2-CG1 3.69Å; W278-V282 PolarHBondContact O-N 3.44Å; W279-V282 HydrophobicContact CE3-CB 3.96Å; W279-V282 HydrophobicContact CE3-CG1 4.08Å; W279-V282 HydrophobicContact CE3-CG2 3.84Å; W279-V282 HydrophobicContact CZ3-CB 4.46Å; W279-V282 HydrophobicContact CZ3-CG1 4.22Å; W279-V282 HydrophobicContact CZ3-CG2 4.13Å; W279-V282 WeakPolarHBondContact O-CB 3.28Å; W279-V282 PolarHBondContact O-N 2.89Å; V282-V285 PolarHBondContact O-N 2.77Å; V282-L286 WeakPolarHBondContact O-CB 3.36Å; V282-L286 PolarHBondContact O-N 3.41Å
283L98.2Very high93.2Very high59 Ų5931.3 Ų31.331%0.30916%0.159SC..Hα-helixtrans-62.9-42.5177.5-172.565.4000111.7A18 W279 L280 V281 L286 F287A18-L283 HydrophobicContact CB-CB 4.39Å; A18-L283 HydrophobicContact CB-CD2 4.12Å; A18-L283 HydrophobicContact CB-CG 4.02Å; W279-L283 WeakPolarHBondContact O-CB 3.1Å; W279-L283 PolarHBondContact O-N 3.47Å; L280-L283 PolarHBondContact O-N 3.46Å; V281-L283 VanDerWaalsContact C-N 3.31Å; V281-L283 PolarHBondContact O-N 2.8Å; L283-L286 HydrophobicContact CD1-CD2 4.4Å; L283-L286 WeakPolarHBondContact O-CB 3.39Å; L283-L286 PolarHBondContact O-N 3.2Å; L283-F287 HydrophobicContact CD1-CD2 4.24Å; L283-F287 HydrophobicContact CD1-CE2 3.46Å; L283-F287 VanDerWaalsContact CD1-CE2 3.46Å; L283-F287 HydrophobicContact CD1-CZ 3.62Å; L283-F287 HydrophobicContact CD2-CE2 4.17Å; L283-F287 HydrophobicContact CG-CD2 4.1Å; L283-F287 HydrophobicContact CG-CE2 3.57Å; L283-F287 HydrophobicContact CG-CZ 4.26Å; L283-F287 WeakPolarHBondContact O-CD2 3.3Å; L283-F287 PolarHBondContact O-N 2.95Å; L283-F287 VanDerWaalsContact O-N 3.14Å
284Y98.4Very high94.4Very high4 Ų429.3 Ų29.32%0.01614%0.144CC..Hα-helixtrans-58.9-48.7172160.7-95.6000111.6W14 L17 F21 F167 Y171 L280 V281 L286 F287 N288W14-Y284 HydrophobicContact CE3-CD1 4.13Å; W14-Y284 HydrophobicContact CE3-CG 4.04Å; W14-Y284 AromaticContact CZ3-CD1 3.66Å; W14-Y284 HydrophobicContact CZ3-CD1 3.66Å; W14-Y284 HydrophobicContact CZ3-CE1 4.12Å; W14-Y284 AromaticContact CZ3-CG 4Å; W14-Y284 HydrophobicContact CZ3-CG 4Å; L17-Y284 HydrophobicContact CB-CD2 3.6Å; L17-Y284 HydrophobicContact CB-CE2 4.07Å; L17-Y284 HydrophobicContact CB-CG 4.41Å; F21-Y284 HydrophobicContact CD2-CD2 4.09Å; F21-Y284 AromaticContact CD2-CE2 3.57Å; F21-Y284 HydrophobicContact CD2-CE2 3.57Å; F21-Y284 HydrophobicContact CE2-CD2 4.49Å; F21-Y284 AromaticContact CE2-CE2 3.56Å; F21-Y284 HydrophobicContact CE2-CE2 3.56Å; F21-Y284 HydrophobicContact CG-CE2 4.39Å; F21-Y284 HydrophobicContact CZ-CE2 4.36Å; F167-Y284 WeakPolarHBondContact CE1-OH 3.3Å; F167-Y284 HydrophobicContact CZ-CE2 4.01Å; F167-Y284 AromaticContact CZ-CZ 3.86Å; F167-Y284 WeakPolarHBondContact CZ-OH 3.28Å; Y171-Y284 AromaticContact CD2-CE1 3.94Å; Y171-Y284 HydrophobicContact CD2-CE1 3.94Å; Y171-Y284 AromaticContact CE2-CD1 3.95Å; Y171-Y284 HydrophobicContact CE2-CD1 3.95Å; Y171-Y284 AromaticContact CE2-CE1 3.35Å; Y171-Y284 HydrophobicContact CE2-CE1 3.35Å; L280-Y284 WeakPolarHBondContact O-CB 3.17Å; L280-Y284 PolarHBondContact O-N 2.81Å; V281-Y284 WeakPolarHBondContact O-CB 3.43Å; V281-Y284 PolarHBondContact O-N 3.24Å; Y284-L286 VanDerWaalsContact C-N 3.31Å; Y284-L286 PolarHBondContact O-N 3.17Å; Y284-F287 PolarHBondContact O-N 3.48Å; Y284-N288 HydrophobicContact CE2-CB 4.28Å; Y284-N288 WeakPolarHBondContact O-CB 3.3Å; Y284-N288 PolarHBondContact O-N 3.34Å; Y284-N288 PolarHBondContact OH-ND2 2.93Å
285V98.4Very high95.6Very high3 Ų321.2 Ų21.22%0.01811%0.106CC..Hα-helixtrans-61.2-42.3178.8173.70000110.2E260 L261 Y264 V281 V282 F287 N288 Q289E260-V285 HydrophobicContact CG-CG1 4.44Å; L261-V285 HydrophobicContact CD1-CG1 4.39Å; Y264-V285 HydrophobicContact CD1-CG2 3.69Å; Y264-V285 HydrophobicContact CD2-CG1 4.24Å; Y264-V285 HydrophobicContact CD2-CG2 4.15Å; Y264-V285 HydrophobicContact CE1-CG2 3.85Å; Y264-V285 HydrophobicContact CE2-CG2 4.32Å; Y264-V285 HydrophobicContact CG-CB 4.43Å; Y264-V285 HydrophobicContact CG-CG1 4.38Å; Y264-V285 HydrophobicContact CG-CG2 3.83Å; V281-V285 HydrophobicContact CG1-CG2 4.44Å; V281-V285 WeakPolarHBondContact O-CG2 3.44Å; V281-V285 PolarHBondContact O-N 2.86Å; V282-V285 PolarHBondContact O-N 2.77Å; V285-F287 PolarHBondContact O-N 2.86Å; V285-N288 PolarHBondContact O-N 2.89Å; V285-Q289 HydrophobicContact CG1-CG 3.83Å; V285-Q289 VanDerWaalsContact O-CB 3.24Å; V285-Q289 WeakPolarHBondContact O-CB 3.25Å; V285-Q289 WeakPolarHBondContact O-CG 3.37Å; V285-Q289 PolarHBondContact O-N 2.83Å
286L98.5Very high96.4Very high49 Ų4921 Ų2126%0.25711%0.105SC..Hα-helixtrans-54.2-52.8176.2173.764.6000111.6L261 V282 L283 Y284 A290 F314L261-L286 HydrophobicContact CD1-CB 3.9Å; L261-L286 HydrophobicContact CD1-CD1 4.43Å; L261-L286 HydrophobicContact CD2-CD1 3.59Å; V282-L286 WeakPolarHBondContact O-CB 3.36Å; V282-L286 PolarHBondContact O-N 3.41Å; L283-L286 HydrophobicContact CD1-CD2 4.4Å; L283-L286 WeakPolarHBondContact O-CB 3.39Å; L283-L286 PolarHBondContact O-N 3.2Å; Y284-L286 VanDerWaalsContact C-N 3.31Å; Y284-L286 PolarHBondContact O-N 3.17Å; L286-A290 WeakPolarHBondContact O-CB 3.41Å; L286-A290 PolarHBondContact O-N 3.24Å; L286-F314 HydrophobicContact CD1-CZ 4Å
287F98.4Very high96.8Very high37 Ų3718.6 Ų18.616%0.1629%0.091CC..Hα-helixtrans-72.6-37-176.7-62.7-42.2000113.3A18 F21 L22 L283 Y284 V285 A290 L291A18-F287 HydrophobicContact CB-CD2 4.11Å; A18-F287 HydrophobicContact CB-CE2 4.48Å; A18-F287 VanDerWaalsContact O-CD2 3.25Å; A18-F287 WeakPolarHBondContact O-CD2 3.18Å; F21-F287 HydrophobicContact CB-CB 3.86Å; L22-F287 HydrophobicContact CB-CB 4.48Å; L22-F287 HydrophobicContact CB-CD1 4.21Å; L22-F287 HydrophobicContact CB-CD2 3.74Å; L22-F287 HydrophobicContact CB-CE1 4.38Å; L22-F287 HydrophobicContact CB-CE2 3.88Å; L22-F287 HydrophobicContact CB-CG 3.9Å; L22-F287 HydrophobicContact CB-CZ 4.21Å; L22-F287 HydrophobicContact CD1-CD1 3.94Å; L22-F287 HydrophobicContact CD1-CE1 3.7Å; L22-F287 HydrophobicContact CD1-CG 4.49Å; L22-F287 HydrophobicContact CD1-CZ 4.01Å; L22-F287 HydrophobicContact CD2-CE1 4.4Å; L22-F287 HydrophobicContact CD2-CE2 4Å; L22-F287 HydrophobicContact CD2-CZ 3.85Å; L22-F287 HydrophobicContact CG-CE1 4.37Å; L22-F287 HydrophobicContact CG-CE2 4.35Å; L22-F287 HydrophobicContact CG-CZ 4.24Å; L283-F287 HydrophobicContact CD1-CD2 4.24Å; L283-F287 HydrophobicContact CD1-CE2 3.46Å; L283-F287 VanDerWaalsContact CD1-CE2 3.46Å; L283-F287 HydrophobicContact CD1-CZ 3.62Å; L283-F287 HydrophobicContact CD2-CE2 4.17Å; L283-F287 HydrophobicContact CG-CD2 4.1Å; L283-F287 HydrophobicContact CG-CE2 3.57Å; L283-F287 HydrophobicContact CG-CZ 4.26Å; L283-F287 WeakPolarHBondContact O-CD2 3.3Å; L283-F287 PolarHBondContact O-N 2.95Å; L283-F287 VanDerWaalsContact O-N 3.14Å; Y284-F287 PolarHBondContact O-N 3.48Å; V285-F287 PolarHBondContact O-N 2.86Å; F287-A290 PolarHBondContact O-N 3.2Å; F287-L291 WeakPolarHBondContact O-CB 3.26Å; F287-L291 PolarHBondContact O-N 3.47Å
288N97.9Very high97.1Very high39 Ų3919.2 Ų19.221%0.2099%0.094CC..Hα-helixtrans-62-47.9173.7179.738.7000111.6F21 Y284 V285 L291 A292F21-N288 HydrophobicContact CD1-CB 3.85Å; F21-N288 HydrophobicContact CE1-CB 4.05Å; F21-N288 WeakPolarHBondContact CE1-OD1 3.36Å; F21-N288 HydrophobicContact CG-CB 4.18Å; Y284-N288 HydrophobicContact CE2-CB 4.28Å; Y284-N288 WeakPolarHBondContact O-CB 3.3Å; Y284-N288 PolarHBondContact O-N 3.34Å; Y284-N288 PolarHBondContact OH-ND2 2.93Å; V285-N288 PolarHBondContact O-N 2.89Å; N288-L291 PolarHBondContact O-N 3.01Å; N288-A292 WeakPolarHBondContact O-CB 3.43Å; N288-A292 PolarHBondContact O-N 3.2Å
289Q98Very high97.2Very high23 Ų2319.7 Ų19.711%0.10710%0.096CC..Hα-helixtrans-67.4-37.1178-66-52.8-20.800112V285 A292 A293 F314V285-Q289 HydrophobicContact CG1-CG 3.83Å; V285-Q289 VanDerWaalsContact O-CB 3.24Å; V285-Q289 WeakPolarHBondContact O-CB 3.25Å; V285-Q289 WeakPolarHBondContact O-CG 3.37Å; V285-Q289 PolarHBondContact O-N 2.83Å; Q289-A292 PolarHBondContact O-N 3.08Å; Q289-A293 WeakPolarHBondContact O-CB 3.29Å; Q289-A293 PolarHBondContact O-N 3.22Å; Q289-F314 HydrophobicContact CB-CE2 4.46Å
290A98.1Very high97.2Very high5 Ų516 Ų164%0.0418%0.082CC..Hα-helixtrans-61.3-45.817500000112.2F25 L286 F287 A293 Q294 F314 L319F25-A290 HydrophobicContact CD2-CB 4.37Å; F25-A290 HydrophobicContact CE2-CB 4.31Å; L286-A290 WeakPolarHBondContact O-CB 3.41Å; L286-A290 PolarHBondContact O-N 3.24Å; F287-A290 PolarHBondContact O-N 3.2Å; A290-A293 PolarHBondContact O-N 3.45Å; A290-Q294 VanDerWaalsContact O-CB 3.24Å; A290-Q294 WeakPolarHBondContact O-CB 3.46Å; A290-Q294 PolarHBondContact O-N 2.68Å; A290-F314 VanDerWaalsContact CA-CE1 3.47Å; A290-F314 HydrophobicContact CB-CE1 3.7Å; A290-F314 HydrophobicContact CB-CZ 4.15Å; A290-L319 HydrophobicContact CB-CD2 3.97Å
291L97.6Very high97.2Very high4 Ų417.7 Ų17.72%0.0219%0.093CC..Hα-helixtrans-62.5-49.6175.817957.4000111.9F21 A24 F25 H28 I51 F287 N288 A293 Q294 L295F21-L291 HydrophobicContact CD1-CD2 4Å; F21-L291 HydrophobicContact CE1-CD2 4.43Å; A24-L291 HydrophobicContact CB-CD2 3.83Å; F25-L291 HydrophobicContact CB-CB 4.49Å; F25-L291 HydrophobicContact CD2-CB 4.33Å; F25-L291 HydrophobicContact CD2-CD1 4.47Å; H28-L291 HydrophobicContact CB-CD1 4.34Å; I51-L291 HydrophobicContact CB-CD2 4.2Å; I51-L291 HydrophobicContact CD1-CD1 4.42Å; I51-L291 HydrophobicContact CG2-CD2 4.22Å; F287-L291 WeakPolarHBondContact O-CB 3.26Å; F287-L291 PolarHBondContact O-N 3.47Å; N288-L291 PolarHBondContact O-N 3.01Å; L291-A293 VanDerWaalsContact C-N 3.34Å; L291-A293 PolarHBondContact O-N 3.29Å; L291-Q294 PolarHBondContact O-N 3.33Å; L291-L295 HydrophobicContact CD1-CD1 4.04Å; L291-L295 HydrophobicContact CD1-CG 4.24Å; L291-L295 HydrophobicContact CG-CD1 4.15Å; L291-L295 VanDerWaalsContact O-CG 3.3Å; L291-L295 WeakPolarHBondContact O-CG 3.22Å; L291-L295 PolarHBondContact O-N 3.42Å
292A97.3Very high97Very high8 Ų822 Ų227%0.06612%0.123CC..Hα-helixtrans-62.6-40.717900000112.4Y53 Y257 N288 Q289 C296Y53-A292 HydrophobicContact CE1-CB 4.44Å; Y257-A292 HydrophobicContact CD2-CB 4.33Å; Y257-A292 HydrophobicContact CE2-CB 3.79Å; N288-A292 WeakPolarHBondContact O-CB 3.43Å; N288-A292 PolarHBondContact O-N 3.2Å; Q289-A292 PolarHBondContact O-N 3.08Å; A292-C296 VanDerWaalsContact O-CB 3.24Å; A292-C296 WeakPolarHBondContact O-CB 3.25Å; A292-C296 PolarHBondContact O-N 2.98Å
293A97.8Very high96.8Very high0 Ų026.5 Ų26.50%014%0.142CC..Hα-helixtrans-62.7-47.4176.800000111.6C254 Y257 Q289 A290 L291 C296 H297 A313 F314C254-A293 HydrophobicContact CB-CB 4.19Å; Y257-A293 HydrophobicContact CD2-CB 3.9Å; Q289-A293 WeakPolarHBondContact O-CB 3.29Å; Q289-A293 PolarHBondContact O-N 3.22Å; A290-A293 PolarHBondContact O-N 3.45Å; L291-A293 VanDerWaalsContact C-N 3.34Å; L291-A293 PolarHBondContact O-N 3.29Å; A293-C296 WeakPolarHBondContact O-CB 3.24Å; A293-C296 PolarHBondContact O-N 3.3Å; A293-H297 WeakPolarHBondContact O-CB 3.27Å; A293-H297 PolarHBondContact O-N 3.49Å; A293-A313 HydrophobicContact CB-CB 4.05Å; A293-F314 HydrophobicContact CB-CB 3.65Å; A293-F314 HydrophobicContact CB-CD1 3.58Å; A293-F314 HydrophobicContact CB-CG 3.82Å
294Q97.4Very high96.6Very high10 Ų1025.5 Ų25.55%0.04714%0.135CC..Hα-helixtrans-59.7-50.8179.3-17965.546.400110.6F25 A290 L291 C296 H297 E298F25-Q294 HydrophobicContact CE2-CB 3.89Å; F25-Q294 HydrophobicContact CE2-CG 4.1Å; A290-Q294 VanDerWaalsContact O-CB 3.24Å; A290-Q294 WeakPolarHBondContact O-CB 3.46Å; A290-Q294 PolarHBondContact O-N 2.68Å; L291-Q294 PolarHBondContact O-N 3.33Å; Q294-C296 PolarHBondContact O-N 3.1Å; Q294-H297 WeakPolarHBondContact O-CB 3.39Å; Q294-H297 PolarHBondContact O-N 3.24Å; Q294-H297 VanDerWaalsContact O-N 3.16Å; Q294-E298 VanDerWaalsContact CG-OE1 3.3Å; Q294-E298 WeakPolarHBondContact CG-OE1 3.33Å; Q294-E298 PolarHBondContact NE2-OE1 2.85Å; Q294-E298 WeakPolarHBondContact O-CG 3.02Å; Q294-E298 PolarHBondContact O-N 2.82Å
295L96.5Very high96.4Very high2 Ų235 Ų351%0.0118%0.179CC..Hα-helixtrans-59.3-35.8177.2-67169.7000112.4H28 I51 R52 T56 L291 F299H28-L295 VanDerWaalsContact CE1-CD2 3.43Å; H28-L295 WeakPolarHBondContact CE1-CD2 3.49Å; I51-L295 HydrophobicContact CB-CD1 4.37Å; I51-L295 HydrophobicContact CD1-CD1 4.37Å; I51-L295 HydrophobicContact CD1-CD2 4.27Å; I51-L295 HydrophobicContact CG1-CD1 4.12Å; I51-L295 VanDerWaalsContact O-CD1 3.28Å; I51-L295 WeakPolarHBondContact O-CD1 3.22Å; R52-L295 HydrophobicContact CG-CD1 4.11Å; R52-L295 HydrophobicContact CG-CD2 4.11Å; T56-L295 HydrophobicContact CG2-CB 4.08Å; L291-L295 HydrophobicContact CD1-CD1 4.04Å; L291-L295 HydrophobicContact CD1-CG 4.24Å; L291-L295 HydrophobicContact CG-CD1 4.15Å; L291-L295 VanDerWaalsContact O-CG 3.3Å; L291-L295 WeakPolarHBondContact O-CG 3.22Å; L291-L295 PolarHBondContact O-N 3.42Å; L295-F299 WeakPolarHBondContact O-CB 3.24Å; L295-F299 PolarHBondContact O-N 3.11Å; L295-F299 VanDerWaalsContact O-N 3.11Å
296C96.3Very high96.1Very high3 Ų339.6 Ų39.62%0.0221%0.212CC..Hα-helixtrans-72.4-40.9177.2-1800000112.6K55 C254 A292 A293 Q294 E298 F299 Y300K55-C296 WeakPolarHBondContact CE-SG 3.2Å; K55-C296 PolarHBondContact NZ-SG 3.43Å; C254-C296 VanDerWaalsContact SG-CB 3.57Å; C254-C296 PolarHBondContact SG-SG 2.83Å; A292-C296 VanDerWaalsContact O-CB 3.24Å; A292-C296 WeakPolarHBondContact O-CB 3.25Å; A292-C296 PolarHBondContact O-N 2.98Å; A293-C296 WeakPolarHBondContact O-CB 3.24Å; A293-C296 PolarHBondContact O-N 3.3Å; Q294-C296 PolarHBondContact O-N 3.1Å; C296-E298 VanDerWaalsContact C-N 3.34Å; C296-F299 WeakPolarHBondContact O-CB 3.25Å; C296-F299 PolarHBondContact O-N 2.84Å; C296-Y300 WeakPolarHBondContact O-CD2 3.45Å; C296-Y300 PolarHBondContact O-N 2.96Å; C296-Y300 VanDerWaalsContact O-N 3.13Å; C296-Y300 VanDerWaalsContact SG-CE2 3.51Å
297H96.8Very high96Very high31 Ų3137.5 Ų37.514%0.14420%0.201CC..Hα-helixtrans-59.5-47.4174.9-178.680.9000110.5S253 A293 Q294 F299 Y300 T301 Y307 R311 A313S253-H297 PolarHBondContact OG-ND1 2.72Å; A293-H297 WeakPolarHBondContact O-CB 3.27Å; A293-H297 PolarHBondContact O-N 3.49Å; Q294-H297 WeakPolarHBondContact O-CB 3.39Å; Q294-H297 PolarHBondContact O-N 3.24Å; Q294-H297 VanDerWaalsContact O-N 3.16Å; H297-F299 VanDerWaalsContact C-N 3.33Å; H297-F299 PolarHBondContact O-N 3.38Å; H297-Y300 WeakPolarHBondContact O-CB 3.49Å; H297-Y300 PolarHBondContact O-N 3.36Å; H297-T301 PolarHBondContact O-N 3.49Å; H297-T301 PolarHBondContact O-OG1 2.94Å; H297-Y307 AromaticContact CE1-CE1 3.91Å; H297-R311 PolarHBondContact CE1-O 3.05Å; H297-A313 HydrophobicContact CB-CB 3.78Å
298E94.8Very high95.8Very high13 Ų1337.3 Ų37.36%0.06120%0.203CC..Hα-helixtrans-63.3-37.6177.7-65.1172.8-175.200113.4H28 R32 Q294 C296 Y300 T301 S302H28-E298 IonicContact CD2-OE1 2.85Å; H28-E298 IonicContact CE1-OE2 2.93Å; H28-E298 IonicContact NE2-OE1 3.69Å; H28-E298 PolarHBondContact NE2-OE1 3.13Å; H28-E298 IonicContact NE2-OE2 2.95Å; H28-E298 PolarHBondContact NE2-OE2 3.17Å; H28-E298 VanDerWaalsContact NE2-OE2 3.11Å; R32-E298 IonicContact CZ-OE1 3.25Å; R32-E298 IonicContact CZ-OE2 3.05Å; R32-E298 IonicContact NE-OE1 2.8Å; R32-E298 PolarHBondContact NE-OE1 3.24Å; R32-E298 IonicContact NE-OE2 3.91Å; R32-E298 IonicContact NH1-OE1 2.83Å; R32-E298 IonicContact NH2-OE1 2.82Å; R32-E298 PolarHBondContact NH2-OE1 3.3Å; R32-E298 IonicContact NH2-OE2 3.21Å; R32-E298 PolarHBondContact NH2-OE2 3.3Å; Q294-E298 VanDerWaalsContact CG-OE1 3.3Å; Q294-E298 WeakPolarHBondContact CG-OE1 3.33Å; Q294-E298 PolarHBondContact NE2-OE1 2.85Å; Q294-E298 WeakPolarHBondContact O-CG 3.02Å; Q294-E298 PolarHBondContact O-N 2.82Å; C296-E298 VanDerWaalsContact C-N 3.34Å; E298-Y300 VanDerWaalsContact C-N 3.28Å; E298-Y300 PolarHBondContact O-N 2.85Å; E298-T301 WeakPolarHBondContact CA-OG1 3.26Å; E298-T301 PolarHBondContact O-OG1 3.41Å; E298-S302 VanDerWaalsContact O-CB 3.3Å; E298-S302 WeakPolarHBondContact O-CB 3.48Å; E298-S302 PolarHBondContact O-N 3.31Å; E298-S302 PolarHBondContact O-OG 2.8Å
299F95.1Very high95.6Very high13 Ų1342.4 Ų42.46%0.05723%0.226CC..Hα-helixtrans-59.7-42172168.7-89.4000111K55 T56 P59 H241 L295 C296 H297 S302 K303 F304K55-F299 HydrophobicContact CB-CD2 4.44Å; K55-F299 HydrophobicContact CB-CE1 4.32Å; K55-F299 HydrophobicContact CB-CE2 4.09Å; K55-F299 HydrophobicContact CB-CZ 4.03Å; K55-F299 HydrophobicContact CD-CD1 3.8Å; K55-F299 HydrophobicContact CD-CE1 3.75Å; K55-F299 HydrophobicContact CD-CG 4.41Å; K55-F299 HydrophobicContact CD-CZ 4.31Å; K55-F299 HydrophobicContact CG-CD1 4.13Å; K55-F299 HydrophobicContact CG-CD2 4.44Å; K55-F299 HydrophobicContact CG-CE1 4.2Å; K55-F299 HydrophobicContact CG-CE2 4.49Å; K55-F299 HydrophobicContact CG-CG 4.25Å; K55-F299 HydrophobicContact CG-CZ 4.37Å; K55-F299 WeakPolarHBondContact O-CD2 3.4Å; K55-F299 WeakPolarHBondContact O-CE2 2.91Å; T56-F299 HydrophobicContact CG2-CB 4.34Å; P59-F299 HydrophobicContact CG-CD2 4.31Å; H241-F299 HydrophobicContact CB-CE1 4.22Å; H241-F299 HydrophobicContact CB-CZ 4.14Å; H241-F299 AromaticContact CD2-CZ 3.5Å; H241-F299 AromaticContact CG-CZ 3.83Å; L295-F299 WeakPolarHBondContact O-CB 3.24Å; L295-F299 PolarHBondContact O-N 3.11Å; L295-F299 VanDerWaalsContact O-N 3.11Å; C296-F299 WeakPolarHBondContact O-CB 3.25Å; C296-F299 PolarHBondContact O-N 2.84Å; H297-F299 VanDerWaalsContact C-N 3.33Å; H297-F299 PolarHBondContact O-N 3.38Å; F299-S302 PolarHBondContact O-OG 2.86Å; F299-K303 HydrophobicContact CE1-CD 4Å; F299-K303 HydrophobicContact CE2-CD 3.9Å; F299-K303 HydrophobicContact CZ-CD 3.4Å; F299-K303 WeakPolarHBondContact O-CB 3.44Å; F299-K303 PolarHBondContact O-N 3.47Å; F299-K303 VanDerWaalsContact O-N 3.11Å; F299-F304 HydrophobicContact CE1-CE2 4.37Å
300Y95.5Very high95.4Very high6 Ų647.4 Ų47.42%0.02425%0.248CC..Hα-helixtrans-70-45.3179-77.2-62.1000112.6K55 C296 H297 E298 S302 K303 F304 Y307K55-Y300 PolarHBondContact NZ-OH 3.48Å; C296-Y300 WeakPolarHBondContact O-CD2 3.45Å; C296-Y300 PolarHBondContact O-N 2.96Å; C296-Y300 VanDerWaalsContact O-N 3.13Å; C296-Y300 VanDerWaalsContact SG-CE2 3.51Å; H297-Y300 WeakPolarHBondContact O-CB 3.49Å; H297-Y300 PolarHBondContact O-N 3.36Å; E298-Y300 VanDerWaalsContact C-N 3.28Å; E298-Y300 PolarHBondContact O-N 2.85Å; Y300-S302 VanDerWaalsContact C-N 3.35Å; Y300-S302 PolarHBondContact O-N 3.31Å; Y300-K303 PolarHBondContact O-N 2.94Å; Y300-F304 AromaticContact CD1-CD2 3.79Å; Y300-F304 HydrophobicContact CD1-CD2 3.79Å; Y300-F304 AromaticContact CD1-CE2 3.62Å; Y300-F304 HydrophobicContact CD1-CE2 3.62Å; Y300-F304 HydrophobicContact CE1-CE2 4.07Å; Y300-F304 WeakPolarHBondContact O-CD2 3.33Å; Y300-F304 PolarHBondContact O-N 3.28Å; Y300-Y307 VanDerWaalsContact CB-CE2 3.46Å; Y300-Y307 HydrophobicContact CD1-CE2 4.39Å; Y300-Y307 HydrophobicContact CD2-CE2 4.38Å; Y300-Y307 HydrophobicContact CG-CD2 4.26Å; Y300-Y307 AromaticContact CG-CE2 3.88Å; Y300-Y307 HydrophobicContact CG-CE2 3.88Å
301T94.7Very high95.3Very high49 Ų4947.4 Ų47.430%0.30125%0.248SC..Hα-helixtrans-65.5-37-179.355.50000112.6H297 E298 Y307H297-T301 PolarHBondContact O-N 3.49Å; H297-T301 PolarHBondContact O-OG1 2.94Å; E298-T301 WeakPolarHBondContact CA-OG1 3.26Å; E298-T301 PolarHBondContact O-OG1 3.41Å; T301-Y307 HydrophobicContact CG2-CD1 3.65Å; T301-Y307 HydrophobicContact CG2-CE1 3.95Å
302S92.6Very high95.3Very high91 Ų9151.1 Ų51.164%0.63626%0.264SS*.Hα-helixtrans-75.1-34177.157.30000113.3E298 F299 Y300E298-S302 VanDerWaalsContact O-CB 3.3Å; E298-S302 WeakPolarHBondContact O-CB 3.48Å; E298-S302 PolarHBondContact O-N 3.31Å; E298-S302 PolarHBondContact O-OG 2.8Å; F299-S302 PolarHBondContact O-OG 2.86Å; Y300-S302 VanDerWaalsContact C-N 3.35Å; Y300-S302 PolarHBondContact O-N 3.31Å
303K93.9Very high95.2Very high108 Ų10850.8 Ų50.847%0.4726%0.26SS..Hα-helixtrans-85.4-33-174.8-175.4166.3-177.5156.70113.8F299 Y300F299-K303 HydrophobicContact CE1-CD 4Å; F299-K303 HydrophobicContact CE2-CD 3.9Å; F299-K303 HydrophobicContact CZ-CD 3.4Å; F299-K303 WeakPolarHBondContact O-CB 3.44Å; F299-K303 PolarHBondContact O-N 3.47Å; F299-K303 VanDerWaalsContact O-N 3.11Å; Y300-K303 PolarHBondContact O-N 2.94Å
304F94.9Very high95Very high37 Ų3750.8 Ų50.816%0.16226%0.26CS..  trans-120.7110.4-172-56.8-81000110.8H241 V243 F299 Y300 S306 Y307H241-F304 HydrophobicContact CB-CZ 4.02Å; H241-F304 VanDerWaalsContact O-CZ 3.26Å; H241-F304 WeakPolarHBondContact O-CZ 3.16Å; V243-F304 HydrophobicContact CG2-CB 3.7Å; V243-F304 HydrophobicContact CG2-CD1 3.83Å; V243-F304 HydrophobicContact CG2-CD2 3.62Å; V243-F304 HydrophobicContact CG2-CE1 4.34Å; V243-F304 HydrophobicContact CG2-CE2 4.17Å; V243-F304 HydrophobicContact CG2-CG 3.43Å; V243-F304 VanDerWaalsContact CG2-CG 3.43Å; V243-F304 HydrophobicContact CG2-CZ 4.5Å; F299-F304 HydrophobicContact CE1-CE2 4.37Å; Y300-F304 AromaticContact CD1-CD2 3.79Å; Y300-F304 HydrophobicContact CD1-CD2 3.79Å; Y300-F304 AromaticContact CD1-CE2 3.62Å; Y300-F304 HydrophobicContact CD1-CE2 3.62Å; Y300-F304 HydrophobicContact CE1-CE2 4.07Å; Y300-F304 WeakPolarHBondContact O-CD2 3.33Å; Y300-F304 PolarHBondContact O-N 3.28Å; F304-S306 PolarHBondContact O-N 3.04Å; F304-Y307 WeakPolarHBondContact O-CB 3.34Å; F304-Y307 PolarHBondContact O-N 3.31Å
305Q93.2Very high94.8Very high203 Ų20352.2 Ų52.295%0.94927%0.268SS*.THydrogen-bonded Turntrans-60.2-32.2175.3-68.3179.9-10.100112.3Y307Q305-Y307 PolarHBondContact O-N 2.84Å
306S92.9Very high94.6Very high101 Ų10153.7 Ų53.771%0.70628%0.278SS*.THydrogen-bonded Turntrans-81.810.4177.5670000114F304F304-S306 PolarHBondContact O-N 3.04Å
307Y96.4Very high94.2Very high5 Ų563 Ų632%0.0231%0.314CS..  trans-67.8131.5-178.1-171.4-97.8000111.5V243 S253 H297 Y300 T301 F304 Q305 Q309 R311V243-Y307 HydrophobicContact CG1-CD2 3.76Å; V243-Y307 HydrophobicContact CG1-CE2 3.96Å; V243-Y307 HydrophobicContact CG2-CD2 4.12Å; S253-Y307 PolarHBondContact OG-OH 3.4Å; H297-Y307 AromaticContact CE1-CE1 3.91Å; Y300-Y307 VanDerWaalsContact CB-CE2 3.46Å; Y300-Y307 HydrophobicContact CD1-CE2 4.39Å; Y300-Y307 HydrophobicContact CD2-CE2 4.38Å; Y300-Y307 HydrophobicContact CG-CD2 4.26Å; Y300-Y307 AromaticContact CG-CE2 3.88Å; Y300-Y307 HydrophobicContact CG-CE2 3.88Å; T301-Y307 HydrophobicContact CG2-CD1 3.65Å; T301-Y307 HydrophobicContact CG2-CE1 3.95Å; F304-Y307 WeakPolarHBondContact O-CB 3.34Å; F304-Y307 PolarHBondContact O-N 3.31Å; Q305-Y307 PolarHBondContact O-N 2.84Å; Y307-Q309 PolarHBondContact O-N 3.35Å; Y307-Q309 VanDerWaalsContact O-N 3.15Å; Y307-Q309 PolarHBondContact O-NE2 3.4Å; Y307-R311 HydrophobicContact CE1-CB 4.25Å; Y307-R311 WeakPolarHBondContact OH-CD 3.4Å
308P94.8Very high93.8Very high33 Ų3368 Ų6821%0.21434%0.341CS..  trans-66.2114.6-178-22.734.8000112.7H310 R311P308-H310 VanDerWaalsContact C-N 3.27Å; P308-H310 PolarHBondContact O-N 3.32Å; P308-R311 HydrophobicContact CB-CG 4.11Å; P308-R311 PolarHBondContact O-N 3.45Å
309Q93.3Very high93.2Very high146 Ų14669.1 Ų69.168%0.68235%0.347SS*.THydrogen-bonded Turntrans-69.3-20.2-173.5-61.5-62.5-26.300114.2Y307 R311Y307-Q309 PolarHBondContact O-N 3.35Å; Y307-Q309 VanDerWaalsContact O-N 3.15Å; Y307-Q309 PolarHBondContact O-NE2 3.4Å; Q309-R311 VanDerWaalsContact C-N 3.32Å
310H93.4Very high93.1Very high127 Ų12771.9 Ų71.959%0.58836%0.362SS*.THydrogen-bonded Turntrans-75.9-20178.166-94.7000113E250 P308E250-H310 PolarHBondContact O-NE2 3.36Å; E250-H310 VanDerWaalsContact O-NE2 3.13Å; P308-H310 VanDerWaalsContact C-N 3.27Å; P308-H310 PolarHBondContact O-N 3.32Å
311R96.3Very high92.9Very high6 Ų675.4 Ų75.42%0.02338%0.38CS..  trans-65.5141.6-179-71.8175.9-175.7-166.7-3.3110.4P244 F249 E250 L251 H297 Y307 P308 Q309P244-R311 PolarHBondContact O-NH1 3.47Å; P244-R311 PolarHBondContact O-NH2 3.09Å; F249-R311 WeakPolarHBondContact O-CD 3.43Å; F249-R311 PolarHBondContact O-NE 3.19Å; F249-R311 PolarHBondContact O-NH1 3.4Å; F249-R311 PolarHBondContact O-NH2 3.02Å; E250-R311 VanDerWaalsContact CD-NH2 3.27Å; E250-R311 WeakPolarHBondContact O-CG 3.03Å; E250-R311 IonicContact OE1-NH2 3.65Å; E250-R311 PolarHBondContact OE1-NH2 3.39Å; E250-R311 IonicContact OE2-CZ 3.58Å; E250-R311 IonicContact OE2-NE 3Å; E250-R311 IonicContact OE2-NH2 2.93Å; E250-R311 PolarHBondContact OE2-NH2 3.31Å; L251-R311 WeakPolarHBondContact O-CA 3.5Å; H297-R311 PolarHBondContact CE1-O 3.05Å; Y307-R311 HydrophobicContact CE1-CB 4.25Å; Y307-R311 WeakPolarHBondContact OH-CD 3.4Å; P308-R311 HydrophobicContact CB-CG 4.11Å; P308-R311 PolarHBondContact O-N 3.45Å; Q309-R311 VanDerWaalsContact C-N 3.32Å
312K96.7Very high92.8Very high82 Ų8276.8 Ų76.836%0.35738%0.384SS..BIsolated β-bridgetrans-96.5172.9170.7-61.1-56.5-176.3-176.50111L251 V252 S253L251-K312 PolarHBondContact O-N 3.4Å; V252-K312 CarbonylContact C-O 3.41Å; V252-K312 WeakPolarHBondContact CA-O 3.19Å; V252-K312 HydrophobicContact CG1-CB 4.18Å; S253-K312 PolarHBondContact N-O 3.24Å; S253-K312 PolarHBondContact OG-O 2.85Å
313A95.7Very high92.9Very high0 Ų076 Ų760%037%0.369CS..SBendtrans-68-53.4-177.300000112.2S253 C254 A293 H297 L319S253-A313 WeakPolarHBondContact CB-O 3.25Å; S253-A313 PolarHBondContact N-O 2.89Å; C254-A313 WeakPolarHBondContact CB-O 3.44Å; C254-A313 PolarHBondContact N-O 3.45Å; A293-A313 HydrophobicContact CB-CB 4.05Å; H297-A313 HydrophobicContact CB-CB 3.78Å; A313-L319 WeakPolarHBondContact CB-OXT 3.35Å; A313-L319 PolarHBondContact N-O 2.92Å; A313-L319 PolarHBondContact N-OXT 3.49Å
314F94.9Very high92.8Very high0 Ų074 Ų740%036%0.363CS..SBendtrans-154.9-20.4172.986.5-67000116.2C254 L258 L261 L286 Q289 A290 A293 L319C254-F314 HydrophobicContact CB-CB 4.17Å; L258-F314 HydrophobicContact CB-CD2 3.97Å; L258-F314 HydrophobicContact CD1-CD2 4.41Å; L261-F314 HydrophobicContact CD2-CE2 4.06Å; L286-F314 HydrophobicContact CD1-CZ 4Å; Q289-F314 HydrophobicContact CB-CE2 4.46Å; A290-F314 VanDerWaalsContact CA-CE1 3.47Å; A290-F314 HydrophobicContact CB-CE1 3.7Å; A290-F314 HydrophobicContact CB-CZ 4.15Å; A293-F314 HydrophobicContact CB-CB 3.65Å; A293-F314 HydrophobicContact CB-CD1 3.58Å; A293-F314 HydrophobicContact CB-CG 3.82Å; F314-L319 HydrophobicContact CE1-CD2 4.05Å; F314-L319 HydrophobicContact CE1-CG 4.49Å; F314-L319 PolarHBondContact N-O 2.92Å
315L93.3Very high92.7Very high41 Ų4176.5 Ų76.522%0.21538%0.376CS..SBendtrans-97.2112.8172.9-71.2170.6000109.2L258 Y317 L318 L319L258-L315 HydrophobicContact CD1-CD2 3.79Å; L315-Y317 PolarHBondContact O-N 3.49Å; L315-L318 HydrophobicContact CB-CB 4.2Å; L315-L318 HydrophobicContact CD1-CD2 4.14Å; L315-L318 PolarHBondContact O-N 3.13Å; L315-L318 VanDerWaalsContact O-N 3.16Å; L315-L319 HydrophobicContact CB-CB 4.23Å; L315-L319 HydrophobicContact CD1-CB 4.42Å; L315-L319 PolarHBondContact N-O 3.29Å; L315-L319 PolarHBondContact O-N 3.21Å
316P90.9Very high92.6Very high33 Ų3367.4 Ų67.421%0.21434%0.335CS..THydrogen-bonded Turntrans-52.5135.5-179.2-25.533.5000111.4W248 V252 L258 L318W248-P316 HydrophobicContact CE3-CG 4.45Å; W248-P316 HydrophobicContact CZ3-CG 4Å; V252-P316 HydrophobicContact CG1-CB 4.33Å; V252-P316 HydrophobicContact CG1-CG 3.93Å; L258-P316 HydrophobicContact CD2-CG 4.39Å; P316-L318 PolarHBondContact O-N 3.48Å
317Y89Confident92.6Very high197 Ų19764.8 Ų64.877%0.77331%0.307SS*.THydrogen-bonded Turntrans64.2-8.8178.7-42.9-72.3000116.7L315L315-Y317 PolarHBondContact O-N 3.49Å
318L88.7Confident92.3Very high136 Ų13669.8 Ų69.871%0.71233%0.331SS*.THydrogen-bonded Turntrans-113.5-65-177.7-176.665.6000113L315 P316L315-L318 HydrophobicContact CB-CB 4.2Å; L315-L318 HydrophobicContact CD1-CD2 4.14Å; L315-L318 PolarHBondContact O-N 3.13Å; L315-L318 VanDerWaalsContact O-N 3.16Å; P316-L318 PolarHBondContact O-N 3.48Å
319L80.4Confident92.1Very high37 Ų3773.2 Ų73.219%0.19434%0.342CS..  trans-131.20-170.2178.559.7000113.3F25 A290 A313 F314 L315F25-L319 HydrophobicContact CE2-CD1 4.49Å; F25-L319 HydrophobicContact CE2-CD2 4.14Å; F25-L319 HydrophobicContact CZ-CD1 3.95Å; F25-L319 HydrophobicContact CZ-CD2 3.82Å; A290-L319 HydrophobicContact CB-CD2 3.97Å; A313-L319 WeakPolarHBondContact CB-OXT 3.35Å; A313-L319 PolarHBondContact N-O 2.92Å; A313-L319 PolarHBondContact N-OXT 3.49Å; F314-L319 HydrophobicContact CE1-CD2 4.05Å; F314-L319 HydrophobicContact CE1-CG 4.49Å; F314-L319 PolarHBondContact N-O 2.92Å; L315-L319 HydrophobicContact CB-CB 4.23Å; L315-L319 HydrophobicContact CD1-CB 4.42Å; L315-L319 PolarHBondContact N-O 3.29Å; L315-L319 PolarHBondContact O-N 3.21Å

Retrieved 319 of 319 residues in 2625.6 ms (Link to these results)

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