A0A087YMX8_POEFO Loading...

Transmembrane 4 L six family member 18

AlphaFold DB , UniProt , Accession A0A087YMX8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 196 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M43.2Very low64.8Low195 Ų19578.9 Ų78.996%0.96146%0.464SS*.  0890-77.5153.1139.400109.1
2C44.8Very low66.4Low114 Ų11472.3 Ų72.377%0.7743%0.425SS*.  trans-98.8-12.1179.8-610000113.4
3C51Low67.9Low119 Ų11974 Ų7480%0.80443%0.43SS*.Hα-helixtrans-70.1-33.5-178.4-68.20000113.4V5 F7C3-V5 VanDerWaalsContact C-N 3.27Å; C3-V5 PolarHBondContact O-N 3.05Å; C3-F7 PolarHBondContact O-N 3.18Å
4S56.7Low69.2Low32 Ų3271.6 Ų71.622%0.22442%0.423CS..Hα-helixtrans-68.3-26.8-179.4-170.80000113A8 N180S4-A8 PolarHBondContact O-N 3.42Å; S4-N180 PolarHBondContact OG-ND2 3.41Å
5V61.4Low70.4Confident64 Ų6466.8 Ų66.839%0.38840%0.395SS..Hα-helixtrans-78-39.2-176.8178.60000111.2C3 R9 L71C3-V5 VanDerWaalsContact C-N 3.27Å; C3-V5 PolarHBondContact O-N 3.05Å; V5-R9 WeakPolarHBondContact O-CB 3.34Å; V5-R9 PolarHBondContact O-N 3.31Å; V5-R9 VanDerWaalsContact O-N 3.16Å; V5-L71 WeakPolarHBondContact CG1-O 3.34Å
6G65.8Low71.5Confident47 Ų4766.7 Ų66.749%0.48539%0.391SS..Hα-helixtrans-65-39.5173.900000112.6R9 S10G6-R9 PolarHBondContact O-N 3.45Å; G6-S10 PolarHBondContact O-N 2.91Å
7F72.9Confident72.6Confident92 Ų9266.6 Ų66.640%0.40439%0.394SS..Hα-helixtrans-64.8-48.6177.5-173.5-102.3000112.2C3 R9 S10 L11 N176C3-F7 PolarHBondContact O-N 3.18Å; F7-R9 VanDerWaalsContact C-N 3.29Å; F7-R9 PolarHBondContact O-N 3.14Å; F7-S10 PolarHBondContact O-N 3.5Å; F7-S10 VanDerWaalsContact O-N 3.15Å; F7-L11 HydrophobicContact CD1-CD1 3.93Å; F7-L11 HydrophobicContact CD1-CG 4.3Å; F7-L11 HydrophobicContact CE1-CD1 3.48Å; F7-L11 VanDerWaalsContact CE1-CD1 3.48Å; F7-L11 HydrophobicContact CE1-CD2 4.42Å; F7-L11 HydrophobicContact CE1-CG 4.01Å; F7-L11 HydrophobicContact CZ-CD1 4.11Å; F7-L11 HydrophobicContact CZ-CD2 4.24Å; F7-L11 HydrophobicContact CZ-CG 4.29Å; F7-L11 WeakPolarHBondContact O-CG 3.28Å; F7-L11 PolarHBondContact O-N 3.19Å; F7-N176 WeakPolarHBondContact CD1-ND2 3.42Å; F7-N176 WeakPolarHBondContact CE1-ND2 3.28Å
8A72.8Confident73.5Confident4 Ų464.7 Ų64.73%0.03338%0.381CS..Hα-helixtrans-58.6-40.3176.500000112.3S4 L11 G12 Q173S4-A8 PolarHBondContact O-N 3.42Å; A8-L11 PolarHBondContact O-N 3.14Å; A8-G12 PolarHBondContact O-N 2.74Å; A8-Q173 VanDerWaalsContact CB-OE1 3.25Å
9R76.9Confident74.2Confident106 Ų10661.3 Ų61.340%0.436%0.361SS..Hα-helixtrans-64.4-41.2176.5-174.2176.9174.5167.6-7.6112.6V5 G6 F7 L11 G12 L13 G72V5-R9 WeakPolarHBondContact O-CB 3.34Å; V5-R9 PolarHBondContact O-N 3.31Å; V5-R9 VanDerWaalsContact O-N 3.16Å; G6-R9 PolarHBondContact O-N 3.45Å; F7-R9 VanDerWaalsContact C-N 3.29Å; F7-R9 PolarHBondContact O-N 3.14Å; R9-L11 VanDerWaalsContact C-N 3.33Å; R9-G12 PolarHBondContact O-N 3.4Å; R9-L13 HydrophobicContact CG-CD1 4.38Å; R9-L13 WeakPolarHBondContact O-CG 3.48Å; R9-L13 PolarHBondContact O-N 3.13Å; R9-G72 PolarHBondContact NH1-O 2.91Å
10S82.6Confident74.9Confident76 Ų7663 Ų6353%0.53137%0.367SS..Hα-helixtrans-64.2-40176-169.20000111.4G6 F7 L13 A14G6-S10 PolarHBondContact O-N 2.91Å; F7-S10 PolarHBondContact O-N 3.5Å; F7-S10 VanDerWaalsContact O-N 3.15Å; S10-L13 PolarHBondContact O-N 2.99Å; S10-A14 WeakPolarHBondContact O-CB 3.35Å; S10-A14 PolarHBondContact O-N 3.35Å
11L84.8Confident75.6Confident19 Ų1963 Ų6310%0.09937%0.371CS..Hα-helixtrans-63.5-44.3176.1-70.6-174.2000111.6F7 A8 R9 L13 A14 L15 I169 L172 Q173F7-L11 HydrophobicContact CD1-CD1 3.93Å; F7-L11 HydrophobicContact CD1-CG 4.3Å; F7-L11 HydrophobicContact CE1-CD1 3.48Å; F7-L11 VanDerWaalsContact CE1-CD1 3.48Å; F7-L11 HydrophobicContact CE1-CD2 4.42Å; F7-L11 HydrophobicContact CE1-CG 4.01Å; F7-L11 HydrophobicContact CZ-CD1 4.11Å; F7-L11 HydrophobicContact CZ-CD2 4.24Å; F7-L11 HydrophobicContact CZ-CG 4.29Å; F7-L11 WeakPolarHBondContact O-CG 3.28Å; F7-L11 PolarHBondContact O-N 3.19Å; A8-L11 PolarHBondContact O-N 3.14Å; R9-L11 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 3.13Å; L11-A14 PolarHBondContact O-N 3.18Å; L11-L15 PolarHBondContact O-N 3.06Å; L11-I169 HydrophobicContact CB-CG2 3.82Å; L11-I169 HydrophobicContact CD1-CG2 4.29Å; L11-I169 HydrophobicContact CD2-CG1 4.5Å; L11-I169 HydrophobicContact CD2-CG2 3.97Å; L11-I169 HydrophobicContact CG-CG2 4.24Å; L11-L172 HydrophobicContact CD1-CB 4.2Å; L11-Q173 HydrophobicContact CD1-CB 4.3Å
12G84.1Confident77.7Confident0 Ų053.8 Ų53.80%033%0.325CS..Hα-helixtrans-62.3-39.6175.300000113.5A8 R9 A14 L15 L16A8-G12 PolarHBondContact O-N 2.74Å; R9-G12 PolarHBondContact O-N 3.4Å; G12-A14 VanDerWaalsContact C-N 3.34Å; G12-L15 PolarHBondContact O-N 3.22Å; G12-L16 PolarHBondContact O-N 2.86Å
13L85.3Confident79.7Confident94 Ų9450.5 Ų50.549%0.49230%0.302SS..Hα-helixtrans-66.8-33.2174.4-77.6168.9000112.8R9 S10 L11 P17 I69R9-L13 HydrophobicContact CG-CD1 4.38Å; R9-L13 WeakPolarHBondContact O-CG 3.48Å; R9-L13 PolarHBondContact O-N 3.13Å; S10-L13 PolarHBondContact O-N 2.99Å; L11-L13 PolarHBondContact O-N 3.13Å; L13-P17 WeakPolarHBondContact O-CD 3.1Å; L13-I69 HydrophobicContact CD2-CD1 4.47Å
14A87.3Confident81.4Confident40 Ų4049.5 Ų49.533%0.33129%0.288SS..Hα-helixtrans-72.9-36.4174.400000112.1S10 L11 G12 L16 P17 L18 I169S10-A14 WeakPolarHBondContact O-CB 3.35Å; S10-A14 PolarHBondContact O-N 3.35Å; L11-A14 PolarHBondContact O-N 3.18Å; G12-A14 VanDerWaalsContact C-N 3.34Å; A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 PolarHBondContact O-N 3.35Å; A14-P17 WeakPolarHBondContact O-CD 3.07Å; A14-P17 VanDerWaalsContact O-CG 3.26Å; A14-P17 WeakPolarHBondContact O-CG 3.41Å; A14-L18 WeakPolarHBondContact O-CD1 3.17Å; A14-I169 HydrophobicContact CB-CD1 4.46Å
15L86.4Confident82.8Confident0 Ų048.3 Ų48.30%028%0.28CS..Hα-helixtrans-63.6-33.2177.3-89157.5000113.5L11 G12 L18 A19 M61 A65 F68 E166 I169L11-L15 PolarHBondContact O-N 3.06Å; G12-L15 PolarHBondContact O-N 3.22Å; L15-L18 PolarHBondContact O-N 3Å; L15-A19 WeakPolarHBondContact O-CB 3.34Å; L15-A19 PolarHBondContact O-N 3.46Å; L15-M61 HydrophobicContact CD2-CE 3.47Å; L15-M61 VanDerWaalsContact CD2-CE 3.47Å; L15-A65 HydrophobicContact CB-CB 3.96Å; L15-F68 HydrophobicContact CD1-CD2 3.46Å; L15-F68 VanDerWaalsContact CD1-CD2 3.46Å; L15-F68 HydrophobicContact CD1-CE2 3.54Å; L15-E166 HydrophobicContact CD2-CB 4.41Å; L15-E166 HydrophobicContact CD2-CG 4.07Å; L15-I169 HydrophobicContact CD1-CB 4.45Å; L15-I169 HydrophobicContact CD1-CG2 3.49Å; L15-I169 VanDerWaalsContact CD1-CG2 3.49Å; L15-I169 HydrophobicContact CD2-CG2 4.36Å; L15-I169 HydrophobicContact CG-CB 4.34Å; L15-I169 HydrophobicContact CG-CD1 4.24Å; L15-I169 HydrophobicContact CG-CG2 3.72Å
16L88.4Confident83.9Confident65 Ų6545.7 Ų45.734%0.3426%0.264SS..Hα-helixtrans-59.3-53.9-177.2-171.471.2000113.8G12 A14 L18 A19 L20 L62G12-L16 PolarHBondContact O-N 2.86Å; A14-L16 VanDerWaalsContact C-N 3.3Å; A14-L16 PolarHBondContact O-N 3.35Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3.48Å; L16-A19 PolarHBondContact O-N 3.13Å; L16-L20 WeakPolarHBondContact O-CG 3.4Å; L16-L20 PolarHBondContact O-N 2.84Å; L16-L62 HydrophobicContact CD1-CD2 4.25Å
17P89.4Confident84.6Confident66 Ų6647.1 Ų47.143%0.42926%0.26SS..Hα-helixtrans-65.1-33.417626-35000112.5L13 A14 L20 C21L13-P17 WeakPolarHBondContact O-CD 3.1Å; A14-P17 WeakPolarHBondContact O-CD 3.07Å; A14-P17 VanDerWaalsContact O-CG 3.26Å; A14-P17 WeakPolarHBondContact O-CG 3.41Å; P17-L20 PolarHBondContact O-N 3.29Å; P17-C21 WeakPolarHBondContact O-CB 3.4Å; P17-C21 PolarHBondContact O-N 3.36Å; P17-C21 PolarHBondContact O-SG 3.42Å; P17-C21 VanDerWaalsContact O-SG 3.36Å
18L88.7Confident85.1Confident31 Ų3146 Ų4616%0.16226%0.258CS..Hα-helixtrans-61.7-48.4175.9-9170.9000111.1A14 L15 L16 L20 C21 S22 L162 L165 E166 I169A14-L18 WeakPolarHBondContact O-CD1 3.17Å; L15-L18 PolarHBondContact O-N 3Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3.48Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-L20 PolarHBondContact O-N 3.3Å; L18-C21 PolarHBondContact O-N 3.34Å; L18-S22 PolarHBondContact O-N 2.8Å; L18-L162 HydrophobicContact CB-CD2 4.48Å; L18-L162 HydrophobicContact CG-CD2 4Å; L18-L165 HydrophobicContact CD2-CB 3.56Å; L18-L165 HydrophobicContact CD2-CD1 4.23Å; L18-E166 HydrophobicContact CB-CG 4.19Å; L18-E166 HydrophobicContact CD2-CG 4.03Å; L18-I169 HydrophobicContact CD2-CD1 4.15Å
19A87.6Confident85.4Confident0 Ų046.4 Ų46.40%026%0.259CS..Hα-helixtrans-64.3-37177.200000112.2L15 L16 S22 V23 M61 L62L15-A19 WeakPolarHBondContact O-CB 3.34Å; L15-A19 PolarHBondContact O-N 3.46Å; L16-A19 PolarHBondContact O-N 3.13Å; A19-S22 WeakPolarHBondContact CA-OG 3.47Å; A19-S22 PolarHBondContact O-N 2.02Å; A19-S22 PolarHBondContact O-OG 3.04Å; A19-V23 VanDerWaalsContact O-CG2 3.3Å; A19-V23 WeakPolarHBondContact O-CG2 2.99Å; A19-V23 PolarHBondContact O-N 3.08Å; A19-M61 HydrophobicContact CB-CB 4.05Å; A19-L62 HydrophobicContact CB-CD2 3.97Å
20L88.4Confident85.3Confident95 Ų9543.3 Ų43.350%0.49725%0.251SS..Hα-helixtrans-65.6-43.8174.2-72.1172.4000111.6L16 P17 L18 S22 V23 L24L16-L20 WeakPolarHBondContact O-CG 3.4Å; L16-L20 PolarHBondContact O-N 2.84Å; P17-L20 PolarHBondContact O-N 3.29Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-L20 PolarHBondContact O-N 3.3Å; L20-S22 VanDerWaalsContact C-N 3.32Å; L20-S22 PolarHBondContact O-N 2.89Å; L20-V23 PolarHBondContact O-N 2.92Å; L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 2.92Å
21C89.2Confident84.8Confident65 Ų6543.4 Ų43.444%0.43924%0.242SC..Hα-helixtrans-61.9-39.7174.8-75.50000111.7P17 L18 L24 A25 L162P17-C21 WeakPolarHBondContact O-CB 3.4Å; P17-C21 PolarHBondContact O-N 3.36Å; P17-C21 PolarHBondContact O-SG 3.42Å; P17-C21 VanDerWaalsContact O-SG 3.36Å; L18-C21 PolarHBondContact O-N 3.34Å; C21-L24 PolarHBondContact O-N 3.2Å; C21-A25 WeakPolarHBondContact O-CB 3.3Å; C21-A25 PolarHBondContact O-N 3.41Å; C21-L162 HydrophobicContact CB-CD1 3.78Å; C21-L162 HydrophobicContact CB-CD2 4.37Å
22S87.4Confident83.9Confident0 Ų043.5 Ų43.50%024%0.243CC..Hα-helixtrans-67.6-40.4177.973.60000111.9L18 A19 L20 N26 G57 G58L18-S22 PolarHBondContact O-N 2.8Å; A19-S22 WeakPolarHBondContact CA-OG 3.47Å; A19-S22 PolarHBondContact O-N 2.02Å; A19-S22 PolarHBondContact O-OG 3.04Å; L20-S22 VanDerWaalsContact C-N 3.32Å; L20-S22 PolarHBondContact O-N 2.89Å; S22-N26 WeakPolarHBondContact O-CB 3.44Å; S22-N26 PolarHBondContact O-N 3.29Å; S22-N26 PolarHBondContact O-ND2 3.41Å; S22-G57 PolarHBondContact OG-O 2.93Å; S22-G57 VanDerWaalsContact OG-O 3.05Å; S22-G58 WeakPolarHBondContact OG-CA 3.34Å
23V85.8Confident83Confident46 Ų4649.4 Ų49.428%0.27927%0.272SS..Hα-helixtrans-60.4-47.5171.9171.30000111.1A19 L20 N26 L27A19-V23 VanDerWaalsContact O-CG2 3.3Å; A19-V23 WeakPolarHBondContact O-CG2 2.99Å; A19-V23 PolarHBondContact O-N 3.08Å; L20-V23 PolarHBondContact O-N 2.92Å; V23-N26 PolarHBondContact O-N 3.49Å; V23-L27 WeakPolarHBondContact O-CB 3.3Å; V23-L27 PolarHBondContact O-N 2.96Å
24L87.4Confident81.8Confident98 Ų9847.8 Ų47.851%0.51328%0.278SS..Hα-helixtrans-62.5-46.4179.7-72172.2000111.6L20 C21 N26 L27 L28L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 2.92Å; C21-L24 PolarHBondContact O-N 3.2Å; L24-N26 PolarHBondContact O-N 3.4Å; L24-L27 WeakPolarHBondContact O-CB 3.3Å; L24-L27 PolarHBondContact O-N 2.98Å; L24-L27 VanDerWaalsContact O-N 3.13Å; L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 PolarHBondContact O-N 3.29Å
25A86.8Confident80.5Confident7 Ų750.5 Ų50.56%0.05828%0.284CS..Hα-helixtrans-62.1-41.5179.200000112.3C21 L27 L28 L29 L155 L159C21-A25 WeakPolarHBondContact O-CB 3.3Å; C21-A25 PolarHBondContact O-N 3.41Å; A25-L27 VanDerWaalsContact C-N 3.35Å; A25-L28 PolarHBondContact O-N 2.93Å; A25-L29 PolarHBondContact O-N 3.01Å; A25-L155 HydrophobicContact CB-CD2 4.19Å; A25-L159 HydrophobicContact CB-CD1 4.49Å; A25-L159 HydrophobicContact CB-CD2 3.81Å; A25-L159 HydrophobicContact CB-CG 3.94Å
26N84.3Confident79.3Confident9 Ų956.4 Ų56.45%0.04831%0.314CS..Hα-helixtrans-65-36.7173.8-80.7-69.8000112.2S22 V23 L24 L29 L30 L54 L159S22-N26 WeakPolarHBondContact O-CB 3.44Å; S22-N26 PolarHBondContact O-N 3.29Å; S22-N26 PolarHBondContact O-ND2 3.41Å; V23-N26 PolarHBondContact O-N 3.49Å; L24-N26 PolarHBondContact O-N 3.4Å; N26-L29 PolarHBondContact O-N 3.22Å; N26-L30 PolarHBondContact O-N 3.23Å; N26-L30 VanDerWaalsContact O-N 3.13Å; N26-L54 HydrophobicContact CB-CB 4.31Å; N26-L54 HydrophobicContact CB-CD1 3.44Å; N26-L54 VanDerWaalsContact CB-CD1 3.44Å; N26-L54 HydrophobicContact CB-CG 4.45Å; N26-L159 WeakPolarHBondContact ND2-CD2 3.18Å
27L81.3Confident77.7Confident77 Ų7758 Ų5840%0.40333%0.327SS..Hα-helixtrans-67.2-40.1175.6-171.767000111.9V23 L24 A25 L29 L30 F31V23-L27 WeakPolarHBondContact O-CB 3.3Å; V23-L27 PolarHBondContact O-N 2.96Å; L24-L27 WeakPolarHBondContact O-CB 3.3Å; L24-L27 PolarHBondContact O-N 2.98Å; L24-L27 VanDerWaalsContact O-N 3.13Å; A25-L27 VanDerWaalsContact C-N 3.35Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.35Å; L27-L30 WeakPolarHBondContact O-CB 3.23Å; L27-L30 PolarHBondContact O-N 2.94Å; L27-L30 VanDerWaalsContact O-N 3.16Å; L27-F31 HydrophobicContact CD1-CD2 4.1Å; L27-F31 HydrophobicContact CD1-CE2 4.04Å; L27-F31 PolarHBondContact O-N 3.43Å; L27-F31 VanDerWaalsContact O-N 3.16Å
28L82.7Confident76.1Confident68 Ų6857.4 Ų57.436%0.35632%0.316SS..Hα-helixtrans-66.7-31.2175.1-91.771.4000112.5L24 A25 L30 F31 W151 L155L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 PolarHBondContact O-N 3.29Å; A25-L28 PolarHBondContact O-N 2.93Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L28-F31 CarbonylContact O-C 3.6Å; L28-W151 HydrophobicContact CB-CZ2 4.13Å; L28-W151 HydrophobicContact CD2-CH2 3.99Å; L28-W151 HydrophobicContact CD2-CZ2 3.73Å; L28-W151 HydrophobicContact CG-CZ2 4.07Å; L28-W151 PolarHBondContact O-NE1 2.9Å; L28-L155 HydrophobicContact CB-CD1 3.74Å; L28-L155 HydrophobicContact CB-CD2 4.28Å; L28-L155 HydrophobicContact CD2-CD2 4.32Å
29L78.7Confident74.4Confident12 Ų1260.4 Ų60.46%0.06333%0.332CS..Hα-helixtrans-69.1-32171.5-84.2160.8000112.2A25 N26 L27 Y50 N152 L155 L156 L159A25-L29 PolarHBondContact O-N 3.01Å; N26-L29 PolarHBondContact O-N 3.22Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.35Å; L29-Y50 HydrophobicContact CB-CD1 4.28Å; L29-Y50 HydrophobicContact CB-CE1 4.07Å; L29-Y50 HydrophobicContact CD1-CE1 4.12Å; L29-Y50 HydrophobicContact CD2-CE1 4.1Å; L29-Y50 HydrophobicContact CG-CE1 4.31Å; L29-N152 HydrophobicContact CD2-CB 4.22Å; L29-L155 HydrophobicContact CD1-CB 3.9Å; L29-L155 HydrophobicContact CD2-CB 3.96Å; L29-L155 HydrophobicContact CD2-CD1 4.15Å; L29-L155 HydrophobicContact CG-CB 3.72Å; L29-L155 HydrophobicContact CG-CD1 3.8Å; L29-L155 HydrophobicContact CG-CG 4.41Å; L29-L156 HydrophobicContact CD1-CD2 4.03Å; L29-L156 HydrophobicContact CD1-CG 4.29Å; L29-L156 HydrophobicContact CD2-CG 4.33Å; L29-L159 HydrophobicContact CD1-CD1 3.46Å; L29-L159 VanDerWaalsContact CD1-CD1 3.46Å
30L74.4Confident72.6Confident42 Ų4269 Ų6922%0.2237%0.372CS..Hα-helixtrans-72.8-35.4178.6-161.973.4000112.4N26 L27 L28 P32 Y47 F51N26-L30 PolarHBondContact O-N 3.23Å; N26-L30 VanDerWaalsContact O-N 3.13Å; L27-L30 WeakPolarHBondContact O-CB 3.23Å; L27-L30 PolarHBondContact O-N 2.94Å; L27-L30 VanDerWaalsContact O-N 3.16Å; L28-L30 VanDerWaalsContact C-N 3.33Å; L30-P32 VanDerWaalsContact C-CD 3.45Å; L30-P32 VanDerWaalsContact O-CD 3.28Å; L30-P32 WeakPolarHBondContact O-CD 3.48Å; L30-Y47 HydrophobicContact CD1-CD2 3.69Å; L30-Y47 HydrophobicContact CD1-CE2 3.72Å; L30-Y47 HydrophobicContact CD2-CE2 4.18Å; L30-Y47 HydrophobicContact CG-CE2 4.32Å; L30-F51 HydrophobicContact CD1-CD2 4.26Å; L30-F51 HydrophobicContact CD1-CE2 4.16Å; L30-F51 HydrophobicContact CD2-CE2 3.77Å; L30-F51 HydrophobicContact CD2-CZ 4.48Å
31F72.6Confident70.7Confident78 Ų7872.7 Ų72.734%0.34239%0.387SS..SBendtrans-118.573.3-179.3-65.2-77.7000111.2L27 L28 M33 G34 I36 I39L27-F31 HydrophobicContact CD1-CD2 4.1Å; L27-F31 HydrophobicContact CD1-CE2 4.04Å; L27-F31 PolarHBondContact O-N 3.43Å; L27-F31 VanDerWaalsContact O-N 3.16Å; L28-F31 CarbonylContact O-C 3.6Å; F31-M33 PolarHBondContact O-N 2.93Å; F31-M33 VanDerWaalsContact O-N 3.09Å; F31-G34 PolarHBondContact O-N 2.95Å; F31-I36 HydrophobicContact CD1-CG2 4.49Å; F31-I36 HydrophobicContact CE1-CG2 4Å; F31-I39 HydrophobicContact CE1-CD1 4.13Å
32P66.8Low68.7Low21 Ų2177.4 Ų77.414%0.13641%0.407CS..G310 helixtrans-58.8120.1174.225.2-32.5000109.4L30 G34 I148L30-P32 VanDerWaalsContact C-CD 3.45Å; L30-P32 VanDerWaalsContact O-CD 3.28Å; L30-P32 WeakPolarHBondContact O-CD 3.48Å; P32-G34 PolarHBondContact O-N 3.15Å; P32-G34 VanDerWaalsContact O-N 3.1Å; P32-I148 HydrophobicContact CB-CD1 3.61Å; P32-I148 HydrophobicContact CG-CD1 4.29Å
33M64.1Low67.1Low124 Ų12481.8 Ų81.861%0.61142%0.424SS*.G310 helixtrans57.817.4-179.6-53.8-157.8-67.200116.4F31 E35 P145F31-M33 PolarHBondContact O-N 2.93Å; F31-M33 VanDerWaalsContact O-N 3.09Å; M33-E35 PolarHBondContact O-N 2.96Å; M33-P145 HydrophobicContact CE-CB 4.29Å
34G59.4Low65.2Low59 Ų5985.7 Ų85.761%0.60844%0.442SS*.G310 helixtrans71.39.5176.500000115.3F31 P32F31-G34 PolarHBondContact O-N 2.95Å; P32-G34 PolarHBondContact O-N 3.15Å; P32-G34 VanDerWaalsContact O-N 3.1Å
35E60.8Low63.3Low98 Ų9884.6 Ų84.646%0.45845%0.447SS..  trans-88.4120.7176.9-71.7-154.3161.500111.8M33 T37 Y38M33-E35 PolarHBondContact O-N 2.96Å; E35-T37 VanDerWaalsContact C-N 3.29Å; E35-T37 PolarHBondContact O-N 2.89Å; E35-T37 PolarHBondContact OE2-OG1 2.95Å; E35-Y38 HydrophobicContact CB-CD2 4.3Å; E35-Y38 HydrophobicContact CB-CE2 3.91Å; E35-Y38 WeakPolarHBondContact OE2-CE2 3.31Å; E35-Y38 PolarHBondContact OE2-OH 3.49Å
36I60.8Low61.6Low124 Ų12486.4 Ų86.464%0.63646%0.46SS*.G310 helixtrans-83.3-3.8-179.99.2176.7000113.2F31 Y38 I39F31-I36 HydrophobicContact CD1-CG2 4.49Å; F31-I36 HydrophobicContact CE1-CG2 4Å; I36-Y38 PolarHBondContact O-N 2.75Å; I36-I39 HydrophobicContact CG2-CD1 3.86Å
37T56.2Low60Low99 Ų9990.8 Ų90.861%0.60748%0.476SS*.G310 helixtrans-67.6-16.4-171.343.50000114.2E35E35-T37 VanDerWaalsContact C-N 3.29Å; E35-T37 PolarHBondContact O-N 2.89Å; E35-T37 PolarHBondContact OE2-OG1 2.95Å
38Y54Low58.6Low52 Ų5292.6 Ų92.620%0.20449%0.485CS..G310 helixtrans-96.72.5-171.9-59.4-76.3000115.5E35 I36 R43 W121E35-Y38 HydrophobicContact CB-CD2 4.3Å; E35-Y38 HydrophobicContact CB-CE2 3.91Å; E35-Y38 WeakPolarHBondContact OE2-CE2 3.31Å; E35-Y38 PolarHBondContact OE2-OH 3.49Å; I36-Y38 PolarHBondContact O-N 2.75Å; Y38-R43 WeakPolarHBondContact O-CD 3.22Å; Y38-R43 PolarHBondContact O-NE 3.01Å; Y38-R43 VanDerWaalsContact O-NE 3.1Å; Y38-W121 HydrophobicContact CE1-CH2 4.44Å
39I53.9Low57.4Low95 Ų9594.6 Ų94.649%0.48749%0.488SS..SBendtrans-81.3-14.1-170-61.1-174.9000113.1F31 I36F31-I39 HydrophobicContact CE1-CD1 4.13Å; I36-I39 HydrophobicContact CG2-CD1 3.86Å
40Q49.6Very low56.3Low180 Ų18096.7 Ų96.784%0.84150%0.496SS*.SBendtrans-93.6-14.2-152.3-147.5161.9-5.100118.1
41Q48.8Very low55.5Low173 Ų17398.6 Ų98.681%0.80850%0.502SS*.SBendtrans-126.1-28.3-166.3-88.5166.9-22.400120.6
42D47.3Very low54.8Low163 Ų16395.8 Ų95.887%0.87250%0.495SS*.SBendtrans-155.312.5175.4-90.8-52.9000113.7L44D42-L44 PolarHBondContact O-N 3.42Å
43R53Low54.5Low92 Ų9294.9 Ų94.935%0.34749%0.49SS..  trans-89.44.5-168.1-64.1-149.2-165.5-152.93.3115.4Y38 A45 Y47Y38-R43 WeakPolarHBondContact O-CD 3.22Å; Y38-R43 PolarHBondContact O-NE 3.01Å; Y38-R43 VanDerWaalsContact O-NE 3.1Å; R43-A45 PolarHBondContact O-N 3.15Å; R43-Y47 WeakPolarHBondContact O-CB 3.28Å; R43-Y47 PolarHBondContact O-N 2.91Å
44L46.7Very low54.6Low128 Ų12891 Ų9167%0.6747%0.471SS*.Hα-helixtrans-66.4-35-172-137.377.4000113D42 Y47 I48D42-L44 PolarHBondContact O-N 3.42Å; L44-Y47 WeakPolarHBondContact O-CB 3.35Å; L44-Y47 PolarHBondContact O-N 3.46Å; L44-I48 WeakPolarHBondContact O-CD1 3.39Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.34Å; L44-I48 PolarHBondContact O-N 3.1Å
45A46.2Very low54.8Low75 Ų7589.9 Ų89.962%0.6246%0.46SS*.Hα-helixtrans-72.3-44.1-179.800000112.8R43 Y47 I48 W49R43-A45 PolarHBondContact O-N 3.15Å; A45-Y47 VanDerWaalsContact C-N 3.29Å; A45-Y47 PolarHBondContact O-N 3.38Å; A45-I48 PolarHBondContact O-N 3.37Å; A45-W49 PolarHBondContact O-N 3.34Å
46S52.6Low54.9Low45 Ų4585.7 Ų85.732%0.31544%0.443SS..Hα-helixtrans-65.3-35.1171.4-66.10000111.4W49 Y50 Y123S46-W49 PolarHBondContact O-N 2.94Å; S46-Y50 WeakPolarHBondContact O-CB 3.29Å; S46-Y50 WeakPolarHBondContact O-CD2 3.43Å; S46-Y50 PolarHBondContact O-N 2.87Å; S46-Y123 PolarHBondContact OG-OH 2.94Å
47Y50.7Low55.1Low101 Ų10179.8 Ų79.840%0.39641%0.412SS..Hα-helixtrans-60.2-44.2175.7-178.5-92.8000112.1L30 R43 L44 A45 Y50 F51L30-Y47 HydrophobicContact CD1-CD2 3.69Å; L30-Y47 HydrophobicContact CD1-CE2 3.72Å; L30-Y47 HydrophobicContact CD2-CE2 4.18Å; L30-Y47 HydrophobicContact CG-CE2 4.32Å; R43-Y47 WeakPolarHBondContact O-CB 3.28Å; R43-Y47 PolarHBondContact O-N 2.91Å; L44-Y47 WeakPolarHBondContact O-CB 3.35Å; L44-Y47 PolarHBondContact O-N 3.46Å; A45-Y47 VanDerWaalsContact C-N 3.29Å; A45-Y47 PolarHBondContact O-N 3.38Å; Y47-Y50 PolarHBondContact O-N 2.85Å; Y47-F51 HydrophobicContact CD1-CD2 4.07Å; Y47-F51 HydrophobicContact CD2-CD2 4.34Å; Y47-F51 HydrophobicContact CD2-CE2 4.45Å; Y47-F51 AromaticContact CE1-CD2 3.65Å; Y47-F51 HydrophobicContact CE1-CD2 3.65Å; Y47-F51 AromaticContact CE1-CE2 3.73Å; Y47-F51 HydrophobicContact CE1-CE2 3.73Å; Y47-F51 HydrophobicContact CE1-CG 4.45Å; Y47-F51 AromaticContact CE2-CD2 3.97Å; Y47-F51 HydrophobicContact CE2-CD2 3.97Å; Y47-F51 AromaticContact CE2-CE2 3.65Å; Y47-F51 HydrophobicContact CE2-CE2 3.65Å; Y47-F51 HydrophobicContact CG-CD2 4.4Å; Y47-F51 AromaticContact CZ-CD2 3.6Å; Y47-F51 AromaticContact CZ-CE2 3.22Å; Y47-F51 WeakPolarHBondContact O-CB 3.33Å; Y47-F51 PolarHBondContact O-N 3.09Å; Y47-F51 WeakPolarHBondContact OH-CE2 3.26Å
48I51.9Low55.8Low116 Ų11675 Ų7560%0.59538%0.383SS*.Hα-helixtrans-64.3-41.2176.7-66.6159.3000111.2L44 A45 F51 G52L44-I48 WeakPolarHBondContact O-CD1 3.39Å; L44-I48 VanDerWaalsContact O-CG1 3.25Å; L44-I48 WeakPolarHBondContact O-CG1 3.34Å; L44-I48 PolarHBondContact O-N 3.1Å; A45-I48 PolarHBondContact O-N 3.37Å; I48-F51 PolarHBondContact O-N 3.48Å; I48-G52 PolarHBondContact O-N 3.03Å
49W56Low56.8Low109 Ų10978.3 Ų78.341%0.41340%0.404SS..Hα-helixtrans-67.4-41.9179.6-130.581000112.2A45 S46 G52 I104 L107A45-W49 PolarHBondContact O-N 3.34Å; S46-W49 PolarHBondContact O-N 2.94Å; W49-G52 PolarHBondContact O-N 3.43Å; W49-I104 HydrophobicContact CD2-CD1 4.11Å; W49-I104 HydrophobicContact CE3-CD1 3.92Å; W49-I104 HydrophobicContact CE3-CG2 3.71Å; W49-I104 HydrophobicContact CH2-CB 4.42Å; W49-I104 HydrophobicContact CH2-CD1 3.17Å; W49-I104 HydrophobicContact CH2-CG1 4.31Å; W49-I104 HydrophobicContact CH2-CG2 4.4Å; W49-I104 HydrophobicContact CZ2-CD1 3.37Å; W49-I104 HydrophobicContact CZ3-CB 4.01Å; W49-I104 HydrophobicContact CZ3-CD1 3.47Å; W49-I104 VanDerWaalsContact CZ3-CD1 3.47Å; W49-I104 HydrophobicContact CZ3-CG1 4.28Å; W49-I104 HydrophobicContact CZ3-CG2 3.57Å; W49-L107 HydrophobicContact CH2-CB 3.7Å; W49-L107 HydrophobicContact CH2-CD1 3.64Å; W49-L107 HydrophobicContact CH2-CG 4.32Å; W49-L107 HydrophobicContact CZ2-CD1 4.26Å; W49-L107 HydrophobicContact CZ3-CB 4.07Å
50Y55.8Low58.1Low56 Ų5676.5 Ų76.522%0.2240%0.395CS..Hα-helixtrans-68.7-37173.9-92.3-83.5000112.8L29 S46 Y47 G52 G53 L54 L156L29-Y50 HydrophobicContact CB-CD1 4.28Å; L29-Y50 HydrophobicContact CB-CE1 4.07Å; L29-Y50 HydrophobicContact CD1-CE1 4.12Å; L29-Y50 HydrophobicContact CD2-CE1 4.1Å; L29-Y50 HydrophobicContact CG-CE1 4.31Å; S46-Y50 WeakPolarHBondContact O-CB 3.29Å; S46-Y50 WeakPolarHBondContact O-CD2 3.43Å; S46-Y50 PolarHBondContact O-N 2.87Å; Y47-Y50 PolarHBondContact O-N 2.85Å; Y50-G52 PolarHBondContact O-N 3.46Å; Y50-G53 PolarHBondContact O-N 2.94Å; Y50-L54 PolarHBondContact O-N 3.32Å; Y50-L156 HydrophobicContact CE1-CD2 4.47Å
51F58.6Low59.6Low82 Ų8267.9 Ų67.936%0.3636%0.355SS..Hα-helixtrans-63.5-28.3171.4-110.2-95.7000112.4L30 Y47 I48 G53 L54 G55L30-F51 HydrophobicContact CD1-CD2 4.26Å; L30-F51 HydrophobicContact CD1-CE2 4.16Å; L30-F51 HydrophobicContact CD2-CE2 3.77Å; L30-F51 HydrophobicContact CD2-CZ 4.48Å; Y47-F51 HydrophobicContact CD1-CD2 4.07Å; Y47-F51 HydrophobicContact CD2-CD2 4.34Å; Y47-F51 HydrophobicContact CD2-CE2 4.45Å; Y47-F51 AromaticContact CE1-CD2 3.65Å; Y47-F51 HydrophobicContact CE1-CD2 3.65Å; Y47-F51 AromaticContact CE1-CE2 3.73Å; Y47-F51 HydrophobicContact CE1-CE2 3.73Å; Y47-F51 HydrophobicContact CE1-CG 4.45Å; Y47-F51 AromaticContact CE2-CD2 3.97Å; Y47-F51 HydrophobicContact CE2-CD2 3.97Å; Y47-F51 AromaticContact CE2-CE2 3.65Å; Y47-F51 HydrophobicContact CE2-CE2 3.65Å; Y47-F51 HydrophobicContact CG-CD2 4.4Å; Y47-F51 AromaticContact CZ-CD2 3.6Å; Y47-F51 AromaticContact CZ-CE2 3.22Å; Y47-F51 WeakPolarHBondContact O-CB 3.33Å; Y47-F51 PolarHBondContact O-N 3.09Å; Y47-F51 WeakPolarHBondContact OH-CE2 3.26Å; I48-F51 PolarHBondContact O-N 3.48Å; F51-G53 VanDerWaalsContact C-N 3.29Å; F51-G53 PolarHBondContact O-N 2.85Å; F51-L54 HydrophobicContact CD1-CD2 4.15Å; F51-L54 HydrophobicContact CE1-CD2 3.82Å; F51-L54 HydrophobicContact CZ-CD2 4.2Å; F51-L54 PolarHBondContact O-N 3.45Å; F51-G55 PolarHBondContact O-N 3.19Å
52G57.4Low61.1Low19 Ų1962.1 Ų62.120%0.19633%0.329CS..Hα-helixtrans-56.8-41.8168.800000112.2I48 W49 Y50 G55 G56 Y100I48-G52 PolarHBondContact O-N 3.03Å; W49-G52 PolarHBondContact O-N 3.43Å; Y50-G52 PolarHBondContact O-N 3.46Å; G52-G55 PolarHBondContact O-N 3.36Å; G52-G56 PolarHBondContact O-N 3.1Å; G52-Y100 WeakPolarHBondContact O-CE1 3.33Å
53G60.8Low62.8Low2 Ų258.6 Ų58.62%0.02131%0.309CS..Hα-helixtrans-65.2-42.3175.700000113.3Y50 F51 G55 G57Y50-G53 PolarHBondContact O-N 2.94Å; F51-G53 VanDerWaalsContact C-N 3.29Å; F51-G53 PolarHBondContact O-N 2.85Å; G53-G55 VanDerWaalsContact C-N 3.34Å; G53-G55 PolarHBondContact O-N 3.38Å; G53-G57 PolarHBondContact O-N 2.89Å
54L65.6Low64.2Low43 Ų4354.2 Ų54.223%0.22529%0.293CS..Iπ-helixtrans-62-41.6174.9-162.889.5000111.7N26 Y50 F51 G58 L59N26-L54 HydrophobicContact CB-CB 4.31Å; N26-L54 HydrophobicContact CB-CD1 3.44Å; N26-L54 VanDerWaalsContact CB-CD1 3.44Å; N26-L54 HydrophobicContact CB-CG 4.45Å; Y50-L54 PolarHBondContact O-N 3.32Å; F51-L54 HydrophobicContact CD1-CD2 4.15Å; F51-L54 HydrophobicContact CE1-CD2 3.82Å; F51-L54 HydrophobicContact CZ-CD2 4.2Å; F51-L54 PolarHBondContact O-N 3.45Å; L54-G58 PolarHBondContact O-N 3.35Å; L54-L59 PolarHBondContact O-N 3.34Å; L54-L59 VanDerWaalsContact O-N 3.16Å
55G64.1Low65.9Low35 Ų3548.1 Ų48.136%0.36126%0.261SS..Iπ-helixtrans-70.4-46.117800000113.2F51 G52 G53 L60F51-G55 PolarHBondContact O-N 3.19Å; G52-G55 PolarHBondContact O-N 3.36Å; G53-G55 VanDerWaalsContact C-N 3.34Å; G53-G55 PolarHBondContact O-N 3.38Å; G55-L60 WeakPolarHBondContact O-CB 3.37Å; G55-L60 PolarHBondContact O-N 3.1Å
56G63.1Low67.5Low10 Ų1048.6 Ų48.610%0.10326%0.256CS..Iπ-helixtrans-83.3-40.3-17300000115.6G52 L60 G97G52-G56 PolarHBondContact O-N 3.1Å; G56-L60 WeakPolarHBondContact O-CB 3.31Å; G56-G97 CarbonylContact O-C 3.3Å; G56-G97 VanDerWaalsContact O-C 3.3Å; G56-G97 WeakPolarHBondContact O-CA 3.49Å
57G64.1Low68.8Low0 Ų047.5 Ų47.50%025%0.249CC..Iπ-helixtrans-95.8-27.4-17800000114.5S22 G53 M61S22-G57 PolarHBondContact OG-O 2.93Å; S22-G57 VanDerWaalsContact OG-O 3.05Å; G53-G57 PolarHBondContact O-N 2.89Å; G57-M61 WeakPolarHBondContact O-CB 3.29Å; G57-M61 WeakPolarHBondContact O-CG 3.43Å
58G71.4Confident70.1Confident0 Ų042.7 Ų42.70%023%0.23CC..Iπ-helixtrans-94.6-70.518000000112.6S22 L54 M61S22-G58 WeakPolarHBondContact OG-CA 3.34Å; L54-G58 PolarHBondContact O-N 3.35Å; G58-M61 PolarHBondContact O-N 3.25Å
59L75.7Confident71.3Confident121 Ų12138.7 Ų38.763%0.63421%0.21SC*.Iπ-helixtrans-69.5-40.8-171.4-160.176000112.6L54 M61 L62L54-L59 PolarHBondContact O-N 3.34Å; L54-L59 VanDerWaalsContact O-N 3.16Å; L59-M61 PolarHBondContact O-N 3.3Å; L59-L62 HydrophobicContact CD1-CD1 4.15Å; L59-L62 WeakPolarHBondContact O-CB 3.32Å; L59-L62 PolarHBondContact O-N 3.23Å
60L80.9Confident72Confident56 Ų5636.9 Ų36.929%0.29321%0.211SC..Hα-helixtrans-65.5-27.7178.7-156.271.4000112.3G55 G56 L62 I63 P64 I93G55-L60 WeakPolarHBondContact O-CB 3.37Å; G55-L60 PolarHBondContact O-N 3.1Å; G56-L60 WeakPolarHBondContact O-CB 3.31Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-I63 HydrophobicContact CD1-CD1 4.03Å; L60-I63 PolarHBondContact O-N 3.41Å; L60-P64 WeakPolarHBondContact O-CD 3.28Å; L60-I93 HydrophobicContact CD1-CG2 3.82Å; L60-I93 HydrophobicContact CD2-CG2 3.93Å; L60-I93 HydrophobicContact CG-CG2 3.61Å
61M81.1Confident72.5Confident0 Ų035.8 Ų35.80%021%0.209CC..Hα-helixtrans-77.2-17.1177.8-66.5-57.5-60.300113.5L15 A19 G57 G58 L59 I63 P64 A65 G94 E166L15-M61 HydrophobicContact CD2-CE 3.47Å; L15-M61 VanDerWaalsContact CD2-CE 3.47Å; A19-M61 HydrophobicContact CB-CB 4.05Å; G57-M61 WeakPolarHBondContact O-CB 3.29Å; G57-M61 WeakPolarHBondContact O-CG 3.43Å; G58-M61 PolarHBondContact O-N 3.25Å; L59-M61 PolarHBondContact O-N 3.3Å; M61-I63 VanDerWaalsContact C-N 3.3Å; M61-I63 PolarHBondContact O-N 3.24Å; M61-P64 HydrophobicContact CE-CG 4.34Å; M61-P64 VanDerWaalsContact O-CD 3.3Å; M61-P64 WeakPolarHBondContact O-CD 3.45Å; M61-P64 WeakPolarHBondContact O-CG 3.34Å; M61-P64 HydrophobicContact SD-CG 4.45Å; M61-A65 WeakPolarHBondContact O-CB 3.39Å; M61-A65 PolarHBondContact O-N 2.94Å; M61-G94 VanDerWaalsContact SD-O 3.38Å; M61-E166 HydrophobicContact CE-CB 3.53Å; M61-E166 HydrophobicContact CE-CG 3.76Å
62L81.3Confident72.3Confident52 Ų5232.6 Ų32.627%0.27220%0.199SC..Hα-helixtrans-68.6-30.4171.4-65.2177.2000112.3L16 A19 L59 L60 A65 V66L16-L62 HydrophobicContact CD1-CD2 4.25Å; A19-L62 HydrophobicContact CB-CD2 3.97Å; L59-L62 HydrophobicContact CD1-CD1 4.15Å; L59-L62 WeakPolarHBondContact O-CB 3.32Å; L59-L62 PolarHBondContact O-N 3.23Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L62-A65 PolarHBondContact O-N 3.49Å; L62-V66 VanDerWaalsContact O-CG2 3.32Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 2.88Å
63I82.8Confident72.2Confident88 Ų8838.5 Ų38.545%0.45122%0.219SC..Hα-helixtrans-61.2-56.2177.9-56.6176.3000111.3L60 M61 A65 V66 A67L60-I63 HydrophobicContact CD1-CD1 4.03Å; L60-I63 PolarHBondContact O-N 3.41Å; M61-I63 VanDerWaalsContact C-N 3.3Å; M61-I63 PolarHBondContact O-N 3.24Å; I63-A65 VanDerWaalsContact C-N 3.35Å; I63-A65 PolarHBondContact O-N 3.41Å; I63-V66 PolarHBondContact O-N 3.49Å; I63-A67 WeakPolarHBondContact O-CB 3.39Å; I63-A67 PolarHBondContact O-N 3.4Å
64P80.7Confident71.7Confident0 Ų041.9 Ų41.90%024%0.242CC..Hα-helixtrans-64.2-36174.322.7-29.7000112.9L60 M61 V66 A67 F68 A90L60-P64 WeakPolarHBondContact O-CD 3.28Å; M61-P64 HydrophobicContact CE-CG 4.34Å; M61-P64 VanDerWaalsContact O-CD 3.3Å; M61-P64 WeakPolarHBondContact O-CD 3.45Å; M61-P64 WeakPolarHBondContact O-CG 3.34Å; M61-P64 HydrophobicContact SD-CG 4.45Å; P64-V66 PolarHBondContact O-N 3.44Å; P64-A67 PolarHBondContact O-N 2.96Å; P64-F68 HydrophobicContact CB-CE1 4.14Å; P64-F68 HydrophobicContact CB-CE2 4.17Å; P64-F68 HydrophobicContact CB-CZ 3.82Å; P64-F68 WeakPolarHBondContact O-CB 3.37Å; P64-F68 VanDerWaalsContact O-CD1 3.23Å; P64-F68 WeakPolarHBondContact O-CD1 3.17Å; P64-F68 WeakPolarHBondContact O-CG 3.45Å; P64-F68 PolarHBondContact O-N 3.08Å; P64-A90 HydrophobicContact CB-CB 4.35Å; P64-A90 WeakPolarHBondContact CB-O 3.13Å
65A82.3Confident70.6Confident0 Ų045.3 Ų45.30%027%0.27CS..Hα-helixtrans-58.6-49.5177.300000111.8L15 M61 L62 I63 F68 I69L15-A65 HydrophobicContact CB-CB 3.96Å; M61-A65 WeakPolarHBondContact O-CB 3.39Å; M61-A65 PolarHBondContact O-N 2.94Å; L62-A65 PolarHBondContact O-N 3.49Å; I63-A65 VanDerWaalsContact C-N 3.35Å; I63-A65 PolarHBondContact O-N 3.41Å; A65-F68 PolarHBondContact O-N 3.4Å; A65-I69 WeakPolarHBondContact O-CD1 3.42Å; A65-I69 VanDerWaalsContact O-CG1 3.27Å; A65-I69 WeakPolarHBondContact O-CG1 3.24Å; A65-I69 PolarHBondContact O-N 3.09Å; A65-I69 VanDerWaalsContact O-N 3.1Å
66V80.8Confident69.7Low85 Ų8549.2 Ų49.252%0.51529%0.29SS..Hα-helixtrans-65.3-44.4177.4174.40000110.7L62 I63 P64 F68 I69 T70L62-V66 VanDerWaalsContact O-CG2 3.32Å; L62-V66 WeakPolarHBondContact O-CG2 3.45Å; L62-V66 PolarHBondContact O-N 2.88Å; I63-V66 PolarHBondContact O-N 3.49Å; P64-V66 PolarHBondContact O-N 3.44Å; V66-F68 VanDerWaalsContact C-N 3.29Å; V66-F68 PolarHBondContact O-N 3.39Å; V66-I69 PolarHBondContact O-N 2.88Å; V66-T70 HydrophobicContact CG1-CG2 4.26Å; V66-T70 WeakPolarHBondContact O-CG2 3.41Å; V66-T70 PolarHBondContact O-N 3.34Å; V66-T70 PolarHBondContact O-OG1 3.44Å
67A79.6Confident68.8Low22 Ų2254.3 Ų54.318%0.18232%0.323CS..Hα-helixtrans-58.6-39.6177.500000112.3I63 P64 T70 L71 A90I63-A67 WeakPolarHBondContact O-CB 3.39Å; I63-A67 PolarHBondContact O-N 3.4Å; P64-A67 PolarHBondContact O-N 2.96Å; A67-T70 PolarHBondContact O-OG1 3.45Å; A67-L71 WeakPolarHBondContact O-CD1 3.25Å; A67-L71 VanDerWaalsContact O-CG 3.25Å; A67-L71 WeakPolarHBondContact O-CG 3.29Å; A67-L71 PolarHBondContact O-N 3.3Å; A67-A90 HydrophobicContact CB-CB 3.66Å
68F79Confident67.8Low0 Ų064.5 Ų64.50%036%0.361CS..Hα-helixtrans-74.1-33.4-179.3-62.8-3.3000112.2L15 P64 A65 V66 L71 A90 A91 Q173L15-F68 HydrophobicContact CD1-CD2 3.46Å; L15-F68 VanDerWaalsContact CD1-CD2 3.46Å; L15-F68 HydrophobicContact CD1-CE2 3.54Å; P64-F68 HydrophobicContact CB-CE1 4.14Å; P64-F68 HydrophobicContact CB-CE2 4.17Å; P64-F68 HydrophobicContact CB-CZ 3.82Å; P64-F68 WeakPolarHBondContact O-CB 3.37Å; P64-F68 VanDerWaalsContact O-CD1 3.23Å; P64-F68 WeakPolarHBondContact O-CD1 3.17Å; P64-F68 WeakPolarHBondContact O-CG 3.45Å; P64-F68 PolarHBondContact O-N 3.08Å; A65-F68 PolarHBondContact O-N 3.4Å; V66-F68 VanDerWaalsContact C-N 3.29Å; V66-F68 PolarHBondContact O-N 3.39Å; F68-L71 HydrophobicContact CD1-CD1 4.26Å; F68-A90 HydrophobicContact CE1-CB 4.33Å; F68-A91 HydrophobicContact CE1-CB 4.29Å; F68-A91 HydrophobicContact CZ-CB 3.9Å; F68-Q173 HydrophobicContact CD1-CG 3.78Å; F68-Q173 HydrophobicContact CD2-CB 4.28Å; F68-Q173 HydrophobicContact CD2-CG 3.97Å; F68-Q173 HydrophobicContact CE1-CB 4.27Å; F68-Q173 HydrophobicContact CE1-CG 3.42Å; F68-Q173 VanDerWaalsContact CE1-CG 3.42Å; F68-Q173 HydrophobicContact CE2-CB 3.65Å; F68-Q173 HydrophobicContact CE2-CG 3.61Å; F68-Q173 HydrophobicContact CG-CG 4.08Å; F68-Q173 HydrophobicContact CZ-CB 3.66Å; F68-Q173 HydrophobicContact CZ-CG 3.33Å
69I76.8Confident66.7Low32 Ų3270.3 Ų70.316%0.16439%0.393CS..Hα-helixtrans-68.9-39.6174.7-67.7166.1000111.3L13 A65 V66 G72L13-I69 HydrophobicContact CD2-CD1 4.47Å; A65-I69 WeakPolarHBondContact O-CD1 3.42Å; A65-I69 VanDerWaalsContact O-CG1 3.27Å; A65-I69 WeakPolarHBondContact O-CG1 3.24Å; A65-I69 PolarHBondContact O-N 3.09Å; A65-I69 VanDerWaalsContact O-N 3.1Å; V66-I69 PolarHBondContact O-N 2.88Å; I69-G72 PolarHBondContact O-N 2.9Å
70T70.4Confident65.6Low72 Ų7268.7 Ų68.744%0.44238%0.382SS..Hα-helixtrans-71.4-32-178.254.30000112.7V66 A67 G72 K73V66-T70 HydrophobicContact CG1-CG2 4.26Å; V66-T70 WeakPolarHBondContact O-CG2 3.41Å; V66-T70 PolarHBondContact O-N 3.34Å; V66-T70 PolarHBondContact O-OG1 3.44Å; A67-T70 PolarHBondContact O-OG1 3.45Å; T70-G72 PolarHBondContact O-N 3.48Å; T70-G72 VanDerWaalsContact O-N 3.17Å; T70-K73 PolarHBondContact O-N 3.22Å; T70-K73 VanDerWaalsContact O-N 3.13Å
71L65.8Low64.3Low33 Ų3370.7 Ų70.717%0.17340%0.4CS..Hα-helixtrans-55.1-31.8170.3-71.3161.5000112.4V5 A67 F68 K73 M83V5-L71 WeakPolarHBondContact CG1-O 3.34Å; A67-L71 WeakPolarHBondContact O-CD1 3.25Å; A67-L71 VanDerWaalsContact O-CG 3.25Å; A67-L71 WeakPolarHBondContact O-CG 3.29Å; A67-L71 PolarHBondContact O-N 3.3Å; F68-L71 HydrophobicContact CD1-CD1 4.26Å; L71-K73 VanDerWaalsContact C-N 3.32Å; L71-K73 PolarHBondContact O-N 3.29Å; L71-M83 HydrophobicContact CD2-CB 4.37Å; L71-M83 HydrophobicContact CD2-CE 4.43Å
72G55.8Low63.1Low15 Ų1576.8 Ų76.816%0.15543%0.432CS..THydrogen-bonded Turntrans-77.3-5-179.600000116.5R9 I69 T70R9-G72 PolarHBondContact NH1-O 2.91Å; I69-G72 PolarHBondContact O-N 2.9Å; T70-G72 PolarHBondContact O-N 3.48Å; T70-G72 VanDerWaalsContact O-N 3.17Å
73K53.9Low62.1Low142 Ų14277 Ų7762%0.61743%0.433SS*.THydrogen-bonded Turntrans-108.4-15.8-173.5-84.6-168164.994.30114.9T70 L71 S75T70-K73 PolarHBondContact O-N 3.22Å; T70-K73 VanDerWaalsContact O-N 3.13Å; L71-K73 VanDerWaalsContact C-N 3.32Å; L71-K73 PolarHBondContact O-N 3.29Å; K73-S75 PolarHBondContact O-N 2.93Å
74C49.9Very low61.1Low73 Ų7375.8 Ų75.849%0.49343%0.426SS..  trans-91.3101.7-175.1-76.40000112.4C76 M83C74-C76 PolarHBondContact O-N 2.98Å; C74-M83 HydrophobicContact CB-CE 3.83Å; C74-M83 HydrophobicContact CB-SD 4.36Å
75S43.6Very low60.3Low116 Ų11679.2 Ų79.281%0.81145%0.449SS*.  trans-74.2103161.7-62.90000109.9K73 C77K73-S75 PolarHBondContact O-N 2.93Å; S75-C77 PolarHBondContact O-N 3.28Å
76C45.4Very low59.7Low117 Ų11780.8 Ų80.879%0.79147%0.465SS*.SBendtrans69.2-5.9148.6-63.30000124.4C74C74-C76 PolarHBondContact O-N 2.98Å
77C43.3Very low59.5Low116 Ų11677 Ų7778%0.78444%0.442SS*.  trans-139.526.2-171.9-70.10000119S75S75-C77 PolarHBondContact O-N 3.28Å
78W42.5Very low59.5Low215 Ų21577.5 Ų77.581%0.81444%0.443SS*.SBendtrans-128.2141.8173-9262000111.3E80W78-E80 PolarHBondContact O-N 3.01Å
79N48.7Very low59.7Low122 Ų12282.1 Ų82.165%0.65247%0.467SS*.  trans-23.686.5-177.3-116.5-2.9000114.5S81 L82 M83N79-S81 PolarHBondContact O-N 3.36Å; N79-L82 HydrophobicContact CB-CB 4.23Å; N79-L82 PolarHBondContact O-N 3.5Å; N79-M83 PolarHBondContact O-N 2.87Å
80E54.1Low60.1Low86 Ų8680.9 Ų80.940%0.40246%0.461SS..Hα-helixtrans-63-31.6-170.7-71.3-178122.900112.2W78 L82 M83 M84 R184W78-E80 PolarHBondContact O-N 3.01Å; E80-L82 VanDerWaalsContact C-N 3.34Å; E80-L82 PolarHBondContact O-N 2.91Å; E80-M83 PolarHBondContact O-N 3.48Å; E80-M84 VanDerWaalsContact O-CB 3.31Å; E80-M84 WeakPolarHBondContact O-CB 3.37Å; E80-M84 WeakPolarHBondContact O-CG 3.35Å; E80-M84 PolarHBondContact O-N 3.33Å; E80-R184 VanDerWaalsContact CD-NH1 3.33Å; E80-R184 IonicContact OE1-CZ 3.69Å; E80-R184 IonicContact OE1-NH1 3.68Å; E80-R184 IonicContact OE1-NH2 2.78Å; E80-R184 PolarHBondContact OE1-NH2 3.31Å; E80-R184 IonicContact OE2-CZ 3.32Å; E80-R184 VanDerWaalsContact OE2-CZ 3.32Å; E80-R184 IonicContact OE2-NH1 2.71Å; E80-R184 PolarHBondContact OE2-NH1 3.34Å; E80-R184 IonicContact OE2-NH2 3.05Å; E80-R184 PolarHBondContact OE2-NH2 3.38Å
81S53.2Low60.9Low98 Ų9877.4 Ų77.469%0.68544%0.44SS*.Hα-helixtrans-64.1-36.6176.8-560000112.6N79 C85N79-S81 PolarHBondContact O-N 3.36Å; S81-C85 WeakPolarHBondContact O-CB 3.43Å; S81-C85 PolarHBondContact O-N 3.36Å; S81-C85 VanDerWaalsContact O-N 3.11Å
82L55.9Low62Low129 Ų12979.3 Ų79.368%0.67545%0.45SS*.Hα-helixtrans-74.1-38.3179.9-169.268.7000111.3N79 E80 G86N79-L82 HydrophobicContact CB-CB 4.23Å; N79-L82 PolarHBondContact O-N 3.5Å; E80-L82 VanDerWaalsContact C-N 3.34Å; E80-L82 PolarHBondContact O-N 2.91Å; L82-G86 PolarHBondContact O-N 3.19Å
83M59.9Low63.6Low56 Ų5681.5 Ų81.528%0.27646%0.458SS..Hα-helixtrans-73.5-40.2178.3-69.5-178.865.400112.7L71 C74 N79 E80 G86 S87L71-M83 HydrophobicContact CD2-CB 4.37Å; L71-M83 HydrophobicContact CD2-CE 4.43Å; C74-M83 HydrophobicContact CB-CE 3.83Å; C74-M83 HydrophobicContact CB-SD 4.36Å; N79-M83 PolarHBondContact O-N 2.87Å; E80-M83 PolarHBondContact O-N 3.48Å; M83-G86 PolarHBondContact O-N 3.4Å; M83-S87 PolarHBondContact O-N 2.88Å
84M61.2Low65.3Low63 Ų6374.8 Ų74.831%0.3143%0.428SS..Hα-helixtrans-64.2-46.9175.2-71.4-80-173.400111E80 G86 S87 V88 N180E80-M84 VanDerWaalsContact O-CB 3.31Å; E80-M84 WeakPolarHBondContact O-CB 3.37Å; E80-M84 WeakPolarHBondContact O-CG 3.35Å; E80-M84 PolarHBondContact O-N 3.33Å; M84-G86 VanDerWaalsContact C-N 3.33Å; M84-G86 PolarHBondContact O-N 3.14Å; M84-S87 PolarHBondContact O-N 3.11Å; M84-S87 PolarHBondContact O-OG 3.33Å; M84-V88 PolarHBondContact O-N 3.47Å; M84-N180 HydrophobicContact CE-CB 4.42Å; M84-N180 HydrophobicContact SD-CB 4.22Å
85C63.4Low67.3Low72 Ų7272.5 Ų72.549%0.48641%0.411SS..Hα-helixtrans-63.6-40176.5-159.30000111.4S81 S87 V88 L89S81-C85 WeakPolarHBondContact O-CB 3.43Å; S81-C85 PolarHBondContact O-N 3.36Å; S81-C85 VanDerWaalsContact O-N 3.11Å; C85-S87 VanDerWaalsContact C-N 3.34Å; C85-S87 PolarHBondContact O-N 2.8Å; C85-V88 PolarHBondContact O-N 3.05Å; C85-L89 WeakPolarHBondContact O-CB 3.3Å; C85-L89 VanDerWaalsContact O-CG 3.29Å; C85-L89 WeakPolarHBondContact O-CG 3.35Å; C85-L89 PolarHBondContact O-N 3.42Å
86G70.4Confident69.5Low32 Ų3272.7 Ų72.733%0.3340%0.402SS..Hα-helixtrans-59.9-38.8174.100000113.5L82 M83 M84 A90L82-G86 PolarHBondContact O-N 3.19Å; M83-G86 PolarHBondContact O-N 3.4Å; M84-G86 VanDerWaalsContact C-N 3.33Å; M84-G86 PolarHBondContact O-N 3.14Å; G86-A90 VanDerWaalsContact O-CB 3.23Å; G86-A90 WeakPolarHBondContact O-CB 3.48Å; G86-A90 PolarHBondContact O-N 3.44Å
87S76.2Confident71.5Confident5 Ų567.2 Ų67.24%0.03537%0.365CS..Hα-helixtrans-67.3-39.2177.176.40000113.6M83 M84 C85 A91M83-S87 PolarHBondContact O-N 2.88Å; M84-S87 PolarHBondContact O-N 3.11Å; M84-S87 PolarHBondContact O-OG 3.33Å; C85-S87 VanDerWaalsContact C-N 3.34Å; C85-S87 PolarHBondContact O-N 2.8Å; S87-A91 WeakPolarHBondContact O-CB 3.39Å; S87-A91 PolarHBondContact O-N 3.01Å
88V80.3Confident73.8Confident33 Ų3361.7 Ų61.720%0.233%0.328CS..Hα-helixtrans-68.3-46.1177.2169.30000110.3M84 C85 A90 A91 I92 L174M84-V88 PolarHBondContact O-N 3.47Å; C85-V88 PolarHBondContact O-N 3.05Å; V88-A90 VanDerWaalsContact C-N 3.34Å; V88-A90 PolarHBondContact O-N 2.88Å; V88-A91 PolarHBondContact O-N 3.49Å; V88-I92 HydrophobicContact CG1-CD1 4.04Å; V88-I92 WeakPolarHBondContact O-CG1 3.18Å; V88-I92 PolarHBondContact O-N 3.13Å; V88-L174 HydrophobicContact CG1-CD1 3.75Å
89L83.3Confident76Confident97 Ų9752.7 Ų52.751%0.50830%0.302SS..Hα-helixtrans-60.3-44.3175.7-70.8172.9000111.6C85 A91 I92 I93C85-L89 WeakPolarHBondContact O-CB 3.3Å; C85-L89 VanDerWaalsContact O-CG 3.29Å; C85-L89 WeakPolarHBondContact O-CG 3.35Å; C85-L89 PolarHBondContact O-N 3.42Å; L89-A91 VanDerWaalsContact C-N 3.33Å; L89-A91 PolarHBondContact O-N 3.38Å; L89-I92 PolarHBondContact O-N 2.95Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.28Å; L89-I93 PolarHBondContact O-N 3.13Å
90A85.7Confident77.9Confident6 Ų651.9 Ų51.95%0.0529%0.29CS..Hα-helixtrans-62.9-40.3176.200000111.8P64 A67 F68 G86 V88 I93 G94P64-A90 HydrophobicContact CB-CB 4.35Å; P64-A90 WeakPolarHBondContact CB-O 3.13Å; A67-A90 HydrophobicContact CB-CB 3.66Å; F68-A90 HydrophobicContact CE1-CB 4.33Å; G86-A90 VanDerWaalsContact O-CB 3.23Å; G86-A90 WeakPolarHBondContact O-CB 3.48Å; G86-A90 PolarHBondContact O-N 3.44Å; V88-A90 VanDerWaalsContact C-N 3.34Å; V88-A90 PolarHBondContact O-N 2.88Å; A90-I93 PolarHBondContact O-N 3.38Å; A90-G94 PolarHBondContact O-N 3.38Å
91A87.4Confident79.4Confident0 Ų047.8 Ų47.80%027%0.271CS..Hα-helixtrans-63.1-42.2175.300000112F68 S87 V88 L89 G94 L95 L174F68-A91 HydrophobicContact CE1-CB 4.29Å; F68-A91 HydrophobicContact CZ-CB 3.9Å; S87-A91 WeakPolarHBondContact O-CB 3.39Å; S87-A91 PolarHBondContact O-N 3.01Å; V88-A91 PolarHBondContact O-N 3.49Å; L89-A91 VanDerWaalsContact C-N 3.33Å; L89-A91 PolarHBondContact O-N 3.38Å; A91-G94 PolarHBondContact O-N 2.89Å; A91-L95 WeakPolarHBondContact O-CG 3.49Å; A91-L95 PolarHBondContact O-N 3.24Å; A91-L174 HydrophobicContact CB-CB 4.05Å; A91-L174 HydrophobicContact CB-CD1 4.46Å
92I88.9Confident81.2Confident73 Ų7347.9 Ų47.937%0.37426%0.26SS..Hα-helixtrans-61.3-45.1175-67.2164.9000110.8V88 L89 G94 L95 L96 L174V88-I92 HydrophobicContact CG1-CD1 4.04Å; V88-I92 WeakPolarHBondContact O-CG1 3.18Å; V88-I92 PolarHBondContact O-N 3.13Å; L89-I92 PolarHBondContact O-N 2.95Å; I92-G94 VanDerWaalsContact C-N 3.29Å; I92-G94 PolarHBondContact O-N 3.09Å; I92-L95 PolarHBondContact O-N 3.16Å; I92-L96 HydrophobicContact CG2-CD1 4.24Å; I92-L96 WeakPolarHBondContact O-CG 3.42Å; I92-L96 PolarHBondContact O-N 3.16Å; I92-L174 HydrophobicContact CG1-CD1 4.17Å
93I89.3Confident82.8Confident61 Ų6145.6 Ų45.631%0.31325%0.251SS..Hα-helixtrans-58.9-43.3175.4-69.5165.4000110.5L60 L89 A90 L96 G97L60-I93 HydrophobicContact CD1-CG2 3.82Å; L60-I93 HydrophobicContact CD2-CG2 3.93Å; L60-I93 HydrophobicContact CG-CG2 3.61Å; L89-I93 VanDerWaalsContact O-CG1 3.31Å; L89-I93 WeakPolarHBondContact O-CG1 3.28Å; L89-I93 PolarHBondContact O-N 3.13Å; A90-I93 PolarHBondContact O-N 3.38Å; I93-L96 PolarHBondContact O-N 3.5Å; I93-G97 PolarHBondContact O-N 3.36Å
94G89.2Confident84Confident0 Ų043.6 Ų43.60%024%0.241CC..Hα-helixtrans-63.4-38.8175.500000113.6M61 A90 A91 I92 G97 S98M61-G94 VanDerWaalsContact SD-O 3.38Å; A90-G94 PolarHBondContact O-N 3.38Å; A91-G94 PolarHBondContact O-N 2.89Å; I92-G94 VanDerWaalsContact C-N 3.29Å; I92-G94 PolarHBondContact O-N 3.09Å; G94-G97 PolarHBondContact O-N 3.06Å; G94-S98 WeakPolarHBondContact O-CB 3.42Å; G94-S98 PolarHBondContact O-N 3.43Å; G94-S98 PolarHBondContact O-OG 2.9Å
95L91.7Very high85.2Confident25 Ų2540.8 Ų40.813%0.13123%0.227CC..Hα-helixtrans-64.6-41.6174.2-68.6171.7000112A91 I92 S98 G99 F167 C170 L171 L174A91-L95 WeakPolarHBondContact O-CG 3.49Å; A91-L95 PolarHBondContact O-N 3.24Å; I92-L95 PolarHBondContact O-N 3.16Å; L95-S98 PolarHBondContact O-OG 3.39Å; L95-G99 PolarHBondContact O-N 2.87Å; L95-F167 HydrophobicContact CB-CE2 4.35Å; L95-F167 HydrophobicContact CD2-CD2 3.65Å; L95-F167 HydrophobicContact CD2-CE2 3.68Å; L95-F167 HydrophobicContact CD2-CG 4.08Å; L95-F167 HydrophobicContact CD2-CZ 4.14Å; L95-F167 WeakPolarHBondContact CD2-O 3.39Å; L95-C170 HydrophobicContact CD2-CB 3.7Å; L95-C170 HydrophobicContact CG-CB 3.89Å; L95-L171 HydrophobicContact CD1-CD2 3.89Å; L95-L171 HydrophobicContact CD2-CB 4.41Å; L95-L171 HydrophobicContact CD2-CD2 3.68Å; L95-L171 HydrophobicContact CD2-CG 3.61Å; L95-L171 HydrophobicContact CG-CD2 4.46Å; L95-L174 HydrophobicContact CD1-CD2 3.63Å
96L90.3Very high86.4Confident121 Ų12138.2 Ų38.263%0.63421%0.213SC*.Hα-helixtrans-65.9-42175.7-68.1174000111.3I92 I93 Y100I92-L96 HydrophobicContact CG2-CD1 4.24Å; I92-L96 WeakPolarHBondContact O-CG 3.42Å; I92-L96 PolarHBondContact O-N 3.16Å; I93-L96 PolarHBondContact O-N 3.5Å; L96-Y100 WeakPolarHBondContact O-CB 3.25Å; L96-Y100 PolarHBondContact O-N 2.95Å
97G87.7Confident87.1Confident1 Ų140.6 Ų40.61%0.0122%0.218CC..Hα-helixtrans-64.3-54.1178.200000113.6G56 I93 G94 G99 Y100 C101G56-G97 CarbonylContact O-C 3.3Å; G56-G97 VanDerWaalsContact O-C 3.3Å; G56-G97 WeakPolarHBondContact O-CA 3.49Å; I93-G97 PolarHBondContact O-N 3.36Å; G94-G97 PolarHBondContact O-N 3.06Å; G97-G99 PolarHBondContact O-N 3.32Å; G97-Y100 PolarHBondContact O-N 3.19Å; G97-C101 WeakPolarHBondContact O-CB 3.21Å; G97-C101 PolarHBondContact O-N 2.88Å
98S90.1Very high87.4Confident1 Ų140.8 Ų40.81%0.00722%0.22CC..Hα-helixtrans-62.9-40.6177.354.40000112.1G94 L95 C101 F102G94-S98 WeakPolarHBondContact O-CB 3.42Å; G94-S98 PolarHBondContact O-N 3.43Å; G94-S98 PolarHBondContact O-OG 2.9Å; L95-S98 PolarHBondContact O-OG 3.39Å; S98-C101 PolarHBondContact O-N 3.33Å; S98-F102 WeakPolarHBondContact O-CB 3.38Å; S98-F102 PolarHBondContact O-N 2.7Å
99G89.7Confident87.6Confident25 Ų2540 Ų4026%0.25821%0.214SC..Hα-helixtrans-62.6-43.6174.300000112.7L95 G97 F102 V103L95-G99 PolarHBondContact O-N 2.87Å; G97-G99 PolarHBondContact O-N 3.32Å; G99-F102 PolarHBondContact O-N 3.44Å; G99-V103 WeakPolarHBondContact O-CG2 3.33Å; G99-V103 PolarHBondContact O-N 3.43Å; G99-V103 VanDerWaalsContact O-N 3.08Å
100Y87.1Confident87.6Confident105 Ų10539.2 Ų39.241%0.41221%0.21SC..Hα-helixtrans-61.8-47.3174.4-179-94000111.1G52 L96 G97 F102 V103 I104G52-Y100 WeakPolarHBondContact O-CE1 3.33Å; L96-Y100 WeakPolarHBondContact O-CB 3.25Å; L96-Y100 PolarHBondContact O-N 2.95Å; G97-Y100 PolarHBondContact O-N 3.19Å; Y100-F102 VanDerWaalsContact C-N 3.33Å; Y100-F102 PolarHBondContact O-N 3.02Å; Y100-V103 PolarHBondContact O-N 3.34Å; Y100-I104 HydrophobicContact CD1-CG1 3.93Å; Y100-I104 HydrophobicContact CD2-CG1 4.23Å; Y100-I104 HydrophobicContact CE1-CD1 4.31Å; Y100-I104 HydrophobicContact CE1-CG1 3.54Å; Y100-I104 HydrophobicContact CE2-CD1 4Å; Y100-I104 HydrophobicContact CE2-CG1 3.88Å; Y100-I104 HydrophobicContact CG-CG1 4.25Å; Y100-I104 WeakPolarHBondContact O-CB 3.45Å; Y100-I104 VanDerWaalsContact O-CG1 3.24Å; Y100-I104 WeakPolarHBondContact O-CG1 3.38Å; Y100-I104 PolarHBondContact O-N 3.44Å
101C86.9Confident87.5Confident1 Ų143.4 Ų43.41%0.00723%0.228CC..Hα-helixtrans-57.9-45.3177-173.60000111.4G97 S98 V103 I104 S105 A163G97-C101 WeakPolarHBondContact O-CB 3.21Å; G97-C101 PolarHBondContact O-N 2.88Å; S98-C101 PolarHBondContact O-N 3.33Å; C101-V103 PolarHBondContact O-N 3.03Å; C101-I104 PolarHBondContact O-N 2.86Å; C101-S105 VanDerWaalsContact O-CB 3.26Å; C101-S105 WeakPolarHBondContact O-CB 3.01Å; C101-S105 PolarHBondContact O-N 3.28Å; C101-S105 PolarHBondContact O-OG 2.86Å; C101-S105 VanDerWaalsContact O-OG 3.09Å; C101-A163 HydrophobicContact CB-CB 4.29Å
102F90.3Very high87Confident100 Ų10043.7 Ų43.744%0.43923%0.232SC..Hα-helixtrans-58.7-48.2177.8-178.3-94000112.6S98 G99 Y100 G106 L160 A163 V164S98-F102 WeakPolarHBondContact O-CB 3.38Å; S98-F102 PolarHBondContact O-N 2.7Å; G99-F102 PolarHBondContact O-N 3.44Å; Y100-F102 VanDerWaalsContact C-N 3.33Å; Y100-F102 PolarHBondContact O-N 3.02Å; F102-G106 PolarHBondContact O-N 3Å; F102-L160 HydrophobicContact CD2-CD2 3.54Å; F102-L160 HydrophobicContact CE2-CD2 3.73Å; F102-L160 HydrophobicContact CG-CD2 4.11Å; F102-L160 HydrophobicContact CZ-CD2 4.43Å; F102-L160 WeakPolarHBondContact O-CD2 3.3Å; F102-A163 HydrophobicContact CB-CB 4.16Å; F102-V164 HydrophobicContact CD2-CG2 3.83Å; F102-V164 HydrophobicContact CE2-CG2 3.74Å
103V89.1Confident86.6Confident81 Ų8140.5 Ų40.549%0.49122%0.216SC..Hα-helixtrans-65.7-46.7-179.2173.40000111.1G99 Y100 C101 G106 L107G99-V103 WeakPolarHBondContact O-CG2 3.33Å; G99-V103 PolarHBondContact O-N 3.43Å; G99-V103 VanDerWaalsContact O-N 3.08Å; Y100-V103 PolarHBondContact O-N 3.34Å; C101-V103 PolarHBondContact O-N 3.03Å; V103-G106 PolarHBondContact O-N 2.92Å; V103-L107 HydrophobicContact CG1-CD1 3.82Å; V103-L107 HydrophobicContact CG1-CG 4.42Å; V103-L107 WeakPolarHBondContact O-CB 3.14Å; V103-L107 VanDerWaalsContact O-CG 3.29Å; V103-L107 WeakPolarHBondContact O-CG 3.35Å; V103-L107 PolarHBondContact O-N 3.3Å
104I85.8Confident86Confident14 Ų1440.3 Ų40.37%0.07221%0.213CC..Hα-helixtrans-63.4-47.6179.6-67.4-59.6000111W49 Y100 C101 G106 L107 A108W49-I104 HydrophobicContact CD2-CD1 4.11Å; W49-I104 HydrophobicContact CE3-CD1 3.92Å; W49-I104 HydrophobicContact CE3-CG2 3.71Å; W49-I104 HydrophobicContact CH2-CB 4.42Å; W49-I104 HydrophobicContact CH2-CD1 3.17Å; W49-I104 HydrophobicContact CH2-CG1 4.31Å; W49-I104 HydrophobicContact CH2-CG2 4.4Å; W49-I104 HydrophobicContact CZ2-CD1 3.37Å; W49-I104 HydrophobicContact CZ3-CB 4.01Å; W49-I104 HydrophobicContact CZ3-CD1 3.47Å; W49-I104 VanDerWaalsContact CZ3-CD1 3.47Å; W49-I104 HydrophobicContact CZ3-CG1 4.28Å; W49-I104 HydrophobicContact CZ3-CG2 3.57Å; Y100-I104 HydrophobicContact CD1-CG1 3.93Å; Y100-I104 HydrophobicContact CD2-CG1 4.23Å; Y100-I104 HydrophobicContact CE1-CD1 4.31Å; Y100-I104 HydrophobicContact CE1-CG1 3.54Å; Y100-I104 HydrophobicContact CE2-CD1 4Å; Y100-I104 HydrophobicContact CE2-CG1 3.88Å; Y100-I104 HydrophobicContact CG-CG1 4.25Å; Y100-I104 WeakPolarHBondContact O-CB 3.45Å; Y100-I104 VanDerWaalsContact O-CG1 3.24Å; Y100-I104 WeakPolarHBondContact O-CG1 3.38Å; Y100-I104 PolarHBondContact O-N 3.44Å; C101-I104 PolarHBondContact O-N 2.86Å; I104-G106 VanDerWaalsContact C-N 3.32Å; I104-G106 PolarHBondContact O-N 3.2Å; I104-L107 PolarHBondContact O-N 3.46Å; I104-A108 VanDerWaalsContact O-CB 3.31Å; I104-A108 WeakPolarHBondContact O-CB 3.34Å; I104-A108 PolarHBondContact O-N 3.3Å
105S87Confident85.5Confident3 Ų340.3 Ų40.32%0.02121%0.213CC..Hα-helixtrans-63.4-38.2177.8-66.40000112C101 L109C101-S105 VanDerWaalsContact O-CB 3.26Å; C101-S105 WeakPolarHBondContact O-CB 3.01Å; C101-S105 PolarHBondContact O-N 3.28Å; C101-S105 PolarHBondContact O-OG 2.86Å; C101-S105 VanDerWaalsContact O-OG 3.09Å; S105-L109 VanDerWaalsContact O-CB 3.28Å; S105-L109 WeakPolarHBondContact O-CB 3.42Å; S105-L109 PolarHBondContact O-N 3.46Å
106G87.4Confident84.9Confident18 Ų1842.6 Ų42.619%0.18622%0.223CC..Hα-helixtrans-65.9-44175.500000112.7F102 V103 I104 L109 I110F102-G106 PolarHBondContact O-N 3Å; V103-G106 PolarHBondContact O-N 2.92Å; I104-G106 VanDerWaalsContact C-N 3.32Å; I104-G106 PolarHBondContact O-N 3.2Å; G106-L109 PolarHBondContact O-N 2.91Å; G106-I110 VanDerWaalsContact O-CG1 3.3Å; G106-I110 WeakPolarHBondContact O-CG1 3.15Å; G106-I110 PolarHBondContact O-N 2.88Å
107L85.8Confident84.5Confident82 Ų8237.3 Ų37.343%0.42920%0.195SC..Hα-helixtrans-65-42.8176.2-72.4172.6000111.7W49 V103 I104 L109 I110 Q111W49-L107 HydrophobicContact CH2-CB 3.7Å; W49-L107 HydrophobicContact CH2-CD1 3.64Å; W49-L107 HydrophobicContact CH2-CG 4.32Å; W49-L107 HydrophobicContact CZ2-CD1 4.26Å; W49-L107 HydrophobicContact CZ3-CB 4.07Å; V103-L107 HydrophobicContact CG1-CD1 3.82Å; V103-L107 HydrophobicContact CG1-CG 4.42Å; V103-L107 WeakPolarHBondContact O-CB 3.14Å; V103-L107 VanDerWaalsContact O-CG 3.29Å; V103-L107 WeakPolarHBondContact O-CG 3.35Å; V103-L107 PolarHBondContact O-N 3.3Å; I104-L107 PolarHBondContact O-N 3.46Å; L107-L109 VanDerWaalsContact C-N 3.29Å; L107-L109 PolarHBondContact O-N 3.4Å; L107-I110 PolarHBondContact O-N 3.02Å; L107-Q111 WeakPolarHBondContact O-CB 3.42Å; L107-Q111 PolarHBondContact O-N 3.3Å
108A81.9Confident84.2Confident9 Ų941.8 Ų41.87%0.07423%0.226CC..Hα-helixtrans-61.4-37.7174.700000112I104 G112 L156I104-A108 VanDerWaalsContact O-CB 3.31Å; I104-A108 WeakPolarHBondContact O-CB 3.34Å; I104-A108 PolarHBondContact O-N 3.3Å; A108-G112 PolarHBondContact O-N 3.48Å; A108-L156 HydrophobicContact CB-CD1 4.09Å; A108-L156 HydrophobicContact CB-CD2 3.93Å
109L85.5Confident83.6Confident17 Ų1752.3 Ų52.39%0.08927%0.268CS..Hα-helixtrans-69.4-35.9176.5-170.871.7000112.2S105 G106 L107 Y132 L133 V153 L156 L160S105-L109 VanDerWaalsContact O-CB 3.28Å; S105-L109 WeakPolarHBondContact O-CB 3.42Å; S105-L109 PolarHBondContact O-N 3.46Å; G106-L109 PolarHBondContact O-N 2.91Å; L107-L109 VanDerWaalsContact C-N 3.29Å; L107-L109 PolarHBondContact O-N 3.4Å; L109-Y132 WeakPolarHBondContact O-CE1 3.04Å; L109-Y132 PolarHBondContact O-OH 3.38Å; L109-L133 HydrophobicContact CD1-CD1 4.48Å; L109-L133 HydrophobicContact CD1-CD2 3.92Å; L109-L133 HydrophobicContact CD2-CD1 3.91Å; L109-L133 HydrophobicContact CG-CD1 3.93Å; L109-L133 HydrophobicContact CG-CD2 4.24Å; L109-V153 HydrophobicContact CD1-CB 4.32Å; L109-V153 HydrophobicContact CD1-CG1 4.23Å; L109-V153 HydrophobicContact CD1-CG2 4.12Å; L109-L156 HydrophobicContact CB-CB 4.46Å; L109-L156 HydrophobicContact CB-CD1 4.26Å; L109-L156 HydrophobicContact CD1-CB 3.97Å; L109-L156 HydrophobicContact CD1-CD1 4.18Å; L109-L160 HydrophobicContact CD2-CD1 3.9Å
110I83.8Confident83.2Confident81 Ų8152.1 Ų52.142%0.41527%0.266SS..Hα-helixtrans-72.5-39.6177.7-68.9166.5000111.2G106 L107 R129G106-I110 VanDerWaalsContact O-CG1 3.3Å; G106-I110 WeakPolarHBondContact O-CG1 3.15Å; G106-I110 PolarHBondContact O-N 2.88Å; L107-I110 PolarHBondContact O-N 3.02Å; I110-R129 HydrophobicContact CG2-CB 4.3Å
111Q82.4Confident82.8Confident93 Ų9352.9 Ų52.944%0.43527%0.268SS..Hα-helixtrans-70.3-34.9179.6-172.8169.9-3.100112L107 Y123L107-Q111 WeakPolarHBondContact O-CB 3.42Å; L107-Q111 PolarHBondContact O-N 3.3Å; Q111-Y123 HydrophobicContact CG-CD1 4.33Å
112G78.2Confident82.3Confident7 Ų755 Ų557%0.07228%0.283CS..  trans77.5168.8-18000000113.8A108 Y132A108-G112 PolarHBondContact O-N 3.48Å; G112-Y132 WeakPolarHBondContact CA-OH 3.26Å
113P79.6Confident81.6Confident6 Ų654 Ų544%0.03928%0.277CS..  trans-71.7149.9-178.531.3-37.1000111.9I148 V149 N152P113-I148 HydrophobicContact CB-CG1 4.43Å; P113-V149 HydrophobicContact CG-CB 4.39Å; P113-V149 HydrophobicContact CG-CG1 4.48Å; P113-V149 HydrophobicContact CG-CG2 3.98Å; P113-N152 HydrophobicContact CB-CB 4.37Å
114H76.6Confident80.8Confident56 Ų5651.5 Ų51.526%0.25926%0.262SS..  trans-76.2125.1165.5-165.9-113.5000109.6W121 S122 Y123H114-W121 AromaticContact CE1-CE3 3.76Å; H114-W121 AromaticContact ND1-CE3 3.58Å; H114-S122 PolarHBondContact CD2-O 3.49Å; H114-Y123 HydrophobicContact CB-CD1 4.24Å; H114-Y123 HydrophobicContact CB-CE1 3.66Å; H114-Y123 HydrophobicContact CB-CE2 4.21Å; H114-Y123 AromaticContact CD2-CD2 3.46Å; H114-Y123 VanDerWaalsContact CD2-CD2 3.46Å; H114-Y123 WeakPolarHBondContact CD2-CD2 3.46Å; H114-Y123 AromaticContact CD2-CE2 3.3Å; H114-Y123 WeakPolarHBondContact CD2-CE2 3.41Å; H114-Y123 AromaticContact CD2-CG 3.95Å; H114-Y123 AromaticContact CD2-CZ 3.68Å; H114-Y123 AromaticContact CG-CZ 3.96Å
115C78.4Confident80.4Confident0 Ų050.9 Ų50.90%026%0.258CS..EExtended strand (participates in β ladder)trans-142163.2-178.274.50000112S122 C142 I148C115-S122 PolarHBondContact N-O 3.16Å; C115-S122 PolarHBondContact O-N 3.05Å; C115-S122 VanDerWaalsContact O-O 3.13Å; C115-C142 HydrophobicContact CB-CB 3.55Å; C115-C142 WeakPolarHBondContact CB-SG 3.34Å; C115-C142 VanDerWaalsContact SG-CA 3.54Å; C115-C142 WeakPolarHBondContact SG-CB 3.1Å; C115-C142 CovalentContact SG-SG 2.02Å; C115-C142 PolarHBondContact SG-SG 3.37Å; C115-I148 HydrophobicContact CB-CG2 4.2Å
116F79.7Confident79.7Confident74 Ų7453 Ų5333%0.32528%0.276SS..EExtended strand (participates in β ladder)trans-84.1122.8174.4-167.5-101.6000110.2W121 L143 Q144F116-W121 HydrophobicContact CB-CD2 4.16Å; F116-W121 HydrophobicContact CB-CE3 4.18Å; F116-W121 HydrophobicContact CB-CH2 4.22Å; F116-W121 HydrophobicContact CB-CZ2 4.19Å; F116-W121 HydrophobicContact CB-CZ3 4.21Å; F116-W121 AromaticContact CD2-CD1 3.56Å; F116-W121 AromaticContact CD2-CD2 3.85Å; F116-W121 HydrophobicContact CD2-CD2 3.85Å; F116-W121 AromaticContact CD2-CE2 3.69Å; F116-W121 AromaticContact CD2-CG 3.77Å; F116-W121 HydrophobicContact CD2-CG 3.77Å; F116-W121 HydrophobicContact CD2-CZ2 4.37Å; F116-W121 AromaticContact CD2-NE1 3.49Å; F116-W121 AromaticContact CE2-CD1 3.92Å; F116-W121 HydrophobicContact CE2-CG 4.46Å; F116-W121 AromaticContact CE2-NE1 3.97Å; F116-L143 PolarHBondContact O-N 3.43Å; F116-Q144 HydrophobicContact CB-CB 4.26Å; F116-Q144 WeakPolarHBondContact CB-O 3.39Å; F116-Q144 PolarHBondContact N-O 2.89Å
117T81.8Confident79.1Confident10 Ų1059.8 Ų59.86%0.06131%0.308CS..EExtended strand (participates in β ladder)trans-109.4174.1176.867.70000110.1Y119 G120 P124T117-Y119 PolarHBondContact O-N 3.48Å; T117-Y119 PolarHBondContact OG1-N 3.28Å; T117-G120 PolarHBondContact N-O 3.41Å; T117-G120 PolarHBondContact O-N 2.99Å; T117-G120 PolarHBondContact OG1-O 2.93Å; T117-P124 HydrophobicContact CG2-CB 4.08Å; T117-P124 HydrophobicContact CG2-CG 3.93Å
118S81Confident78.4Confident95 Ų9557.8 Ų57.866%0.66430%0.297SS*.THydrogen-bonded Turntrans-57.4-21.2174.356.40000114.2
119Y78.6Confident78.1Confident222 Ų22267.6 Ų67.687%0.87133%0.332SS*.THydrogen-bonded Turntrans-100.55.7-179.8-59.6-77.1000113.4T117T117-Y119 PolarHBondContact O-N 3.48Å; T117-Y119 PolarHBondContact OG1-N 3.28Å
120G81.1Confident77.5Confident21 Ų2167.3 Ų67.322%0.21633%0.333CS..EExtended strand (participates in β ladder)trans111.1-168.1-176.300000113.5T117 S122T117-G120 PolarHBondContact N-O 3.41Å; T117-G120 PolarHBondContact O-N 2.99Å; T117-G120 PolarHBondContact OG1-O 2.93Å; G120-S122 PolarHBondContact O-N 2.94Å
121W77.6Confident77.3Confident120 Ų12072.3 Ų72.346%0.45535%0.346SS..EExtended strand (participates in β ladder)trans-73.4117.4177.1-74.3101.3000110.6Y38 H114 F116Y38-W121 HydrophobicContact CE1-CH2 4.44Å; H114-W121 AromaticContact CE1-CE3 3.76Å; H114-W121 AromaticContact ND1-CE3 3.58Å; F116-W121 HydrophobicContact CB-CD2 4.16Å; F116-W121 HydrophobicContact CB-CE3 4.18Å; F116-W121 HydrophobicContact CB-CH2 4.22Å; F116-W121 HydrophobicContact CB-CZ2 4.19Å; F116-W121 HydrophobicContact CB-CZ3 4.21Å; F116-W121 AromaticContact CD2-CD1 3.56Å; F116-W121 AromaticContact CD2-CD2 3.85Å; F116-W121 HydrophobicContact CD2-CD2 3.85Å; F116-W121 AromaticContact CD2-CE2 3.69Å; F116-W121 AromaticContact CD2-CG 3.77Å; F116-W121 HydrophobicContact CD2-CG 3.77Å; F116-W121 HydrophobicContact CD2-CZ2 4.37Å; F116-W121 AromaticContact CD2-NE1 3.49Å; F116-W121 AromaticContact CE2-CD1 3.92Å; F116-W121 HydrophobicContact CE2-CG 4.46Å; F116-W121 AromaticContact CE2-NE1 3.97Å
122S76.8Confident77.2Confident46 Ų4667.9 Ų67.932%0.32233%0.326SS..EExtended strand (participates in β ladder)trans-151.9174.6178.667.60000112H114 C115 G120 P124H114-S122 PolarHBondContact CD2-O 3.49Å; C115-S122 PolarHBondContact N-O 3.16Å; C115-S122 PolarHBondContact O-N 3.05Å; C115-S122 VanDerWaalsContact O-O 3.13Å; G120-S122 PolarHBondContact O-N 2.94Å; S122-P124 VanDerWaalsContact C-CD 3.47Å; S122-P124 WeakPolarHBondContact O-CD 3.44Å
123Y75.5Confident77.4Confident80 Ų8070.4 Ų70.431%0.31434%0.337SS..  trans-10084.1168.6-75.6-84.8000109.6S46 Q111 H114 F125 A126S46-Y123 PolarHBondContact OG-OH 2.94Å; Q111-Y123 HydrophobicContact CG-CD1 4.33Å; H114-Y123 HydrophobicContact CB-CD1 4.24Å; H114-Y123 HydrophobicContact CB-CE1 3.66Å; H114-Y123 HydrophobicContact CB-CE2 4.21Å; H114-Y123 AromaticContact CD2-CD2 3.46Å; H114-Y123 VanDerWaalsContact CD2-CD2 3.46Å; H114-Y123 WeakPolarHBondContact CD2-CD2 3.46Å; H114-Y123 AromaticContact CD2-CE2 3.3Å; H114-Y123 WeakPolarHBondContact CD2-CE2 3.41Å; H114-Y123 AromaticContact CD2-CG 3.95Å; H114-Y123 AromaticContact CD2-CZ 3.68Å; H114-Y123 AromaticContact CG-CZ 3.96Å; Y123-F125 PolarHBondContact O-N 3.49Å; Y123-F125 VanDerWaalsContact O-N 3.13Å; Y123-A126 PolarHBondContact O-N 3.23Å
124P73.3Confident77.4Confident27 Ų2777.5 Ų77.518%0.17537%0.374CS..THydrogen-bonded Turntrans-66-19.3-174.226-34.9000113.6T117 S122T117-P124 HydrophobicContact CG2-CB 4.08Å; T117-P124 HydrophobicContact CG2-CG 3.93Å; S122-P124 VanDerWaalsContact C-CD 3.47Å; S122-P124 WeakPolarHBondContact O-CD 3.44Å
125F76.3Confident77.7Confident1 Ų179.9 Ų79.90%0.00439%0.385CS..THydrogen-bonded Turntrans-99.1-7.3-175.3-55.8-60.8000114.3Y123 D127 Q128 Y132 N138 C142 V149Y123-F125 PolarHBondContact O-N 3.49Å; Y123-F125 VanDerWaalsContact O-N 3.13Å; F125-D127 VanDerWaalsContact C-N 3.28Å; F125-D127 PolarHBondContact O-N 3.31Å; F125-Q128 PolarHBondContact O-N 2.9Å; F125-Y132 HydrophobicContact CB-CD1 3.61Å; F125-Y132 HydrophobicContact CB-CE1 3.88Å; F125-Y132 HydrophobicContact CB-CG 4.03Å; F125-Y132 AromaticContact CD1-CD1 3.99Å; F125-Y132 HydrophobicContact CD1-CD1 3.99Å; F125-Y132 AromaticContact CD1-CD2 4Å; F125-Y132 HydrophobicContact CD1-CD2 4Å; F125-Y132 AromaticContact CD1-CG 3.51Å; F125-Y132 HydrophobicContact CD1-CG 3.51Å; F125-Y132 HydrophobicContact CD2-CD2 4.34Å; F125-Y132 HydrophobicContact CD2-CE2 4.5Å; F125-Y132 HydrophobicContact CD2-CG 4.45Å; F125-Y132 HydrophobicContact CE1-CD2 4.2Å; F125-Y132 HydrophobicContact CE1-CG 4.06Å; F125-Y132 AromaticContact CG-CD1 3.86Å; F125-Y132 HydrophobicContact CG-CD1 3.86Å; F125-Y132 HydrophobicContact CG-CD2 4.06Å; F125-Y132 HydrophobicContact CG-CE1 4.29Å; F125-Y132 HydrophobicContact CG-CE2 4.49Å; F125-Y132 AromaticContact CG-CG 3.73Å; F125-Y132 HydrophobicContact CG-CG 3.73Å; F125-Y132 HydrophobicContact CZ-CD2 4.46Å; F125-N138 HydrophobicContact CE1-CB 4.36Å; F125-C142 VanDerWaalsContact CE2-SG 3.57Å; F125-V149 HydrophobicContact CE2-CG1 4.31Å; F125-V149 HydrophobicContact CE2-CG2 3.87Å; F125-V149 HydrophobicContact CZ-CG2 4.3Å
126A73.3Confident77.7Confident47 Ų4783.7 Ų83.739%0.38841%0.41SS..G310 helixtrans-59.8-38.5-177.300000112.3Y123 Q128Y123-A126 PolarHBondContact O-N 3.23Å; A126-Q128 VanDerWaalsContact C-N 3.32Å; A126-Q128 PolarHBondContact O-N 2.98Å
127D73.4Confident77.6Confident161 Ų16187.6 Ų87.686%0.86143%0.429SS*.G310 helixtrans-74.7-21.5176.6-87.2-28.1000113.5F125 R129F125-D127 VanDerWaalsContact C-N 3.28Å; F125-D127 PolarHBondContact O-N 3.31Å; D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.89Å
128Q70.8Confident77.4Confident41 Ų4188.3 Ų88.319%0.19243%0.433CS..G310 helixtrans-83.1-7.4-174.6-64.2-162.6-800113.4F125 A126 G130 R131 W141F125-Q128 PolarHBondContact O-N 2.9Å; A126-Q128 VanDerWaalsContact C-N 3.32Å; A126-Q128 PolarHBondContact O-N 2.98Å; Q128-G130 PolarHBondContact O-N 3.42Å; Q128-G130 VanDerWaalsContact O-N 3.14Å; Q128-R131 HydrophobicContact CB-CB 4.29Å; Q128-R131 VanDerWaalsContact O-CB 3.28Å; Q128-R131 WeakPolarHBondContact O-CB 3.3Å; Q128-R131 WeakPolarHBondContact O-CG 3.19Å; Q128-R131 PolarHBondContact O-N 3.23Å; Q128-W141 VanDerWaalsContact NE2-CH2 3.35Å
129R75.5Confident77.4Confident214 Ų21486.9 Ų86.981%0.80841%0.413SS*.THydrogen-bonded Turntrans42.747.4179.7-61.4-170.6-175.7-175.91.8113.4I110 D127 R131I110-R129 HydrophobicContact CG2-CB 4.3Å; D127-R129 VanDerWaalsContact C-N 3.31Å; D127-R129 PolarHBondContact O-N 2.89Å; R129-R131 PolarHBondContact O-N 3.44Å
130G74.3Confident77.3Confident11 Ų1180.3 Ų80.311%0.11340%0.4CS..THydrogen-bonded Turntrans81.81.3179.200000116.4Q128 Y132 L133Q128-G130 PolarHBondContact O-N 3.42Å; Q128-G130 VanDerWaalsContact O-N 3.14Å; G130-Y132 PolarHBondContact O-N 2.98Å; G130-L133 WeakPolarHBondContact O-CB 3.45Å; G130-L133 WeakPolarHBondContact O-CG 3.5Å; G130-L133 PolarHBondContact O-N 2.94Å; G130-L133 VanDerWaalsContact O-N 3.08Å
131R80.1Confident77.1Confident186 Ų18685.2 Ų85.270%0.70241%0.412SS*.G310 helixtrans-58.7-27.9172.9-77.4177.1148.8-167.2-6.9113.1Q128 R129 L133 L134Q128-R131 HydrophobicContact CB-CB 4.29Å; Q128-R131 VanDerWaalsContact O-CB 3.28Å; Q128-R131 WeakPolarHBondContact O-CB 3.3Å; Q128-R131 WeakPolarHBondContact O-CG 3.19Å; Q128-R131 PolarHBondContact O-N 3.23Å; R129-R131 PolarHBondContact O-N 3.44Å; R131-L133 PolarHBondContact O-N 3.37Å; R131-L134 PolarHBondContact O-N 3.38Å; R131-L134 VanDerWaalsContact O-N 3.13Å
132Y80.4Confident77.2Confident1 Ų180.2 Ų80.20%0.00440%0.395CS..G310 helixtrans-62.8-18.7176.881.9-87.8000113.7L109 G112 F125 G130 L134 Q135 W139 V149 V153L109-Y132 WeakPolarHBondContact O-CE1 3.04Å; L109-Y132 PolarHBondContact O-OH 3.38Å; G112-Y132 WeakPolarHBondContact CA-OH 3.26Å; F125-Y132 HydrophobicContact CB-CD1 3.61Å; F125-Y132 HydrophobicContact CB-CE1 3.88Å; F125-Y132 HydrophobicContact CB-CG 4.03Å; F125-Y132 AromaticContact CD1-CD1 3.99Å; F125-Y132 HydrophobicContact CD1-CD1 3.99Å; F125-Y132 AromaticContact CD1-CD2 4Å; F125-Y132 HydrophobicContact CD1-CD2 4Å; F125-Y132 AromaticContact CD1-CG 3.51Å; F125-Y132 HydrophobicContact CD1-CG 3.51Å; F125-Y132 HydrophobicContact CD2-CD2 4.34Å; F125-Y132 HydrophobicContact CD2-CE2 4.5Å; F125-Y132 HydrophobicContact CD2-CG 4.45Å; F125-Y132 HydrophobicContact CE1-CD2 4.2Å; F125-Y132 HydrophobicContact CE1-CG 4.06Å; F125-Y132 AromaticContact CG-CD1 3.86Å; F125-Y132 HydrophobicContact CG-CD1 3.86Å; F125-Y132 HydrophobicContact CG-CD2 4.06Å; F125-Y132 HydrophobicContact CG-CE1 4.29Å; F125-Y132 HydrophobicContact CG-CE2 4.49Å; F125-Y132 AromaticContact CG-CG 3.73Å; F125-Y132 HydrophobicContact CG-CG 3.73Å; F125-Y132 HydrophobicContact CZ-CD2 4.46Å; G130-Y132 PolarHBondContact O-N 2.98Å; Y132-L134 VanDerWaalsContact C-N 3.33Å; Y132-Q135 CarbonylContact O-C 3.45Å; Y132-W139 AromaticContact CD2-NE1 3.71Å; Y132-W139 PolarHBondContact O-NE1 2.84Å; Y132-V149 HydrophobicContact CD2-CG1 4.1Å; Y132-V149 HydrophobicContact CE2-CG1 3.83Å; Y132-V153 HydrophobicContact CE2-CG2 3.73Å
133L81.8Confident77.2Confident60 Ų6083.1 Ų83.131%0.31441%0.406SS..G310 helixtrans-71.4-28.6175.9-58.9172000112.5L109 G130 R131 V153L109-L133 HydrophobicContact CD1-CD1 4.48Å; L109-L133 HydrophobicContact CD1-CD2 3.92Å; L109-L133 HydrophobicContact CD2-CD1 3.91Å; L109-L133 HydrophobicContact CG-CD1 3.93Å; L109-L133 HydrophobicContact CG-CD2 4.24Å; G130-L133 WeakPolarHBondContact O-CB 3.45Å; G130-L133 WeakPolarHBondContact O-CG 3.5Å; G130-L133 PolarHBondContact O-N 2.94Å; G130-L133 VanDerWaalsContact O-N 3.08Å; R131-L133 PolarHBondContact O-N 3.37Å; L133-V153 HydrophobicContact CD2-CB 4.35Å; L133-V153 HydrophobicContact CD2-CG1 3.73Å; L133-V153 HydrophobicContact CD2-CG2 3.62Å
134L80.1Confident77.1Confident154 Ų15484.4 Ų84.481%0.80642%0.415SS*.THydrogen-bonded Turntrans-90.7-13.7-179.3-64.1169.1000112.4R131 Y132R131-L134 PolarHBondContact O-N 3.38Å; R131-L134 VanDerWaalsContact O-N 3.13Å; Y132-L134 VanDerWaalsContact C-N 3.33Å
135Q81.9Confident77Confident107 Ų10783.7 Ų83.750%0.541%0.41SS..  trans-127.981.6-175.9-67.6-175.1-45.900109.8Y132 E137 N138Y132-Q135 CarbonylContact O-C 3.45Å; Q135-E137 PolarHBondContact O-N 3.39Å; Q135-E137 VanDerWaalsContact O-N 3.14Å; Q135-N138 WeakPolarHBondContact O-CB 3.37Å; Q135-N138 PolarHBondContact O-N 3.36Å; Q135-N138 PolarHBondContact OE1-ND2 3.45Å
136P77.9Confident76.8Confident79 Ų7989.2 Ų89.251%0.51344%0.439SS..G310 helixtrans-61.4-20.5179.922.9-32.2000113.3N138 W139P136-N138 PolarHBondContact O-N 3.03Å; P136-W139 HydrophobicContact CB-CD2 4.24Å; P136-W139 HydrophobicContact CB-CE3 4.42Å; P136-W139 HydrophobicContact CB-CZ2 4.39Å; P136-W139 VanDerWaalsContact O-CB 3.28Å; P136-W139 WeakPolarHBondContact O-CB 3.3Å; P136-W139 PolarHBondContact O-N 3.41Å
137E78.8Confident77Confident157 Ų15792.5 Ų92.573%0.73445%0.45SS*.G310 helixtrans-52.3-34.8170.7-59.8-68.6145.400112.6Q135 W139 S140Q135-E137 PolarHBondContact O-N 3.39Å; Q135-E137 VanDerWaalsContact O-N 3.14Å; E137-W139 PolarHBondContact O-N 2.89Å; E137-S140 PolarHBondContact O-OG 3.46Å
138N76.9Confident77.4Confident25 Ų2585.5 Ų85.513%0.13441%0.412CS..G310 helixtrans-74.9-10.9-178.7-63.5-7.2000112.9F125 Q135 P136 S140 W141F125-N138 HydrophobicContact CE1-CB 4.36Å; Q135-N138 WeakPolarHBondContact O-CB 3.37Å; Q135-N138 PolarHBondContact O-N 3.36Å; Q135-N138 PolarHBondContact OE1-ND2 3.45Å; P136-N138 PolarHBondContact O-N 3.03Å; N138-S140 PolarHBondContact O-N 3.15Å; N138-W141 PolarHBondContact O-N 3.3Å
139W80.7Confident77.9Confident64 Ų6483.8 Ų83.824%0.24240%0.404CS..G310 helixtrans-70.2-21.4179.2-60.72.3000111.8Y132 P136 E137 W141 C142 V149 E150Y132-W139 AromaticContact CD2-NE1 3.71Å; Y132-W139 PolarHBondContact O-NE1 2.84Å; P136-W139 HydrophobicContact CB-CD2 4.24Å; P136-W139 HydrophobicContact CB-CE3 4.42Å; P136-W139 HydrophobicContact CB-CZ2 4.39Å; P136-W139 VanDerWaalsContact O-CB 3.28Å; P136-W139 WeakPolarHBondContact O-CB 3.3Å; P136-W139 PolarHBondContact O-N 3.41Å; E137-W139 PolarHBondContact O-N 2.89Å; W139-W141 PolarHBondContact O-N 2.88Å; W139-W141 VanDerWaalsContact O-N 3.13Å; W139-C142 PolarHBondContact O-N 2.89Å; W139-V149 HydrophobicContact CB-CB 4.32Å; W139-V149 HydrophobicContact CB-CG1 4.32Å; W139-V149 HydrophobicContact CD2-CB 4.32Å; W139-V149 HydrophobicContact CD2-CG1 3.84Å; W139-V149 HydrophobicContact CG-CB 4.15Å; W139-V149 HydrophobicContact CG-CG1 3.7Å; W139-E150 HydrophobicContact CE3-CB 4.21Å; W139-E150 HydrophobicContact CZ3-CB 3.75Å; W139-E150 HydrophobicContact CZ3-CG 3.95Å
140S77.4Confident78.4Confident85 Ų8578.2 Ų78.259%0.59439%0.388SS*.G310 helixtrans-61.7-14.917562.30000114.3E137 N138 C142E137-S140 PolarHBondContact O-OG 3.46Å; N138-S140 PolarHBondContact O-N 3.15Å; S140-C142 VanDerWaalsContact C-N 3.28Å; S140-C142 PolarHBondContact O-N 3.46Å
141W76.4Confident78.8Confident124 Ų12482.2 Ų82.247%0.4740%0.399SS..G310 helixtrans-71.9-23177.6-62.2-2000113Q128 N138 W139Q128-W141 VanDerWaalsContact NE2-CH2 3.35Å; N138-W141 PolarHBondContact O-N 3.3Å; W139-W141 PolarHBondContact O-N 2.88Å; W139-W141 VanDerWaalsContact O-N 3.13Å
142C79.1Confident79.1Confident15 Ų1574.2 Ų74.210%0.10137%0.37CS..  trans-88106.8172.5-700000109.6C115 F125 W139 S140 V149C115-C142 HydrophobicContact CB-CB 3.55Å; C115-C142 WeakPolarHBondContact CB-SG 3.34Å; C115-C142 VanDerWaalsContact SG-CA 3.54Å; C115-C142 WeakPolarHBondContact SG-CB 3.1Å; C115-C142 CovalentContact SG-SG 2.02Å; C115-C142 PolarHBondContact SG-SG 3.37Å; F125-C142 VanDerWaalsContact CE2-SG 3.57Å; W139-C142 PolarHBondContact O-N 2.89Å; S140-C142 VanDerWaalsContact C-N 3.28Å; S140-C142 PolarHBondContact O-N 3.46Å; C142-V149 HydrophobicContact CB-CG2 3.95Å
143L77.2Confident79.4Confident107 Ų10774.9 Ų74.956%0.5638%0.375SS*.  trans-81.4-39.1-179.2-65170.7000111.9F116F116-L143 PolarHBondContact O-N 3.43Å
144Q73.4Confident79.8Confident107 Ų10775.1 Ų75.150%0.538%0.379SS..BIsolated β-bridgetrans-145.2138.9-178.2-161.5166.5-3300111.2F116F116-Q144 HydrophobicContact CB-CB 4.26Å; F116-Q144 WeakPolarHBondContact CB-O 3.39Å; F116-Q144 PolarHBondContact N-O 2.89Å
145P70.6Confident80.2Confident11 Ų1168.8 Ų68.87%0.07135%0.345CS..SBendcis-71.5151.5-6.617.2-14.7000114.1M33 N147 I148M33-P145 HydrophobicContact CE-CB 4.29Å; P145-N147 PolarHBondContact O-N 3.28Å; P145-I148 HydrophobicContact CB-CB 4.47Å; P145-I148 HydrophobicContact CG-CB 3.9Å; P145-I148 HydrophobicContact CG-CD1 4.18Å; P145-I148 HydrophobicContact CG-CG1 3.97Å; P145-I148 HydrophobicContact CG-CG2 4.39Å; P145-I148 WeakPolarHBondContact O-CB 3.32Å; P145-I148 VanDerWaalsContact O-CG2 3.31Å; P145-I148 WeakPolarHBondContact O-CG2 3.37Å; P145-I148 PolarHBondContact O-N 3.26Å
146I73.4Confident80.5Confident118 Ų11863.9 Ų63.961%0.60532%0.323SS*.THydrogen-bonded Turntrans-61.2134-178.6-58.8170000109.5I148I146-I148 PolarHBondContact O-N 2.94Å; I146-I148 VanDerWaalsContact O-N 3.15Å
147N77.5Confident81.1Confident115 Ų11563 Ų6362%0.61532%0.318SS*.THydrogen-bonded Turntrans58.120.3178.5-57.4-21.3000116P145 V149 E150 W151P145-N147 PolarHBondContact O-N 3.28Å; N147-V149 PolarHBondContact O-N 3.21Å; N147-E150 PolarHBondContact O-N 3.46Å; N147-W151 PolarHBondContact O-N 3.21Å; N147-W151 VanDerWaalsContact O-N 3.1Å
148I80.8Confident81.7Confident14 Ų1459.2 Ų59.27%0.07231%0.305CS..Hα-helixtrans-62.7-32.2179.1-168.158.3000113.1P32 P113 C115 P145 I146 N152P32-I148 HydrophobicContact CB-CD1 3.61Å; P32-I148 HydrophobicContact CG-CD1 4.29Å; P113-I148 HydrophobicContact CB-CG1 4.43Å; C115-I148 HydrophobicContact CB-CG2 4.2Å; P145-I148 HydrophobicContact CB-CB 4.47Å; P145-I148 HydrophobicContact CG-CB 3.9Å; P145-I148 HydrophobicContact CG-CD1 4.18Å; P145-I148 HydrophobicContact CG-CG1 3.97Å; P145-I148 HydrophobicContact CG-CG2 4.39Å; P145-I148 WeakPolarHBondContact O-CB 3.32Å; P145-I148 VanDerWaalsContact O-CG2 3.31Å; P145-I148 WeakPolarHBondContact O-CG2 3.37Å; P145-I148 PolarHBondContact O-N 3.26Å; I146-I148 PolarHBondContact O-N 2.94Å; I146-I148 VanDerWaalsContact O-N 3.15Å; I148-N152 WeakPolarHBondContact O-CB 3.35Å; I148-N152 PolarHBondContact O-N 3.32Å
149V82.6Confident82.4Confident5 Ų558 Ų583%0.0330%0.299CS..Hα-helixtrans-66.7-50.5-179.4-173.60000110.4P113 F125 Y132 W139 C142 N147 W151 N152 V153P113-V149 HydrophobicContact CG-CB 4.39Å; P113-V149 HydrophobicContact CG-CG1 4.48Å; P113-V149 HydrophobicContact CG-CG2 3.98Å; F125-V149 HydrophobicContact CE2-CG1 4.31Å; F125-V149 HydrophobicContact CE2-CG2 3.87Å; F125-V149 HydrophobicContact CZ-CG2 4.3Å; Y132-V149 HydrophobicContact CD2-CG1 4.1Å; Y132-V149 HydrophobicContact CE2-CG1 3.83Å; W139-V149 HydrophobicContact CB-CB 4.32Å; W139-V149 HydrophobicContact CB-CG1 4.32Å; W139-V149 HydrophobicContact CD2-CB 4.32Å; W139-V149 HydrophobicContact CD2-CG1 3.84Å; W139-V149 HydrophobicContact CG-CB 4.15Å; W139-V149 HydrophobicContact CG-CG1 3.7Å; C142-V149 HydrophobicContact CB-CG2 3.95Å; N147-V149 PolarHBondContact O-N 3.21Å; V149-W151 VanDerWaalsContact C-N 3.34Å; V149-W151 PolarHBondContact O-N 2.94Å; V149-N152 PolarHBondContact O-N 3.41Å; V149-V153 HydrophobicContact CG1-CG2 4.25Å; V149-V153 VanDerWaalsContact O-CB 3.3Å; V149-V153 WeakPolarHBondContact O-CB 3.34Å; V149-V153 WeakPolarHBondContact O-CG2 3.3Å; V149-V153 PolarHBondContact O-N 3.05Å
150E84.6Confident82.9Confident98 Ų9856.4 Ų56.446%0.45829%0.294SS..Hα-helixtrans-60.5-44.8177.3-172179.2162.100111.4W139 N147 N152 V153 T154W139-E150 HydrophobicContact CE3-CB 4.21Å; W139-E150 HydrophobicContact CZ3-CB 3.75Å; W139-E150 HydrophobicContact CZ3-CG 3.95Å; N147-E150 PolarHBondContact O-N 3.46Å; E150-N152 PolarHBondContact O-N 2.95Å; E150-V153 PolarHBondContact O-N 2.98Å; E150-T154 HydrophobicContact CG-CG2 4.29Å; E150-T154 WeakPolarHBondContact O-CB 2.98Å; E150-T154 VanDerWaalsContact O-CG2 3.22Å; E150-T154 WeakPolarHBondContact O-CG2 3.44Å; E150-T154 PolarHBondContact O-N 3.43Å; E150-T154 PolarHBondContact O-OG1 3.34Å
151W84Confident83.6Confident95 Ų9554.1 Ų54.136%0.3628%0.284SS..Hα-helixtrans-58.9-49.5178.3-171.4-99.6000112.8L28 N147 V149 T154 L155L28-W151 HydrophobicContact CB-CZ2 4.13Å; L28-W151 HydrophobicContact CD2-CH2 3.99Å; L28-W151 HydrophobicContact CD2-CZ2 3.73Å; L28-W151 HydrophobicContact CG-CZ2 4.07Å; L28-W151 PolarHBondContact O-NE1 2.9Å; N147-W151 PolarHBondContact O-N 3.21Å; N147-W151 VanDerWaalsContact O-N 3.1Å; V149-W151 VanDerWaalsContact C-N 3.34Å; V149-W151 PolarHBondContact O-N 2.94Å; W151-T154 PolarHBondContact O-OG1 3.43Å; W151-L155 HydrophobicContact CD2-CD1 4.22Å; W151-L155 HydrophobicContact CG-CD1 4.27Å; W151-L155 HydrophobicContact CZ2-CD1 4.15Å; W151-L155 VanDerWaalsContact NE1-CD1 3.27Å; W151-L155 WeakPolarHBondContact O-CG 3.45Å; W151-L155 PolarHBondContact O-N 3.04Å; W151-L155 VanDerWaalsContact O-N 3.15Å
152N85.9Confident84.4Confident17 Ų1749.2 Ų49.29%0.09127%0.267CS..Hα-helixtrans-69.4-41.8-179.7-80.619.5000111.7L29 P113 I148 V149 E150 L156L29-N152 HydrophobicContact CD2-CB 4.22Å; P113-N152 HydrophobicContact CB-CB 4.37Å; I148-N152 WeakPolarHBondContact O-CB 3.35Å; I148-N152 PolarHBondContact O-N 3.32Å; V149-N152 PolarHBondContact O-N 3.41Å; E150-N152 PolarHBondContact O-N 2.95Å; N152-L156 VanDerWaalsContact O-CB 3.23Å; N152-L156 WeakPolarHBondContact O-CB 3.41Å; N152-L156 WeakPolarHBondContact O-CD1 3.36Å; N152-L156 WeakPolarHBondContact O-CG 3.5Å; N152-L156 PolarHBondContact O-N 2.87Å
153V87.1Confident85Confident16 Ų1648.6 Ų48.610%0.09726%0.263CS..Hα-helixtrans-62-46.8179168.50000110.8L109 Y132 L133 V149 E150 C157L109-V153 HydrophobicContact CD1-CB 4.32Å; L109-V153 HydrophobicContact CD1-CG1 4.23Å; L109-V153 HydrophobicContact CD1-CG2 4.12Å; Y132-V153 HydrophobicContact CE2-CG2 3.73Å; L133-V153 HydrophobicContact CD2-CB 4.35Å; L133-V153 HydrophobicContact CD2-CG1 3.73Å; L133-V153 HydrophobicContact CD2-CG2 3.62Å; V149-V153 HydrophobicContact CG1-CG2 4.25Å; V149-V153 VanDerWaalsContact O-CB 3.3Å; V149-V153 WeakPolarHBondContact O-CB 3.34Å; V149-V153 WeakPolarHBondContact O-CG2 3.3Å; V149-V153 PolarHBondContact O-N 3.05Å; E150-V153 PolarHBondContact O-N 2.98Å; V153-C157 VanDerWaalsContact O-CB 3.28Å; V153-C157 WeakPolarHBondContact O-CB 3.15Å; V153-C157 PolarHBondContact O-N 3.21Å; V153-C157 PolarHBondContact O-SG 2.97Å
154T88.9Confident85.8Confident65 Ų6546.5 Ų46.540%0.39926%0.255SS..Hα-helixtrans-62.4-49179.950.90000111.8E150 W151 C157 V158E150-T154 HydrophobicContact CG-CG2 4.29Å; E150-T154 WeakPolarHBondContact O-CB 2.98Å; E150-T154 VanDerWaalsContact O-CG2 3.22Å; E150-T154 WeakPolarHBondContact O-CG2 3.44Å; E150-T154 PolarHBondContact O-N 3.43Å; E150-T154 PolarHBondContact O-OG1 3.34Å; W151-T154 PolarHBondContact O-OG1 3.43Å; T154-C157 PolarHBondContact O-N 3.32Å; T154-V158 WeakPolarHBondContact O-CG2 3.32Å; T154-V158 PolarHBondContact O-N 3.33Å
155L88.6Confident86.7Confident20 Ų2045.7 Ų45.711%0.10525%0.253CS..Hα-helixtrans-65.4-41.2179.5-70.1172.8000112.9A25 L28 L29 W151 V158 L159A25-L155 HydrophobicContact CB-CD2 4.19Å; L28-L155 HydrophobicContact CB-CD1 3.74Å; L28-L155 HydrophobicContact CB-CD2 4.28Å; L28-L155 HydrophobicContact CD2-CD2 4.32Å; L29-L155 HydrophobicContact CD1-CB 3.9Å; L29-L155 HydrophobicContact CD2-CB 3.96Å; L29-L155 HydrophobicContact CD2-CD1 4.15Å; L29-L155 HydrophobicContact CG-CB 3.72Å; L29-L155 HydrophobicContact CG-CD1 3.8Å; L29-L155 HydrophobicContact CG-CG 4.41Å; W151-L155 HydrophobicContact CD2-CD1 4.22Å; W151-L155 HydrophobicContact CG-CD1 4.27Å; W151-L155 HydrophobicContact CZ2-CD1 4.15Å; W151-L155 VanDerWaalsContact NE1-CD1 3.27Å; W151-L155 WeakPolarHBondContact O-CG 3.45Å; W151-L155 PolarHBondContact O-N 3.04Å; W151-L155 VanDerWaalsContact O-N 3.15Å; L155-V158 PolarHBondContact O-N 3.18Å; L155-L159 WeakPolarHBondContact O-CG 3.39Å; L155-L159 PolarHBondContact O-N 3.41Å
156L89.1Confident87.7Confident5 Ų545.2 Ų45.23%0.02625%0.25CS..Hα-helixtrans-65.6-38.6176.3-72.8169.7000111.9L29 Y50 A108 L109 N152 L159 L160L29-L156 HydrophobicContact CD1-CD2 4.03Å; L29-L156 HydrophobicContact CD1-CG 4.29Å; L29-L156 HydrophobicContact CD2-CG 4.33Å; Y50-L156 HydrophobicContact CE1-CD2 4.47Å; A108-L156 HydrophobicContact CB-CD1 4.09Å; A108-L156 HydrophobicContact CB-CD2 3.93Å; L109-L156 HydrophobicContact CB-CB 4.46Å; L109-L156 HydrophobicContact CB-CD1 4.26Å; L109-L156 HydrophobicContact CD1-CB 3.97Å; L109-L156 HydrophobicContact CD1-CD1 4.18Å; N152-L156 VanDerWaalsContact O-CB 3.23Å; N152-L156 WeakPolarHBondContact O-CB 3.41Å; N152-L156 WeakPolarHBondContact O-CD1 3.36Å; N152-L156 WeakPolarHBondContact O-CG 3.5Å; N152-L156 PolarHBondContact O-N 2.87Å; L156-L159 PolarHBondContact O-N 3.2Å; L156-L160 WeakPolarHBondContact O-CG 3.45Å; L156-L160 PolarHBondContact O-N 3.15Å
157C90.7Very high88.7Confident61 Ų6143.6 Ų43.641%0.41224%0.239SC..Hα-helixtrans-65.1-41.4173.8-76.10000112.4V153 T154 L160 G161V153-C157 VanDerWaalsContact O-CB 3.28Å; V153-C157 WeakPolarHBondContact O-CB 3.15Å; V153-C157 PolarHBondContact O-N 3.21Å; V153-C157 PolarHBondContact O-SG 2.97Å; T154-C157 PolarHBondContact O-N 3.32Å; C157-L160 PolarHBondContact O-N 3.06Å; C157-G161 PolarHBondContact O-N 2.99Å
158V91.5Very high89.4Confident76 Ų7642.1 Ų42.146%0.46123%0.23SC..Hα-helixtrans-61.6-45.2174.1169.60000110.5T154 L155 L160 G161 L162T154-V158 WeakPolarHBondContact O-CG2 3.32Å; T154-V158 PolarHBondContact O-N 3.33Å; L155-V158 PolarHBondContact O-N 3.18Å; V158-L160 PolarHBondContact O-N 3.33Å; V158-G161 PolarHBondContact O-N 3.31Å; V158-L162 HydrophobicContact CG1-CD1 3.92Å; V158-L162 HydrophobicContact CG1-CG 4.29Å; V158-L162 WeakPolarHBondContact O-CG 3.08Å; V158-L162 PolarHBondContact O-N 3.35Å
159L90.3Very high89.9Confident1 Ų142.4 Ų42.41%0.00523%0.232CC..Hα-helixtrans-60.2-42.9176.1-75.7172.1000112.6A25 N26 L29 L155 L156 G161 L162 A163A25-L159 HydrophobicContact CB-CD1 4.49Å; A25-L159 HydrophobicContact CB-CD2 3.81Å; A25-L159 HydrophobicContact CB-CG 3.94Å; N26-L159 WeakPolarHBondContact ND2-CD2 3.18Å; L29-L159 HydrophobicContact CD1-CD1 3.46Å; L29-L159 VanDerWaalsContact CD1-CD1 3.46Å; L155-L159 WeakPolarHBondContact O-CG 3.39Å; L155-L159 PolarHBondContact O-N 3.41Å; L156-L159 PolarHBondContact O-N 3.2Å; L159-G161 VanDerWaalsContact C-N 3.32Å; L159-G161 PolarHBondContact O-N 3.41Å; L159-L162 PolarHBondContact O-N 3.37Å; L159-A163 VanDerWaalsContact O-CB 3.29Å; L159-A163 WeakPolarHBondContact O-CB 3.38Å; L159-A163 PolarHBondContact O-N 3.01Å
160L91.8Very high90.3Very high29 Ų2942.2 Ų42.215%0.15223%0.23CC..Hα-helixtrans-58.4-44.8174.1-77167.5000111.6F102 L109 L156 C157 V158 A163 V164F102-L160 HydrophobicContact CD2-CD2 3.54Å; F102-L160 HydrophobicContact CE2-CD2 3.73Å; F102-L160 HydrophobicContact CG-CD2 4.11Å; F102-L160 HydrophobicContact CZ-CD2 4.43Å; F102-L160 WeakPolarHBondContact O-CD2 3.3Å; L109-L160 HydrophobicContact CD2-CD1 3.9Å; L156-L160 WeakPolarHBondContact O-CG 3.45Å; L156-L160 PolarHBondContact O-N 3.15Å; C157-L160 PolarHBondContact O-N 3.06Å; V158-L160 PolarHBondContact O-N 3.33Å; L160-A163 PolarHBondContact O-N 3.44Å; L160-V164 WeakPolarHBondContact O-CG2 3.15Å; L160-V164 PolarHBondContact O-N 3.16Å; L160-V164 VanDerWaalsContact O-N 3.09Å
161G93Very high90.6Very high37 Ų3741.3 Ų41.338%0.38123%0.228SC..Hα-helixtrans-62.8-46176.900000112.8C157 V158 L159 V164 L165C157-G161 PolarHBondContact O-N 2.99Å; V158-G161 PolarHBondContact O-N 3.31Å; L159-G161 VanDerWaalsContact C-N 3.32Å; L159-G161 PolarHBondContact O-N 3.41Å; G161-V164 PolarHBondContact O-N 3.4Å; G161-L165 WeakPolarHBondContact O-CG 3.49Å; G161-L165 PolarHBondContact O-N 3.45Å; G161-L165 VanDerWaalsContact O-N 3.11Å
162L91.9Very high90.8Very high22 Ų2240.8 Ų40.812%0.11523%0.232CC..Hα-helixtrans-61.6-46.4176.7-68.4173.5000111.3L18 C21 V158 L159 V164 L165 E166L18-L162 HydrophobicContact CB-CD2 4.48Å; L18-L162 HydrophobicContact CG-CD2 4Å; C21-L162 HydrophobicContact CB-CD1 3.78Å; C21-L162 HydrophobicContact CB-CD2 4.37Å; V158-L162 HydrophobicContact CG1-CD1 3.92Å; V158-L162 HydrophobicContact CG1-CG 4.29Å; V158-L162 WeakPolarHBondContact O-CG 3.08Å; V158-L162 PolarHBondContact O-N 3.35Å; L159-L162 PolarHBondContact O-N 3.37Å; L162-V164 VanDerWaalsContact C-N 3.3Å; L162-V164 PolarHBondContact O-N 2.83Å; L162-L165 PolarHBondContact O-N 3.42Å; L162-L165 VanDerWaalsContact O-N 3.14Å; L162-E166 WeakPolarHBondContact O-CB 3.4Å; L162-E166 VanDerWaalsContact O-CG 3.28Å; L162-E166 WeakPolarHBondContact O-CG 3.48Å; L162-E166 PolarHBondContact O-N 2.94Å
163A91.9Very high90.8Very high1 Ų140.4 Ų40.41%0.00823%0.23CC..Hα-helixtrans-59.3-39.3178.500000112.2C101 F102 L159 L160 F167C101-A163 HydrophobicContact CB-CB 4.29Å; F102-A163 HydrophobicContact CB-CB 4.16Å; L159-A163 VanDerWaalsContact O-CB 3.29Å; L159-A163 WeakPolarHBondContact O-CB 3.38Å; L159-A163 PolarHBondContact O-N 3.01Å; L160-A163 PolarHBondContact O-N 3.44Å; A163-F167 VanDerWaalsContact O-CB 3.25Å; A163-F167 WeakPolarHBondContact O-CB 3.39Å; A163-F167 PolarHBondContact O-N 3.45Å
164V93.9Very high90.8Very high63 Ų6341.1 Ų41.138%0.38223%0.233SC..Hα-helixtrans-65.4-44.7175.5170.80000111.5F102 L160 G161 L162 F167 I168F102-V164 HydrophobicContact CD2-CG2 3.83Å; F102-V164 HydrophobicContact CE2-CG2 3.74Å; L160-V164 WeakPolarHBondContact O-CG2 3.15Å; L160-V164 PolarHBondContact O-N 3.16Å; L160-V164 VanDerWaalsContact O-N 3.09Å; G161-V164 PolarHBondContact O-N 3.4Å; L162-V164 VanDerWaalsContact C-N 3.3Å; L162-V164 PolarHBondContact O-N 2.83Å; V164-F167 PolarHBondContact O-N 3.23Å; V164-I168 HydrophobicContact CG1-CD1 3.91Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.31Å; V164-I168 PolarHBondContact O-N 3.46Å
165L93.1Very high90.6Very high91 Ų9139.5 Ų39.548%0.47623%0.229SC..Hα-helixtrans-63.1-44.7177.9-69.1171.5000111.5L18 G161 L162 F167 I168 I169L18-L165 HydrophobicContact CD2-CB 3.56Å; L18-L165 HydrophobicContact CD2-CD1 4.23Å; G161-L165 WeakPolarHBondContact O-CG 3.49Å; G161-L165 PolarHBondContact O-N 3.45Å; G161-L165 VanDerWaalsContact O-N 3.11Å; L162-L165 PolarHBondContact O-N 3.42Å; L162-L165 VanDerWaalsContact O-N 3.14Å; L165-F167 PolarHBondContact O-N 3.31Å; L165-I168 PolarHBondContact O-N 2.74Å; L165-I169 VanDerWaalsContact O-CG1 3.3Å; L165-I169 WeakPolarHBondContact O-CG1 3.12Å; L165-I169 PolarHBondContact O-N 2.96Å
166E91.9Very high90.3Very high1 Ų141 Ų411%0.00524%0.237CC..Hα-helixtrans-58.2-46.1175-76.7178.4156.700112L15 L18 M61 L162 I168 I169 C170L15-E166 HydrophobicContact CD2-CB 4.41Å; L15-E166 HydrophobicContact CD2-CG 4.07Å; L18-E166 HydrophobicContact CB-CG 4.19Å; L18-E166 HydrophobicContact CD2-CG 4.03Å; M61-E166 HydrophobicContact CE-CB 3.53Å; M61-E166 HydrophobicContact CE-CG 3.76Å; L162-E166 WeakPolarHBondContact O-CB 3.4Å; L162-E166 VanDerWaalsContact O-CG 3.28Å; L162-E166 WeakPolarHBondContact O-CG 3.48Å; L162-E166 PolarHBondContact O-N 2.94Å; E166-I168 PolarHBondContact O-N 3.23Å; E166-I169 PolarHBondContact O-N 3.01Å; E166-C170 PolarHBondContact O-N 3.49Å; E166-C170 PolarHBondContact O-SG 3.49Å
167F92.8Very high89.7Confident83 Ų8340.9 Ų40.936%0.36424%0.237SC..Hα-helixtrans-60.1-46177.2-173.6-93.8000111.8L95 A163 V164 L165 I169 C170 L171L95-F167 HydrophobicContact CB-CE2 4.35Å; L95-F167 HydrophobicContact CD2-CD2 3.65Å; L95-F167 HydrophobicContact CD2-CE2 3.68Å; L95-F167 HydrophobicContact CD2-CG 4.08Å; L95-F167 HydrophobicContact CD2-CZ 4.14Å; L95-F167 WeakPolarHBondContact CD2-O 3.39Å; A163-F167 VanDerWaalsContact O-CB 3.25Å; A163-F167 WeakPolarHBondContact O-CB 3.39Å; A163-F167 PolarHBondContact O-N 3.45Å; V164-F167 PolarHBondContact O-N 3.23Å; L165-F167 PolarHBondContact O-N 3.31Å; F167-I169 PolarHBondContact O-N 2.98Å; F167-C170 PolarHBondContact O-N 3.49Å; F167-L171 HydrophobicContact CD1-CD1 3.73Å; F167-L171 HydrophobicContact CD1-CG 4.11Å; F167-L171 HydrophobicContact CE1-CD1 3.34Å; F167-L171 HydrophobicContact CE1-CD2 4.43Å; F167-L171 HydrophobicContact CE1-CG 3.87Å; F167-L171 HydrophobicContact CZ-CD1 4.14Å; F167-L171 HydrophobicContact CZ-CD2 4.48Å; F167-L171 HydrophobicContact CZ-CG 4.33Å; F167-L171 WeakPolarHBondContact O-CB 3.47Å; F167-L171 WeakPolarHBondContact O-CG 3.23Å; F167-L171 PolarHBondContact O-N 3.35Å
168I93.3Very high89Confident84 Ų8441.8 Ų41.843%0.43124%0.238SC..Hα-helixtrans-61.4-45177.2-67.7165.6000110.6V164 L165 E166 L171 L172V164-I168 HydrophobicContact CG1-CD1 3.91Å; V164-I168 VanDerWaalsContact O-CG1 3.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.31Å; V164-I168 PolarHBondContact O-N 3.46Å; L165-I168 PolarHBondContact O-N 2.74Å; E166-I168 PolarHBondContact O-N 3.23Å; I168-L171 PolarHBondContact O-N 3.47Å; I168-L172 HydrophobicContact CG2-CD1 4.21Å; I168-L172 WeakPolarHBondContact O-CG 3.29Å; I168-L172 PolarHBondContact O-N 2.92Å
169I91.1Very high88.3Confident21 Ų2142.1 Ų42.111%0.10824%0.24CC..Hα-helixtrans-62.6-45.5179.1-66.9166000111L11 A14 L15 L18 L165 E166 F167 L171 L172 Q173L11-I169 HydrophobicContact CB-CG2 3.82Å; L11-I169 HydrophobicContact CD1-CG2 4.29Å; L11-I169 HydrophobicContact CD2-CG1 4.5Å; L11-I169 HydrophobicContact CD2-CG2 3.97Å; L11-I169 HydrophobicContact CG-CG2 4.24Å; A14-I169 HydrophobicContact CB-CD1 4.46Å; L15-I169 HydrophobicContact CD1-CB 4.45Å; L15-I169 HydrophobicContact CD1-CG2 3.49Å; L15-I169 VanDerWaalsContact CD1-CG2 3.49Å; L15-I169 HydrophobicContact CD2-CG2 4.36Å; L15-I169 HydrophobicContact CG-CB 4.34Å; L15-I169 HydrophobicContact CG-CD1 4.24Å; L15-I169 HydrophobicContact CG-CG2 3.72Å; L18-I169 HydrophobicContact CD2-CD1 4.15Å; L165-I169 VanDerWaalsContact O-CG1 3.3Å; L165-I169 WeakPolarHBondContact O-CG1 3.12Å; L165-I169 PolarHBondContact O-N 2.96Å; E166-I169 PolarHBondContact O-N 3.01Å; F167-I169 PolarHBondContact O-N 2.98Å; I169-L171 VanDerWaalsContact C-N 3.33Å; I169-L171 PolarHBondContact O-N 3.26Å; I169-L172 PolarHBondContact O-N 3.34Å; I169-Q173 PolarHBondContact O-N 2.98Å
170C90.2Very high87.3Confident0 Ų043.6 Ų43.60%025%0.248CC..Hα-helixtrans-63.5-37.1177-73.30000112.2L95 E166 F167 Q173 L174L95-C170 HydrophobicContact CD2-CB 3.7Å; L95-C170 HydrophobicContact CG-CB 3.89Å; E166-C170 PolarHBondContact O-N 3.49Å; E166-C170 PolarHBondContact O-SG 3.49Å; F167-C170 PolarHBondContact O-N 3.49Å; C170-Q173 PolarHBondContact O-N 3.25Å; C170-L174 WeakPolarHBondContact O-CB 3.23Å; C170-L174 PolarHBondContact O-N 3Å
171L91.2Very high86.1Confident80 Ų8045.2 Ų45.242%0.41927%0.265SS..Hα-helixtrans-63.4-44.3173.9-80.1-177000112.2L95 F167 I168 I169 Q173 L174 G175L95-L171 HydrophobicContact CD1-CD2 3.89Å; L95-L171 HydrophobicContact CD2-CB 4.41Å; L95-L171 HydrophobicContact CD2-CD2 3.68Å; L95-L171 HydrophobicContact CD2-CG 3.61Å; L95-L171 HydrophobicContact CG-CD2 4.46Å; F167-L171 HydrophobicContact CD1-CD1 3.73Å; F167-L171 HydrophobicContact CD1-CG 4.11Å; F167-L171 HydrophobicContact CE1-CD1 3.34Å; F167-L171 HydrophobicContact CE1-CD2 4.43Å; F167-L171 HydrophobicContact CE1-CG 3.87Å; F167-L171 HydrophobicContact CZ-CD1 4.14Å; F167-L171 HydrophobicContact CZ-CD2 4.48Å; F167-L171 HydrophobicContact CZ-CG 4.33Å; F167-L171 WeakPolarHBondContact O-CB 3.47Å; F167-L171 WeakPolarHBondContact O-CG 3.23Å; F167-L171 PolarHBondContact O-N 3.35Å; I168-L171 PolarHBondContact O-N 3.47Å; I169-L171 VanDerWaalsContact C-N 3.33Å; I169-L171 PolarHBondContact O-N 3.26Å; L171-Q173 VanDerWaalsContact C-N 3.32Å; L171-Q173 PolarHBondContact O-N 3.32Å; L171-L174 PolarHBondContact O-N 3.1Å; L171-G175 PolarHBondContact O-N 2.99Å
172L89.2Confident84.9Confident83 Ų8349.5 Ų49.544%0.43528%0.278SS..Hα-helixtrans-61.5-42.4177-70172.9000111.2L11 I168 I169 G175 N176L11-L172 HydrophobicContact CD1-CB 4.2Å; I168-L172 HydrophobicContact CG2-CD1 4.21Å; I168-L172 WeakPolarHBondContact O-CG 3.29Å; I168-L172 PolarHBondContact O-N 2.92Å; I169-L172 PolarHBondContact O-N 3.34Å; L172-G175 PolarHBondContact O-N 3.46Å; L172-N176 VanDerWaalsContact O-CG 3.31Å; L172-N176 PolarHBondContact O-N 3.38Å; L172-N176 PolarHBondContact O-ND2 2.84Å
173Q85.9Confident83.3Confident9 Ų952.3 Ų52.34%0.04230%0.299CS..Hα-helixtrans-68.4-38.2177.4-173.759.53300112.3A8 L11 F68 I169 C170 L171 N176 G177A8-Q173 VanDerWaalsContact CB-OE1 3.25Å; L11-Q173 HydrophobicContact CD1-CB 4.3Å; F68-Q173 HydrophobicContact CD1-CG 3.78Å; F68-Q173 HydrophobicContact CD2-CB 4.28Å; F68-Q173 HydrophobicContact CD2-CG 3.97Å; F68-Q173 HydrophobicContact CE1-CB 4.27Å; F68-Q173 HydrophobicContact CE1-CG 3.42Å; F68-Q173 VanDerWaalsContact CE1-CG 3.42Å; F68-Q173 HydrophobicContact CE2-CB 3.65Å; F68-Q173 HydrophobicContact CE2-CG 3.61Å; F68-Q173 HydrophobicContact CG-CG 4.08Å; F68-Q173 HydrophobicContact CZ-CB 3.66Å; F68-Q173 HydrophobicContact CZ-CG 3.33Å; I169-Q173 PolarHBondContact O-N 2.98Å; C170-Q173 PolarHBondContact O-N 3.25Å; L171-Q173 VanDerWaalsContact C-N 3.32Å; L171-Q173 PolarHBondContact O-N 3.32Å; Q173-N176 PolarHBondContact O-N 3.17Å; Q173-G177 PolarHBondContact O-N 3.41Å
174L87.4Confident81.7Confident31 Ų3157.1 Ų57.116%0.16232%0.317CS..Hα-helixtrans-62-45.5174.2-17963.5000111.1V88 A91 I92 L95 C170 L171 G177 L178V88-L174 HydrophobicContact CG1-CD1 3.75Å; A91-L174 HydrophobicContact CB-CB 4.05Å; A91-L174 HydrophobicContact CB-CD1 4.46Å; I92-L174 HydrophobicContact CG1-CD1 4.17Å; L95-L174 HydrophobicContact CD1-CD2 3.63Å; C170-L174 WeakPolarHBondContact O-CB 3.23Å; C170-L174 PolarHBondContact O-N 3Å; L171-L174 PolarHBondContact O-N 3.1Å; L174-G177 PolarHBondContact O-N 3.16Å; L174-L178 HydrophobicContact CD1-CD1 4.18Å; L174-L178 HydrophobicContact CD1-CG 4.46Å; L174-L178 HydrophobicContact CG-CD1 3.91Å; L174-L178 WeakPolarHBondContact O-CB 3.25Å; L174-L178 WeakPolarHBondContact O-CG 3.36Å; L174-L178 PolarHBondContact O-N 3.11Å
175G84.4Confident79.3Confident32 Ų3259.4 Ų59.433%0.3333%0.333SS..Hα-helixtrans-59.2-47.517600000112.2L171 L172 G177 L178 V179L171-G175 PolarHBondContact O-N 2.99Å; L172-G175 PolarHBondContact O-N 3.46Å; G175-G177 VanDerWaalsContact C-N 3.35Å; G175-G177 PolarHBondContact O-N 2.95Å; G175-L178 PolarHBondContact O-N 3.05Å; G175-V179 WeakPolarHBondContact O-CG2 3.27Å; G175-V179 PolarHBondContact O-N 2.92Å
176N81.2Confident77.1Confident50 Ų5060.3 Ų60.327%0.26735%0.346SS..Hα-helixtrans-63.9-39.1176.1-70.6-30.6000112.6F7 L172 Q173 N180F7-N176 WeakPolarHBondContact CD1-ND2 3.42Å; F7-N176 WeakPolarHBondContact CE1-ND2 3.28Å; L172-N176 VanDerWaalsContact O-CG 3.31Å; L172-N176 PolarHBondContact O-N 3.38Å; L172-N176 PolarHBondContact O-ND2 2.84Å; Q173-N176 PolarHBondContact O-N 3.17Å; N176-N180 WeakPolarHBondContact O-CB 3.35Å; N176-N180 VanDerWaalsContact O-CG 3.25Å; N176-N180 PolarHBondContact O-N 3.23Å; N176-N180 PolarHBondContact O-ND2 2.93Å
177G75.9Confident74.7Confident3 Ų363.8 Ų63.83%0.03137%0.369CS..Hα-helixtrans-61.5-44.5174.600000112.2Q173 L174 G175 N180 A181Q173-G177 PolarHBondContact O-N 3.41Å; L174-G177 PolarHBondContact O-N 3.16Å; G175-G177 VanDerWaalsContact C-N 3.35Å; G175-G177 PolarHBondContact O-N 2.95Å; G177-N180 PolarHBondContact O-N 3.4Å; G177-A181 WeakPolarHBondContact O-CB 3.32Å; G177-A181 PolarHBondContact O-N 3.13Å
178L77.8Confident72.2Confident81 Ų8168.4 Ų68.442%0.42439%0.385SS..Hα-helixtrans-66.7-44.6177.4-76.3161.5000112.4L174 G175 N180 A181 I182L174-L178 HydrophobicContact CD1-CD1 4.18Å; L174-L178 HydrophobicContact CD1-CG 4.46Å; L174-L178 HydrophobicContact CG-CD1 3.91Å; L174-L178 WeakPolarHBondContact O-CB 3.25Å; L174-L178 WeakPolarHBondContact O-CG 3.36Å; L174-L178 PolarHBondContact O-N 3.11Å; G175-L178 PolarHBondContact O-N 3.05Å; L178-N180 VanDerWaalsContact C-N 3.32Å; L178-N180 PolarHBondContact O-N 2.78Å; L178-A181 PolarHBondContact O-N 2.71Å; L178-A181 VanDerWaalsContact O-N 3.15Å; L178-I182 WeakPolarHBondContact O-CB 3.47Å; L178-I182 VanDerWaalsContact O-CG1 3.3Å; L178-I182 WeakPolarHBondContact O-CG1 3.15Å; L178-I182 PolarHBondContact O-N 3.44Å
179V76.4Confident69.4Low82 Ų8273.3 Ų73.350%0.49740%0.403SS..Hα-helixtrans-60.9-43.8175.8171.20000110.3G175 A181 I182 C183G175-V179 WeakPolarHBondContact O-CG2 3.27Å; G175-V179 PolarHBondContact O-N 2.92Å; V179-A181 VanDerWaalsContact C-N 3.31Å; V179-A181 PolarHBondContact O-N 3.42Å; V179-I182 PolarHBondContact O-N 3.41Å; V179-C183 WeakPolarHBondContact O-CB 3.31Å; V179-C183 PolarHBondContact O-N 3.07Å; V179-C183 PolarHBondContact O-SG 3.46Å; V179-C183 VanDerWaalsContact O-SG 3.41Å
180N68.4Low67.1Low33 Ų3378.5 Ų78.518%0.17643%0.427CS..Hα-helixtrans-64.9-33.5175.6-74.1-35.2000112.8S4 M84 N176 G177 L178 R184S4-N180 PolarHBondContact OG-ND2 3.41Å; M84-N180 HydrophobicContact CE-CB 4.42Å; M84-N180 HydrophobicContact SD-CB 4.22Å; N176-N180 WeakPolarHBondContact O-CB 3.35Å; N176-N180 VanDerWaalsContact O-CG 3.25Å; N176-N180 PolarHBondContact O-N 3.23Å; N176-N180 PolarHBondContact O-ND2 2.93Å; G177-N180 PolarHBondContact O-N 3.4Å; L178-N180 VanDerWaalsContact C-N 3.32Å; L178-N180 PolarHBondContact O-N 2.78Å; N180-R184 WeakPolarHBondContact O-CB 3.48Å; N180-R184 PolarHBondContact O-N 3.21Å
181A67.4Low64.7Low62 Ų6285.9 Ų85.951%0.51246%0.462SS..Hα-helixtrans-71.9-43.9176.500000112.5G177 L178 V179G177-A181 WeakPolarHBondContact O-CB 3.32Å; G177-A181 PolarHBondContact O-N 3.13Å; L178-A181 PolarHBondContact O-N 2.71Å; L178-A181 VanDerWaalsContact O-N 3.15Å; V179-A181 VanDerWaalsContact C-N 3.31Å; V179-A181 PolarHBondContact O-N 3.42Å
182I67Low62.3Low128 Ų12890 Ų9066%0.65647%0.473SS*.Hα-helixtrans-77.1-40.2-177.8-63165.4000111.1L178 V179 R184 P185L178-I182 WeakPolarHBondContact O-CB 3.47Å; L178-I182 VanDerWaalsContact O-CG1 3.3Å; L178-I182 WeakPolarHBondContact O-CG1 3.15Å; L178-I182 PolarHBondContact O-N 3.44Å; V179-I182 PolarHBondContact O-N 3.41Å; I182-R184 PolarHBondContact O-N 2.82Å; I182-P185 WeakPolarHBondContact O-CD 3.21Å
183C59.4Low60Low81 Ų8189.8 Ų89.855%0.54748%0.479SS..SBendtrans-79-0.2179.1-64.10000113.9V179 P185V179-C183 WeakPolarHBondContact O-CB 3.31Å; V179-C183 PolarHBondContact O-N 3.07Å; V179-C183 PolarHBondContact O-SG 3.46Å; V179-C183 VanDerWaalsContact O-SG 3.41Å; C183-P185 WeakPolarHBondContact O-CD 3.47Å
184R57.2Low58.2Low102 Ų10296 Ų9639%0.38551%0.511SS..  trans-98.675.2164.5-90.1-167.6174.8-164.80.1112.9E80 N180 I182 C186E80-R184 VanDerWaalsContact CD-NH1 3.33Å; E80-R184 IonicContact OE1-CZ 3.69Å; E80-R184 IonicContact OE1-NH1 3.68Å; E80-R184 IonicContact OE1-NH2 2.78Å; E80-R184 PolarHBondContact OE1-NH2 3.31Å; E80-R184 IonicContact OE2-CZ 3.32Å; E80-R184 VanDerWaalsContact OE2-CZ 3.32Å; E80-R184 IonicContact OE2-NH1 2.71Å; E80-R184 PolarHBondContact OE2-NH1 3.34Å; E80-R184 IonicContact OE2-NH2 3.05Å; E80-R184 PolarHBondContact OE2-NH2 3.38Å; N180-R184 WeakPolarHBondContact O-CB 3.48Å; N180-R184 PolarHBondContact O-N 3.21Å; I182-R184 PolarHBondContact O-N 2.82Å; R184-C186 VanDerWaalsContact C-N 3.27Å
185P43.3Very low56.2Low111 Ų111101.7 Ų101.772%0.72154%0.542SS*.  trans-81.9-0.8151.7-12.128.4000113.5I182 C183I182-P185 WeakPolarHBondContact O-CD 3.21Å; C183-P185 WeakPolarHBondContact O-CD 3.47Å
186C47.1Very low54.2Low110 Ų110107 Ų10774%0.74358%0.583SS**SBendtrans-123.679.8-171.7-750000112.2R184R184-C186 VanDerWaalsContact C-N 3.27Å
187C42.8Very low52.8Low73 Ų73109.9 Ų109.949%0.49360%0.599SS.*SBendtrans-163.6-0.4151.1-99.10000113.1K189C187-K189 PolarHBondContact O-N 3.45Å
188Y40.2Very low51.6Low180 Ų180115.5 Ų115.571%0.70663%0.629SS**THydrogen-bonded Turntrans-76.1-8.9171.1-167.4-101000113.2Q190 Y192Y188-Q190 VanDerWaalsContact C-N 3.33Å; Y188-Q190 PolarHBondContact O-N 3.21Å; Y188-Y192 HydrophobicContact CE1-CD2 4.18Å; Y188-Y192 HydrophobicContact CE1-CE2 4.05Å; Y188-Y192 AromaticContact CZ-CE2 3.96Å; Y188-Y192 WeakPolarHBondContact OH-CE2 3.47Å
189K34.6Very low50.1Low188 Ų188117.4 Ų117.482%0.81764%0.64SS**THydrogen-bonded Turntrans-83.4-3.2-176.4-143.9173-174.9176.90114.6C187 S193C187-K189 PolarHBondContact O-N 3.45Å; K189-S193 PolarHBondContact O-OG 3.44Å
190Q41.5Very low48.6Very low129 Ų129119.5 Ų119.560%0.60365%0.648SS**SBendtrans-98.8-17.7-172-130.8161.1-3200114.6Y188Y188-Q190 VanDerWaalsContact C-N 3.33Å; Y188-Q190 PolarHBondContact O-N 3.21Å
191E39.5Very low47.3Very low155 Ų155124.9 Ų124.972%0.72468%0.678SS**SBendtrans-86.5-23.6179.2-147.7113110.700113
192Y41.7Very low46Very low166 Ų166129.1 Ų129.165%0.65169%0.689SS**SBendtrans-87.2-18.3177.4-88.9-86.3000114.3Y188Y188-Y192 HydrophobicContact CE1-CD2 4.18Å; Y188-Y192 HydrophobicContact CE1-CE2 4.05Å; Y188-Y192 AromaticContact CZ-CE2 3.96Å; Y188-Y192 WeakPolarHBondContact OH-CE2 3.47Å
193S41.1Very low44.5Very low80 Ų80129.2 Ų129.256%0.55969%0.691SS**SBendtrans-95.4-1.3-179.464.30000114.3K189K189-S193 PolarHBondContact O-OG 3.44Å
194L48.9Very low43.4Very low140 Ų140132.9 Ų132.973%0.73370%0.702SS**SBendtrans-103.6-8.8176.7-119.6145.5000112.4
195N44.4Very low42.2Very low149 Ų149135.5 Ų135.580%0.79773%0.729SS**  trans-11714.5176.2-67.8-19.2000112.8
196A41.3Very low42.1Very low145 Ų145137.7 Ų137.7100%1.19873%0.73SS**  trans-118.90175.200000110.7

Retrieved 196 of 196 residues in 1031.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).