A0A077ZI36_TRITR Loading...

Protein-S-isoprenylcysteine O-methyltransferase

Catalyzes the post-translational methylation of isoprenylated C-terminal cysteine residues.

AlphaFold DB , UniProt , Accession A0A077ZI36, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 273 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M49.6Very low85.6Confident167 Ų16763.3 Ų63.382%0.82332%0.318SS*.  0134.60-78.9176.1178.400107.3T3 F5 R6M1-T3 PolarHBondContact O-N 3.06Å; M1-F5 HydrophobicContact CB-CD1 4.36Å; M1-F5 HydrophobicContact CE-CD1 4.03Å; M1-F5 HydrophobicContact CE-CE1 3.66Å; M1-F5 HydrophobicContact CG-CD1 3.88Å; M1-F5 HydrophobicContact CG-CE1 4.42Å; M1-F5 HydrophobicContact SD-CD1 3.59Å; M1-F5 VanDerWaalsContact SD-CD1 3.59Å; M1-F5 HydrophobicContact SD-CE1 3.85Å; M1-R6 HydrophobicContact CB-CB 4.33Å
2E67.1Low86.4Confident150 Ų15065.9 Ų65.970%0.70133%0.327SS*.  trans-51135.5166.2-63-177.7168.100108.2P4 F5 R6E2-P4 WeakPolarHBondContact O-CD 3.03Å; E2-P4 VanDerWaalsContact O-N 3.07Å; E2-F5 PolarHBondContact O-N 3.37Å; E2-F5 VanDerWaalsContact O-N 3.1Å; E2-R6 PolarHBondContact O-N 3.15Å
3T84.7Confident86.9Confident91 Ų9168.8 Ų68.856%0.55834%0.343SS*.Hα-helixtrans-47.8-37.2-176.5480000113M1 R6 H7M1-T3 PolarHBondContact O-N 3.06Å; T3-R6 PolarHBondContact O-N 3.2Å; T3-H7 PolarHBondContact O-N 3.07Å; T3-H7 PolarHBondContact O-ND1 3.46Å
4P90.2Very high87.3Confident18 Ų1865.6 Ų65.612%0.11733%0.33CS..Hα-helixtrans-67.1-43179.8-22.738.4000113.9E2 R6 H7 A8 L114E2-P4 WeakPolarHBondContact O-CD 3.03Å; E2-P4 VanDerWaalsContact O-N 3.07Å; P4-R6 VanDerWaalsContact C-N 3.3Å; P4-R6 PolarHBondContact O-N 3Å; P4-H7 WeakPolarHBondContact O-CB 3.29Å; P4-H7 PolarHBondContact O-N 3.32Å; P4-H7 VanDerWaalsContact O-N 3.09Å; P4-A8 PolarHBondContact O-N 2.62Å; P4-L114 HydrophobicContact CB-CD2 3.75Å; P4-L114 HydrophobicContact CG-CD2 4.43Å
5F91Very high87.7Confident98 Ų9862.1 Ų62.143%0.4331%0.312SS..Hα-helixtrans-63.3-38.9179.1-176-100.2000111.5M1 E2 H7 A8 V9M1-F5 HydrophobicContact CB-CD1 4.36Å; M1-F5 HydrophobicContact CE-CD1 4.03Å; M1-F5 HydrophobicContact CE-CE1 3.66Å; M1-F5 HydrophobicContact CG-CD1 3.88Å; M1-F5 HydrophobicContact CG-CE1 4.42Å; M1-F5 HydrophobicContact SD-CD1 3.59Å; M1-F5 VanDerWaalsContact SD-CD1 3.59Å; M1-F5 HydrophobicContact SD-CE1 3.85Å; E2-F5 PolarHBondContact O-N 3.37Å; E2-F5 VanDerWaalsContact O-N 3.1Å; F5-H7 VanDerWaalsContact C-N 3.3Å; F5-H7 PolarHBondContact O-N 3.14Å; F5-A8 PolarHBondContact O-N 2.89Å; F5-V9 HydrophobicContact CD1-CG2 4.07Å; F5-V9 HydrophobicContact CE1-CG2 3.6Å; F5-V9 HydrophobicContact CE2-CG2 4.22Å; F5-V9 HydrophobicContact CZ-CG2 3.68Å; F5-V9 WeakPolarHBondContact O-CG2 3.38Å; F5-V9 PolarHBondContact O-N 3.31Å
6R91.3Very high88.1Confident85 Ų8560.8 Ų60.832%0.32131%0.31SS..Hα-helixtrans-59.7-41.7174.2-167.2-174.271.4-170.90.2111.4M1 E2 T3 P4 A10 D53M1-R6 HydrophobicContact CB-CB 4.33Å; E2-R6 PolarHBondContact O-N 3.15Å; T3-R6 PolarHBondContact O-N 3.2Å; P4-R6 VanDerWaalsContact C-N 3.3Å; P4-R6 PolarHBondContact O-N 3Å; R6-A10 VanDerWaalsContact O-CB 3.25Å; R6-A10 WeakPolarHBondContact O-CB 3.31Å; R6-A10 PolarHBondContact O-N 3.19Å; R6-D53 IonicContact CZ-OD2 3Å; R6-D53 IonicContact NH1-OD2 2.63Å; R6-D53 IonicContact NH2-OD2 3.69Å; R6-D53 PolarHBondContact NH2-OD2 3.23Å
7H93.4Very high88.3Confident13 Ų1360.4 Ų60.46%0.0631%0.314CS..Hα-helixtrans-69-37.6176.3-71.897.7000112.7T3 P4 F5 S11 S55 L56 V59 F103 L114T3-H7 PolarHBondContact O-N 3.07Å; T3-H7 PolarHBondContact O-ND1 3.46Å; P4-H7 WeakPolarHBondContact O-CB 3.29Å; P4-H7 PolarHBondContact O-N 3.32Å; P4-H7 VanDerWaalsContact O-N 3.09Å; F5-H7 VanDerWaalsContact C-N 3.3Å; F5-H7 PolarHBondContact O-N 3.14Å; H7-S11 VanDerWaalsContact O-CB 3.29Å; H7-S11 WeakPolarHBondContact O-CB 3.46Å; H7-S11 PolarHBondContact O-N 3.09Å; H7-S11 PolarHBondContact O-OG 3.29Å; H7-S55 PolarHBondContact NE2-OG 3.15Å; H7-L56 WeakPolarHBondContact NE2-CA 3.34Å; H7-L56 PolarHBondContact NE2-N 3.33Å; H7-V59 HydrophobicContact CB-CG1 4.45Å; H7-V59 VanDerWaalsContact CD2-CG2 3.49Å; H7-V59 WeakPolarHBondContact CD2-CG2 3.44Å; H7-F103 HydrophobicContact CB-CE1 4.27Å; H7-F103 HydrophobicContact CB-CZ 3.99Å; H7-L114 HydrophobicContact CB-CD2 4.14Å
8A94.7Very high88.4Confident1 Ų157.1 Ų57.11%0.00830%0.297CS..Hα-helixtrans-61.1-50.4174.400000111.4P4 F5 S11 F12 F104 A107 L108P4-A8 PolarHBondContact O-N 2.62Å; F5-A8 PolarHBondContact O-N 2.89Å; A8-S11 PolarHBondContact O-N 3.13Å; A8-S11 PolarHBondContact O-OG 2.87Å; A8-F12 WeakPolarHBondContact O-CB 3.3Å; A8-F12 PolarHBondContact O-N 3.36Å; A8-F104 HydrophobicContact CB-CD2 4.36Å; A8-F104 HydrophobicContact CB-CE2 4.21Å; A8-F104 WeakPolarHBondContact O-CE2 3.4Å; A8-A107 HydrophobicContact CB-CB 3.71Å; A8-L108 HydrophobicContact CB-CD2 3.88Å; A8-L108 HydrophobicContact CB-CG 4.29Å
9V93.4Very high88.5Confident54 Ų5454.9 Ų54.933%0.32729%0.288SS..Hα-helixtrans-62.5-47178.6173.60000111.1F5 F12 L13F5-V9 HydrophobicContact CD1-CG2 4.07Å; F5-V9 HydrophobicContact CE1-CG2 3.6Å; F5-V9 HydrophobicContact CE2-CG2 4.22Å; F5-V9 HydrophobicContact CZ-CG2 3.68Å; F5-V9 WeakPolarHBondContact O-CG2 3.38Å; F5-V9 PolarHBondContact O-N 3.31Å; V9-F12 PolarHBondContact O-N 3.27Å; V9-L13 HydrophobicContact CG1-CD1 3.79Å; V9-L13 HydrophobicContact CG1-CG 4.29Å; V9-L13 WeakPolarHBondContact O-CB 3.44Å; V9-L13 WeakPolarHBondContact O-CG 3.16Å; V9-L13 PolarHBondContact O-N 3.46Å
10A91.8Very high88.6Confident19 Ų1957.2 Ų57.216%0.15730%0.303CS..Hα-helixtrans-60.9-47.8178.900000111.8R6 F12 L13 C14 L56 V60R6-A10 VanDerWaalsContact O-CB 3.25Å; R6-A10 WeakPolarHBondContact O-CB 3.31Å; R6-A10 PolarHBondContact O-N 3.19Å; A10-F12 PolarHBondContact O-N 2.97Å; A10-L13 PolarHBondContact O-N 2.86Å; A10-C14 WeakPolarHBondContact O-CB 3.46Å; A10-C14 PolarHBondContact O-N 3.42Å; A10-C14 PolarHBondContact O-SG 3.37Å; A10-L56 HydrophobicContact CB-CD1 3.73Å; A10-V60 HydrophobicContact CB-CG2 4.22Å
11S94.2Very high88.6Confident0 Ų058.2 Ų58.20%031%0.308CS..Hα-helixtrans-60.7-45.4179.157.30000112.4H7 A8 F15 S63H7-S11 VanDerWaalsContact O-CB 3.29Å; H7-S11 WeakPolarHBondContact O-CB 3.46Å; H7-S11 PolarHBondContact O-N 3.09Å; H7-S11 PolarHBondContact O-OG 3.29Å; A8-S11 PolarHBondContact O-N 3.13Å; A8-S11 PolarHBondContact O-OG 2.87Å; S11-F15 VanDerWaalsContact O-CB 3.22Å; S11-F15 WeakPolarHBondContact O-CB 3.27Å; S11-F15 PolarHBondContact O-N 3.38Å; S11-S63 VanDerWaalsContact CA-OG 3.23Å; S11-S63 WeakPolarHBondContact CA-OG 3.28Å; S11-S63 WeakPolarHBondContact CB-OG 3.47Å; S11-S63 WeakPolarHBondContact O-CB 3.34Å
12F95.4Very high90.3Very high95 Ų9550.5 Ų50.542%0.41727%0.27SS..Hα-helixtrans-61.6-49.3177.7179.4-96.2000112.8A8 V9 A10 S16 F100 F104A8-F12 WeakPolarHBondContact O-CB 3.3Å; A8-F12 PolarHBondContact O-N 3.36Å; V9-F12 PolarHBondContact O-N 3.27Å; A10-F12 PolarHBondContact O-N 2.97Å; F12-S16 VanDerWaalsContact O-CB 3.27Å; F12-S16 WeakPolarHBondContact O-CB 3.31Å; F12-S16 PolarHBondContact O-N 3.43Å; F12-S16 PolarHBondContact O-OG 2.65Å; F12-F100 HydrophobicContact CD2-CZ 4.15Å; F12-F104 HydrophobicContact CB-CD2 4.14Å; F12-F104 HydrophobicContact CB-CE2 3.63Å; F12-F104 HydrophobicContact CB-CZ 4.22Å; F12-F104 HydrophobicContact CD2-CE2 4.24Å; F12-F104 HydrophobicContact CD2-CZ 4.02Å; F12-F104 HydrophobicContact CG-CE2 4.26Å; F12-F104 HydrophobicContact CG-CZ 4.37Å
13L92.7Very high91.3Very high103 Ų10346.5 Ų46.554%0.53925%0.25SS..Hα-helixtrans-63.3-44.2-179.5-71.7178.3000111.2V9 A10 S17V9-L13 HydrophobicContact CG1-CD1 3.79Å; V9-L13 HydrophobicContact CG1-CG 4.29Å; V9-L13 WeakPolarHBondContact O-CB 3.44Å; V9-L13 WeakPolarHBondContact O-CG 3.16Å; V9-L13 PolarHBondContact O-N 3.46Å; A10-L13 PolarHBondContact O-N 2.86Å; L13-S17 WeakPolarHBondContact O-CB 3.32Å; L13-S17 PolarHBondContact O-N 3.07Å; L13-S17 PolarHBondContact O-OG 3.44Å
14C92.1Very high91.4Very high24 Ų2449.8 Ų49.816%0.16225%0.254CS..Hα-helixtrans-69.6-40.8-179.3-710000112.7A10 S17 S18 V60 M64A10-C14 WeakPolarHBondContact O-CB 3.46Å; A10-C14 PolarHBondContact O-N 3.42Å; A10-C14 PolarHBondContact O-SG 3.37Å; C14-S17 PolarHBondContact O-OG 2.96Å; C14-S18 WeakPolarHBondContact O-CB 3.27Å; C14-S18 PolarHBondContact O-N 2.95Å; C14-V60 HydrophobicContact CB-CG1 4.48Å; C14-M64 HydrophobicContact CB-CG 3.76Å
15F94.5Very high91.1Very high13 Ų1351.3 Ų51.36%0.05726%0.26CS..Hα-helixtrans-62.2-50.1174.2178.5-90.2000111S11 C19 S63 L66 Y70 F100S11-F15 VanDerWaalsContact O-CB 3.22Å; S11-F15 WeakPolarHBondContact O-CB 3.27Å; S11-F15 PolarHBondContact O-N 3.38Å; F15-C19 WeakPolarHBondContact O-CB 3.08Å; F15-C19 PolarHBondContact O-N 3.05Å; F15-S63 WeakPolarHBondContact CA-O 3.48Å; F15-L66 HydrophobicContact CD2-CB 3.96Å; F15-L66 HydrophobicContact CE2-CB 4Å; F15-Y70 HydrophobicContact CZ-CD1 4.41Å; F15-Y70 AromaticContact CZ-CD2 3.99Å; F15-Y70 HydrophobicContact CZ-CD2 3.99Å; F15-Y70 AromaticContact CZ-CG 3.84Å; F15-Y70 HydrophobicContact CZ-CG 3.84Å; F15-F100 HydrophobicContact CB-CD2 3.7Å; F15-F100 HydrophobicContact CB-CE2 3.68Å; F15-F100 HydrophobicContact CB-CG 4.24Å; F15-F100 HydrophobicContact CB-CZ 4.2Å; F15-F100 AromaticContact CD1-CD1 3.85Å; F15-F100 HydrophobicContact CD1-CD1 3.85Å; F15-F100 HydrophobicContact CD1-CD2 4.34Å; F15-F100 AromaticContact CD1-CE1 3.81Å; F15-F100 HydrophobicContact CD1-CE1 3.81Å; F15-F100 HydrophobicContact CD1-CE2 4.31Å; F15-F100 HydrophobicContact CD1-CG 4.12Å; F15-F100 HydrophobicContact CD1-CZ 4.05Å; F15-F100 HydrophobicContact CD2-CB 3.65Å; F15-F100 AromaticContact CD2-CD1 3.96Å; F15-F100 HydrophobicContact CD2-CD1 3.96Å; F15-F100 AromaticContact CD2-CD2 3.77Å; F15-F100 HydrophobicContact CD2-CD2 3.77Å; F15-F100 HydrophobicContact CD2-CE2 4.47Å; F15-F100 AromaticContact CD2-CG 3.48Å; F15-F100 HydrophobicContact CD2-CG 3.48Å; F15-F100 VanDerWaalsContact CD2-CG 3.48Å; F15-F100 AromaticContact CE1-CD1 3.86Å; F15-F100 HydrophobicContact CE1-CD1 3.86Å; F15-F100 HydrophobicContact CE1-CE1 4.05Å; F15-F100 HydrophobicContact CE1-CG 4.38Å; F15-F100 HydrophobicContact CE2-CB 3.66Å; F15-F100 AromaticContact CE2-CD1 3.96Å; F15-F100 HydrophobicContact CE2-CD1 3.96Å; F15-F100 AromaticContact CE2-CG 3.77Å; F15-F100 HydrophobicContact CE2-CG 3.77Å; F15-F100 HydrophobicContact CG-CB 4.36Å; F15-F100 AromaticContact CG-CD1 3.91Å; F15-F100 HydrophobicContact CG-CD1 3.91Å; F15-F100 AromaticContact CG-CD2 3.67Å; F15-F100 HydrophobicContact CG-CD2 3.67Å; F15-F100 HydrophobicContact CG-CE1 4.13Å; F15-F100 AromaticContact CG-CE2 3.91Å; F15-F100 HydrophobicContact CG-CE2 3.91Å; F15-F100 AromaticContact CG-CG 3.67Å; F15-F100 HydrophobicContact CG-CG 3.67Å; F15-F100 HydrophobicContact CG-CZ 4.13Å; F15-F100 HydrophobicContact CZ-CB 4.39Å; F15-F100 AromaticContact CZ-CD1 3.91Å; F15-F100 HydrophobicContact CZ-CD1 3.91Å; F15-F100 HydrophobicContact CZ-CG 4.21Å
16S94.1Very high90.8Very high41 Ų4148.2 Ų48.229%0.28725%0.248SC..Hα-helixtrans-67.8-45.9-175.7-54.70000112.3F12 C19 V20F12-S16 VanDerWaalsContact O-CB 3.27Å; F12-S16 WeakPolarHBondContact O-CB 3.31Å; F12-S16 PolarHBondContact O-N 3.43Å; F12-S16 PolarHBondContact O-OG 2.65Å; S16-C19 WeakPolarHBondContact O-CB 3.37Å; S16-C19 PolarHBondContact O-N 3.31Å; S16-V20 WeakPolarHBondContact O-CG2 3.28Å; S16-V20 PolarHBondContact O-N 3.36Å
17S90.9Very high90.5Very high54 Ų5448.6 Ų48.638%0.37825%0.253SS..Hα-helixtrans-64.3-44.5177.556.10000111.9L13 C14 C19 V20 I21L13-S17 WeakPolarHBondContact O-CB 3.32Å; L13-S17 PolarHBondContact O-N 3.07Å; L13-S17 PolarHBondContact O-OG 3.44Å; C14-S17 PolarHBondContact O-OG 2.96Å; S17-C19 VanDerWaalsContact C-N 3.33Å; S17-C19 PolarHBondContact O-N 3.46Å; S17-V20 PolarHBondContact O-N 2.99Å; S17-I21 WeakPolarHBondContact O-CB 3.5Å; S17-I21 WeakPolarHBondContact O-CD1 3.42Å; S17-I21 VanDerWaalsContact O-CG1 3.23Å; S17-I21 WeakPolarHBondContact O-CG1 3.32Å; S17-I21 PolarHBondContact O-N 3.14Å
18S89.9Confident90Very high1 Ų149.7 Ų49.71%0.00726%0.262CS..Hα-helixtrans-56.5-48.6174.1-179.20000110.7C14 V20 I21 Y22 M64 C68C14-S18 WeakPolarHBondContact O-CB 3.27Å; C14-S18 PolarHBondContact O-N 2.95Å; S18-V20 PolarHBondContact O-N 2.9Å; S18-I21 PolarHBondContact O-N 3.3Å; S18-Y22 WeakPolarHBondContact O-CD2 3.25Å; S18-Y22 PolarHBondContact O-N 3.26Å; S18-Y22 VanDerWaalsContact OG-CD2 3.26Å; S18-Y22 WeakPolarHBondContact OG-CD2 3.48Å; S18-Y22 VanDerWaalsContact OG-CE2 3.3Å; S18-Y22 WeakPolarHBondContact OG-CE2 3.27Å; S18-M64 PolarHBondContact OG-O 2.98Å; S18-C68 PolarHBondContact OG-N 3.01Å
19C91.3Very high88.9Confident17 Ų1756.3 Ų56.312%0.11530%0.297CS..Hα-helixtrans-54.8-51.5177.3177.80000112.3F15 S16 S17 F23 G67 A71F15-C19 WeakPolarHBondContact O-CB 3.08Å; F15-C19 PolarHBondContact O-N 3.05Å; S16-C19 WeakPolarHBondContact O-CB 3.37Å; S16-C19 PolarHBondContact O-N 3.31Å; S17-C19 VanDerWaalsContact C-N 3.33Å; S17-C19 PolarHBondContact O-N 3.46Å; C19-F23 WeakPolarHBondContact O-CB 3.14Å; C19-F23 PolarHBondContact O-N 3.38Å; C19-G67 WeakPolarHBondContact CA-O 3.29Å; C19-A71 WeakPolarHBondContact O-CB 3.35Å
20V90.2Very high87.2Confident99 Ų9961.3 Ų61.360%0.631%0.314SS*.Hα-helixtrans-63-46.5-178.6172.50000111.6S16 S17 S18 Y24S16-V20 WeakPolarHBondContact O-CG2 3.28Å; S16-V20 PolarHBondContact O-N 3.36Å; S17-V20 PolarHBondContact O-N 2.99Å; S18-V20 PolarHBondContact O-N 2.9Å; V20-Y24 WeakPolarHBondContact O-CB 3.41Å; V20-Y24 PolarHBondContact O-N 3.32Å
21I87.7Confident85.5Confident80 Ų8068.6 Ų68.641%0.4134%0.342SS..Hα-helixtrans-62.1-52.9-178.4-68.9165.9000110.3S17 S18 F23 Y24 L25S17-I21 WeakPolarHBondContact O-CB 3.5Å; S17-I21 WeakPolarHBondContact O-CD1 3.42Å; S17-I21 VanDerWaalsContact O-CG1 3.23Å; S17-I21 WeakPolarHBondContact O-CG1 3.32Å; S17-I21 PolarHBondContact O-N 3.14Å; S18-I21 PolarHBondContact O-N 3.3Å; I21-F23 PolarHBondContact O-N 3.24Å; I21-Y24 PolarHBondContact O-N 3.38Å; I21-L25 HydrophobicContact CG2-CD1 3.92Å; I21-L25 HydrophobicContact CG2-CG 4.43Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.47Å; I21-L25 PolarHBondContact O-N 3.41Å
22Y86.6Confident84Confident5 Ų575.6 Ų75.62%0.0238%0.379CS..Hα-helixtrans-68.8-35.7-176.9-73.2-65.3000112.5S18 L25 L26 I36 S39 C40 C68S18-Y22 WeakPolarHBondContact O-CD2 3.25Å; S18-Y22 PolarHBondContact O-N 3.26Å; S18-Y22 VanDerWaalsContact OG-CD2 3.26Å; S18-Y22 WeakPolarHBondContact OG-CD2 3.48Å; S18-Y22 VanDerWaalsContact OG-CE2 3.3Å; S18-Y22 WeakPolarHBondContact OG-CE2 3.27Å; Y22-L25 HydrophobicContact CD1-CD1 4.15Å; Y22-L25 HydrophobicContact CE1-CD1 4.38Å; Y22-L25 PolarHBondContact O-N 3.23Å; Y22-L26 WeakPolarHBondContact O-CB 3.32Å; Y22-L26 VanDerWaalsContact O-CG 3.23Å; Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 2.69Å; Y22-I36 HydrophobicContact CD1-CB 4.43Å; Y22-I36 HydrophobicContact CD1-CG1 4.19Å; Y22-I36 HydrophobicContact CD1-CG2 3.79Å; Y22-I36 HydrophobicContact CE1-CB 4.23Å; Y22-I36 HydrophobicContact CE1-CG1 4.41Å; Y22-I36 HydrophobicContact CE1-CG2 3.6Å; Y22-S39 PolarHBondContact OH-OG 2.9Å; Y22-C40 VanDerWaalsContact CZ-SG 3.58Å; Y22-C40 PolarHBondContact OH-N 3.17Å; Y22-C40 PolarHBondContact OH-SG 3.24Å; Y22-C68 HydrophobicContact CD2-CB 3.62Å; Y22-C68 HydrophobicContact CE2-CB 3.88Å; Y22-C68 HydrophobicContact CG-CB 4.19Å
23F87.2Confident82.3Confident65 Ų6575 Ų7529%0.28539%0.386SS..Hα-helixtrans-61.2-46.8174.2-175.5-98.2000110.9C19 I21 L25 L26 F27 A71 L74 T78C19-F23 WeakPolarHBondContact O-CB 3.14Å; C19-F23 PolarHBondContact O-N 3.38Å; I21-F23 PolarHBondContact O-N 3.24Å; F23-L25 PolarHBondContact O-N 2.89Å; F23-L26 PolarHBondContact O-N 3.1Å; F23-F27 HydrophobicContact CD1-CD2 4.04Å; F23-F27 HydrophobicContact CD1-CE2 4.31Å; F23-F27 HydrophobicContact CD2-CD2 4.24Å; F23-F27 HydrophobicContact CD2-CE2 4.06Å; F23-F27 AromaticContact CE1-CD2 3.72Å; F23-F27 HydrophobicContact CE1-CD2 3.72Å; F23-F27 AromaticContact CE1-CE2 3.64Å; F23-F27 HydrophobicContact CE1-CE2 3.64Å; F23-F27 HydrophobicContact CE1-CZ 4.43Å; F23-F27 AromaticContact CE2-CD2 3.94Å; F23-F27 HydrophobicContact CE2-CD2 3.94Å; F23-F27 AromaticContact CE2-CE2 3.35Å; F23-F27 HydrophobicContact CE2-CE2 3.35Å; F23-F27 HydrophobicContact CE2-CZ 4.33Å; F23-F27 HydrophobicContact CG-CD2 4.3Å; F23-F27 AromaticContact CZ-CD2 3.68Å; F23-F27 HydrophobicContact CZ-CD2 3.68Å; F23-F27 AromaticContact CZ-CE2 3.11Å; F23-F27 HydrophobicContact CZ-CE2 3.11Å; F23-F27 AromaticContact CZ-CZ 3.84Å; F23-F27 HydrophobicContact CZ-CZ 3.84Å; F23-F27 WeakPolarHBondContact O-CD2 3.44Å; F23-F27 PolarHBondContact O-N 3.09Å; F23-F27 VanDerWaalsContact O-N 3.08Å; F23-A71 HydrophobicContact CB-CB 4.14Å; F23-L74 HydrophobicContact CD2-CB 3.72Å; F23-L74 HydrophobicContact CD2-CD1 4.26Å; F23-L74 HydrophobicContact CE2-CB 3.67Å; F23-L74 HydrophobicContact CE2-CD1 4.47Å; F23-T78 HydrophobicContact CE2-CG2 4.3Å; F23-T78 HydrophobicContact CZ-CG2 4.3Å
24Y87Confident80.8Confident161 Ų16174.4 Ų74.463%0.63139%0.39SS*.Hα-helixtrans-61.4-42.9176.2177-97.8000112.8V20 I21 F27 S28V20-Y24 WeakPolarHBondContact O-CB 3.41Å; V20-Y24 PolarHBondContact O-N 3.32Å; I21-Y24 PolarHBondContact O-N 3.38Å; Y24-F27 PolarHBondContact O-N 2.96Å; Y24-S28 WeakPolarHBondContact CE1-OG 3.44Å; Y24-S28 WeakPolarHBondContact O-CB 3.4Å; Y24-S28 PolarHBondContact O-N 2.99Å; Y24-S28 PolarHBondContact O-OG 3.45Å
25L84.6Confident79.6Confident49 Ų4975 Ų7526%0.25739%0.394SS..Hα-helixtrans-61.8-44.6177.7-71.9174.1000111.9I21 Y22 F23 F27 S28 I36I21-L25 HydrophobicContact CG2-CD1 3.92Å; I21-L25 HydrophobicContact CG2-CG 4.43Å; I21-L25 VanDerWaalsContact O-CG 3.3Å; I21-L25 WeakPolarHBondContact O-CG 3.47Å; I21-L25 PolarHBondContact O-N 3.41Å; Y22-L25 HydrophobicContact CD1-CD1 4.15Å; Y22-L25 HydrophobicContact CE1-CD1 4.38Å; Y22-L25 PolarHBondContact O-N 3.23Å; F23-L25 PolarHBondContact O-N 2.89Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 2.63Å; L25-S28 PolarHBondContact O-N 3.38Å; L25-I36 HydrophobicContact CB-CG1 4.42Å; L25-I36 HydrophobicContact CD1-CG1 4.3Å
26L84.7Confident78.3Confident34 Ų3475.9 Ų75.918%0.17840%0.399CS..Hα-helixtrans-63.1-38.5177.7-71.7166.9000112.1Y22 F23 I36 V72 Y75Y22-L26 WeakPolarHBondContact O-CB 3.32Å; Y22-L26 VanDerWaalsContact O-CG 3.23Å; Y22-L26 WeakPolarHBondContact O-CG 3.44Å; Y22-L26 PolarHBondContact O-N 2.69Å; F23-L26 PolarHBondContact O-N 3.1Å; L26-I36 HydrophobicContact CD2-CD1 3.82Å; L26-I36 HydrophobicContact CG-CD1 4.23Å; L26-V72 HydrophobicContact CD1-CG2 4.03Å; L26-Y75 HydrophobicContact CB-CD1 4.33Å; L26-Y75 HydrophobicContact CB-CD2 3.69Å; L26-Y75 HydrophobicContact CB-CE2 4.07Å; L26-Y75 HydrophobicContact CB-CG 3.82Å; L26-Y75 HydrophobicContact CD1-CD1 4.33Å; L26-Y75 HydrophobicContact CD1-CG 4.04Å; L26-Y75 HydrophobicContact CD2-CD1 4.46Å; L26-Y75 HydrophobicContact CG-CG 4.41Å; L26-Y75 WeakPolarHBondContact O-CE2 3.45Å
27F84Confident77Confident93 Ų9378.9 Ų78.941%0.40841%0.411SS..Hα-helixtrans-72-35.2177.5-97.4-89.5000114F23 Y24 L25 N29 Y75 T78F23-F27 HydrophobicContact CD1-CD2 4.04Å; F23-F27 HydrophobicContact CD1-CE2 4.31Å; F23-F27 HydrophobicContact CD2-CD2 4.24Å; F23-F27 HydrophobicContact CD2-CE2 4.06Å; F23-F27 AromaticContact CE1-CD2 3.72Å; F23-F27 HydrophobicContact CE1-CD2 3.72Å; F23-F27 AromaticContact CE1-CE2 3.64Å; F23-F27 HydrophobicContact CE1-CE2 3.64Å; F23-F27 HydrophobicContact CE1-CZ 4.43Å; F23-F27 AromaticContact CE2-CD2 3.94Å; F23-F27 HydrophobicContact CE2-CD2 3.94Å; F23-F27 AromaticContact CE2-CE2 3.35Å; F23-F27 HydrophobicContact CE2-CE2 3.35Å; F23-F27 HydrophobicContact CE2-CZ 4.33Å; F23-F27 HydrophobicContact CG-CD2 4.3Å; F23-F27 AromaticContact CZ-CD2 3.68Å; F23-F27 HydrophobicContact CZ-CD2 3.68Å; F23-F27 AromaticContact CZ-CE2 3.11Å; F23-F27 HydrophobicContact CZ-CE2 3.11Å; F23-F27 AromaticContact CZ-CZ 3.84Å; F23-F27 HydrophobicContact CZ-CZ 3.84Å; F23-F27 WeakPolarHBondContact O-CD2 3.44Å; F23-F27 PolarHBondContact O-N 3.09Å; F23-F27 VanDerWaalsContact O-N 3.08Å; Y24-F27 PolarHBondContact O-N 2.96Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 2.63Å; F27-N29 PolarHBondContact O-N 3.34Å; F27-Y75 AromaticContact CD2-CD2 3.87Å; F27-Y75 HydrophobicContact CD2-CD2 3.87Å; F27-Y75 HydrophobicContact CD2-CE2 4.47Å; F27-Y75 AromaticContact CE2-CD2 3.76Å; F27-Y75 HydrophobicContact CE2-CD2 3.76Å; F27-Y75 HydrophobicContact CZ-CD2 4.47Å; F27-T78 HydrophobicContact CE2-CG2 4.01Å; F27-T78 HydrophobicContact CZ-CG2 3.61Å; F27-T78 VanDerWaalsContact CZ-OG1 3.25Å; F27-T78 WeakPolarHBondContact CZ-OG1 3.22Å
28S83.1Confident76Confident36 Ų3683.8 Ų83.825%0.25243%0.426SS..THydrogen-bonded Turntrans-67.8-8.2-174-65.70000113.1Y24 L25 K30Y24-S28 WeakPolarHBondContact CE1-OG 3.44Å; Y24-S28 WeakPolarHBondContact O-CB 3.4Å; Y24-S28 PolarHBondContact O-N 2.99Å; Y24-S28 PolarHBondContact O-OG 3.45Å; L25-S28 PolarHBondContact O-N 3.38Å; S28-K30 WeakPolarHBondContact O-CG 3.46Å; S28-K30 PolarHBondContact O-N 3.21Å
29N71.3Confident75.1Confident140 Ų14085 Ų8575%0.74943%0.434SS*.  trans51.8-2.2-173.6-91-29000114.8F27 F31F27-N29 PolarHBondContact O-N 3.34Å; N29-F31 PolarHBondContact O-N 3.27Å
30K59Low74.2Confident158 Ų15886.2 Ų86.269%0.68744%0.443SS*.  trans-84.4104.9-175.9-77.7-180-177.5-1770107.7S28S28-K30 WeakPolarHBondContact O-CG 3.46Å; S28-K30 PolarHBondContact O-N 3.21Å
31F54.9Low73.2Confident172 Ų17285.1 Ų85.175%0.75444%0.438SS*.SBendtrans75.598.6170.8-65.3-86.9000116.1N29 S35N29-F31 PolarHBondContact O-N 3.27Å; F31-S35 PolarHBondContact O-OG 2.79Å
32L62.3Low72.6Confident147 Ų14783 Ų8377%0.7743%0.433SS*.  trans-19.9139.7155-149.575.8000113.7C34 S35L32-C34 WeakPolarHBondContact O-CA 3.34Å; L32-C34 PolarHBondContact O-N 3.07Å; L32-S35 PolarHBondContact O-N 3.45Å; L32-S35 VanDerWaalsContact O-N 3.11Å
33C60.9Low72.1Confident82 Ų8284.9 Ų84.955%0.55444%0.443SS*.THydrogen-bonded Turntrans-10.1-35.2176.3-57.30000119.7S35 I36 L37C33-S35 VanDerWaalsContact C-N 3.32Å; C33-S35 PolarHBondContact O-N 3.05Å; C33-I36 WeakPolarHBondContact O-CB 3.35Å; C33-I36 PolarHBondContact O-N 3.25Å; C33-L37 WeakPolarHBondContact O-CB 3.26Å; C33-L37 VanDerWaalsContact O-CG 3.27Å; C33-L37 WeakPolarHBondContact O-CG 3.48Å; C33-L37 PolarHBondContact O-N 3.42Å
34C60.6Low71.4Confident92 Ų9284.3 Ų84.362%0.62245%0.45SS*.Hα-helixtrans-53.4-39.4171.3-57.50000114.1L32 F38L32-C34 WeakPolarHBondContact O-CA 3.34Å; L32-C34 PolarHBondContact O-N 3.07Å; C34-F38 WeakPolarHBondContact O-CB 3.14Å; C34-F38 PolarHBondContact O-N 3.26Å
35S66.4Low70.8Confident37 Ų3780.8 Ų80.826%0.25945%0.448SS..Hα-helixtrans-68.3-42.3178.467.90000111.6F31 L32 C33 F38 S39F31-S35 PolarHBondContact O-OG 2.79Å; L32-S35 PolarHBondContact O-N 3.45Å; L32-S35 VanDerWaalsContact O-N 3.11Å; C33-S35 VanDerWaalsContact C-N 3.32Å; C33-S35 PolarHBondContact O-N 3.05Å; S35-F38 PolarHBondContact O-N 3.14Å; S35-S39 WeakPolarHBondContact O-CB 3.47Å; S35-S39 PolarHBondContact O-N 3.37Å; S35-S39 PolarHBondContact O-OG 3.38Å
36I68.2Low70.4Confident30 Ų3083.4 Ų83.415%0.15446%0.461CS..Hα-helixtrans-60.8-52.2173.7-70.9175000109.2Y22 L25 L26 C33 F38 S39 C40Y22-I36 HydrophobicContact CD1-CB 4.43Å; Y22-I36 HydrophobicContact CD1-CG1 4.19Å; Y22-I36 HydrophobicContact CD1-CG2 3.79Å; Y22-I36 HydrophobicContact CE1-CB 4.23Å; Y22-I36 HydrophobicContact CE1-CG1 4.41Å; Y22-I36 HydrophobicContact CE1-CG2 3.6Å; L25-I36 HydrophobicContact CB-CG1 4.42Å; L25-I36 HydrophobicContact CD1-CG1 4.3Å; L26-I36 HydrophobicContact CD2-CD1 3.82Å; L26-I36 HydrophobicContact CG-CD1 4.23Å; C33-I36 WeakPolarHBondContact O-CB 3.35Å; C33-I36 PolarHBondContact O-N 3.25Å; I36-F38 PolarHBondContact O-N 3.46Å; I36-S39 PolarHBondContact O-N 3.28Å; I36-S39 PolarHBondContact O-OG 2.93Å; I36-C40 PolarHBondContact O-N 2.8Å; I36-C40 PolarHBondContact O-SG 3.13Å
37L67.2Low70Confident104 Ų10482.6 Ų82.655%0.54546%0.457SS..Hα-helixtrans-59.4-44.2177.2-73.5167.4000112.1C33 C40 C41C33-L37 WeakPolarHBondContact O-CB 3.26Å; C33-L37 VanDerWaalsContact O-CG 3.27Å; C33-L37 WeakPolarHBondContact O-CG 3.48Å; C33-L37 PolarHBondContact O-N 3.42Å; L37-C40 WeakPolarHBondContact O-CB 3.31Å; L37-C40 PolarHBondContact O-N 3.05Å; L37-C41 WeakPolarHBondContact O-CB 3.41Å; L37-C41 PolarHBondContact O-N 3.44Å; L37-C41 PolarHBondContact O-SG 2.84Å
38F69.2Low69.6Low157 Ų15784.2 Ų84.269%0.68947%0.466SS*.Hα-helixtrans-62.6-44.1177-176.6-96.6000111.4C34 S35 I36 C41 A42C34-F38 WeakPolarHBondContact O-CB 3.14Å; C34-F38 PolarHBondContact O-N 3.26Å; S35-F38 PolarHBondContact O-N 3.14Å; I36-F38 PolarHBondContact O-N 3.46Å; F38-C41 PolarHBondContact O-N 3.39Å; F38-A42 VanDerWaalsContact O-CB 3.3Å; F38-A42 WeakPolarHBondContact O-CB 3.47Å; F38-A42 PolarHBondContact O-N 2.92Å
39S71.4Confident69.3Low26 Ų2692 Ų9218%0.18249%0.491CS..Hα-helixtrans-63.1-40.8174.571.20000112Y22 S35 I36 A42 I43Y22-S39 PolarHBondContact OH-OG 2.9Å; S35-S39 WeakPolarHBondContact O-CB 3.47Å; S35-S39 PolarHBondContact O-N 3.37Å; S35-S39 PolarHBondContact O-OG 3.38Å; I36-S39 PolarHBondContact O-N 3.28Å; I36-S39 PolarHBondContact O-OG 2.93Å; S39-A42 PolarHBondContact O-N 3.23Å; S39-I43 WeakPolarHBondContact O-CB 3.25Å; S39-I43 WeakPolarHBondContact O-CD1 3.41Å; S39-I43 WeakPolarHBondContact O-CG1 3.3Å; S39-I43 PolarHBondContact O-N 2.73Å
40C71.4Confident69.8Low43 Ų4390 Ų9029%0.29148%0.483SS..Hα-helixtrans-58.4-50173.8-67.20000110.8Y22 I36 L37 I43 A44Y22-C40 VanDerWaalsContact CZ-SG 3.58Å; Y22-C40 PolarHBondContact OH-N 3.17Å; Y22-C40 PolarHBondContact OH-SG 3.24Å; I36-C40 PolarHBondContact O-N 2.8Å; I36-C40 PolarHBondContact O-SG 3.13Å; L37-C40 WeakPolarHBondContact O-CB 3.31Å; L37-C40 PolarHBondContact O-N 3.05Å; C40-I43 PolarHBondContact O-N 3.19Å; C40-A44 VanDerWaalsContact O-CB 3.25Å; C40-A44 WeakPolarHBondContact O-CB 3.26Å; C40-A44 PolarHBondContact O-N 2.83Å
41C70.8Confident70.9Confident76 Ų7683.8 Ų83.851%0.51446%0.458SS..Hα-helixtrans-64.3-44.8-179.8-69.50000111.8L37 F38 A44 C45L37-C41 WeakPolarHBondContact O-CB 3.41Å; L37-C41 PolarHBondContact O-N 3.44Å; L37-C41 PolarHBondContact O-SG 2.84Å; F38-C41 PolarHBondContact O-N 3.39Å; C41-A44 PolarHBondContact O-N 2.93Å; C41-C45 WeakPolarHBondContact O-CB 3.48Å; C41-C45 PolarHBondContact O-N 3.48Å; C41-C45 PolarHBondContact O-SG 2.94Å
42A73.1Confident72.1Confident36 Ų3682.9 Ų82.930%0.29846%0.46SS..Hα-helixtrans-61.6-46.1178.300000111.1F38 S39 C45 I46F38-A42 VanDerWaalsContact O-CB 3.3Å; F38-A42 WeakPolarHBondContact O-CB 3.47Å; F38-A42 PolarHBondContact O-N 2.92Å; S39-A42 PolarHBondContact O-N 3.23Å; A42-C45 PolarHBondContact O-N 3.19Å; A42-I46 WeakPolarHBondContact O-CD1 3.44Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.28Å; A42-I46 PolarHBondContact O-N 3.3Å
43I76.9Confident73.3Confident45 Ų4578.3 Ų78.323%0.23144%0.437CS..Hα-helixtrans-65.6-42.1177.6-61.4162.7000110.5S39 C40 C45 I46 I47 M64S39-I43 WeakPolarHBondContact O-CB 3.25Å; S39-I43 WeakPolarHBondContact O-CD1 3.41Å; S39-I43 WeakPolarHBondContact O-CG1 3.3Å; S39-I43 PolarHBondContact O-N 2.73Å; C40-I43 PolarHBondContact O-N 3.19Å; I43-C45 PolarHBondContact O-N 3.39Å; I43-I46 PolarHBondContact O-N 3.21Å; I43-I47 HydrophobicContact CG2-CD1 3.57Å; I43-I47 HydrophobicContact CG2-CG1 4.19Å; I43-I47 WeakPolarHBondContact O-CB 3.22Å; I43-I47 WeakPolarHBondContact O-CD1 3.34Å; I43-I47 WeakPolarHBondContact O-CG1 3.48Å; I43-I47 PolarHBondContact O-N 3.01Å; I43-M64 HydrophobicContact CB-CE 3.97Å; I43-M64 HydrophobicContact CD1-CE 3.69Å; I43-M64 HydrophobicContact CG1-CE 4.34Å; I43-M64 HydrophobicContact CG2-CE 3.21Å; I43-M64 HydrophobicContact CG2-SD 3.41Å; I43-M64 WeakPolarHBondContact CG2-SD 3.29Å
44A72.6Confident74.6Confident53 Ų5378.8 Ų78.844%0.43843%0.434SS..Hα-helixtrans-60.1-42.2175.600000112.6C40 C41 I47 H48C40-A44 VanDerWaalsContact O-CB 3.25Å; C40-A44 WeakPolarHBondContact O-CB 3.26Å; C40-A44 PolarHBondContact O-N 2.83Å; C41-A44 PolarHBondContact O-N 2.93Å; A44-I47 PolarHBondContact O-N 3.05Å; A44-H48 WeakPolarHBondContact O-CB 3.5Å; A44-H48 PolarHBondContact O-N 2.88Å
45C74Confident76Confident86 Ų8676.5 Ų76.558%0.58142%0.419SS*.Hα-helixtrans-64.5-43.8174.9-72.30000112C41 A42 I43 I47 H48 Y49C41-C45 WeakPolarHBondContact O-CB 3.48Å; C41-C45 PolarHBondContact O-N 3.48Å; C41-C45 PolarHBondContact O-SG 2.94Å; A42-C45 PolarHBondContact O-N 3.19Å; I43-C45 PolarHBondContact O-N 3.39Å; C45-I47 VanDerWaalsContact C-N 3.34Å; C45-H48 PolarHBondContact O-N 3.35Å; C45-Y49 WeakPolarHBondContact O-CB 3.44Å; C45-Y49 PolarHBondContact O-N 2.65Å
46I76.5Confident77.1Confident105 Ų10575.9 Ų75.954%0.53841%0.413SS..Hα-helixtrans-61.8-45.4176.3-69.1164000110.1A42 I43 H48 Y49 V50A42-I46 WeakPolarHBondContact O-CD1 3.44Å; A42-I46 VanDerWaalsContact O-CG1 3.23Å; A42-I46 WeakPolarHBondContact O-CG1 3.28Å; A42-I46 PolarHBondContact O-N 3.3Å; I43-I46 PolarHBondContact O-N 3.21Å; I46-H48 VanDerWaalsContact C-N 3.34Å; I46-H48 PolarHBondContact O-N 3.36Å; I46-Y49 PolarHBondContact O-N 3.25Å; I46-V50 HydrophobicContact CG2-CG2 4.09Å; I46-V50 VanDerWaalsContact O-CB 3.29Å; I46-V50 WeakPolarHBondContact O-CB 3.27Å; I46-V50 VanDerWaalsContact O-CG2 3.22Å; I46-V50 WeakPolarHBondContact O-CG2 3.22Å; I46-V50 PolarHBondContact O-N 2.91Å
47I76.7Confident78.2Confident17 Ų1777.2 Ų77.29%0.08742%0.416CS..Hα-helixtrans-58.1-47.6175.8-74.5160.1000110.9I43 A44 C45 Y49 V50 I51 R57 V60 M64I43-I47 HydrophobicContact CG2-CD1 3.57Å; I43-I47 HydrophobicContact CG2-CG1 4.19Å; I43-I47 WeakPolarHBondContact O-CB 3.22Å; I43-I47 WeakPolarHBondContact O-CD1 3.34Å; I43-I47 WeakPolarHBondContact O-CG1 3.48Å; I43-I47 PolarHBondContact O-N 3.01Å; A44-I47 PolarHBondContact O-N 3.05Å; C45-I47 VanDerWaalsContact C-N 3.34Å; I47-Y49 VanDerWaalsContact C-N 3.32Å; I47-Y49 PolarHBondContact O-N 3.4Å; I47-V50 PolarHBondContact O-N 3.26Å; I47-I51 HydrophobicContact CG2-CD1 4.12Å; I47-I51 WeakPolarHBondContact O-CB 3.43Å; I47-I51 PolarHBondContact O-N 2.89Å; I47-R57 HydrophobicContact CG2-CG 3.73Å; I47-V60 HydrophobicContact CD1-CG1 3.45Å; I47-V60 VanDerWaalsContact CD1-CG1 3.45Å; I47-V60 HydrophobicContact CG1-CG1 3.73Å; I47-V60 HydrophobicContact CG2-CG1 4.17Å; I47-M64 HydrophobicContact CD1-SD 3.47Å; I47-M64 WeakPolarHBondContact CD1-SD 3.42Å
48H76.3Confident79.3Confident127 Ų12776.8 Ų76.859%0.58841%0.411SS*.Hα-helixtrans-61.8-40.9179.5-176.671.6000112.3A44 C45 I46A44-H48 WeakPolarHBondContact O-CB 3.5Å; A44-H48 PolarHBondContact O-N 2.88Å; C45-H48 PolarHBondContact O-N 3.35Å; I46-H48 VanDerWaalsContact C-N 3.34Å; I46-H48 PolarHBondContact O-N 3.36Å
49Y76.9Confident80.4Confident198 Ų19869.4 Ų69.478%0.77638%0.379SS*.Hα-helixtrans-74.3-36.7-179.1-175.7-101.1000113.4C45 I46 I47C45-Y49 WeakPolarHBondContact O-CB 3.44Å; C45-Y49 PolarHBondContact O-N 2.65Å; I46-Y49 PolarHBondContact O-N 3.25Å; I47-Y49 VanDerWaalsContact C-N 3.32Å; I47-Y49 PolarHBondContact O-N 3.4Å
50V80.7Confident81.4Confident98 Ų9868.6 Ų68.659%0.59437%0.373SS*.Hα-helixtrans-88.5-32.1-173175.30000112.4I46 I47I46-V50 HydrophobicContact CG2-CG2 4.09Å; I46-V50 VanDerWaalsContact O-CB 3.29Å; I46-V50 WeakPolarHBondContact O-CB 3.27Å; I46-V50 VanDerWaalsContact O-CG2 3.22Å; I46-V50 WeakPolarHBondContact O-CG2 3.22Å; I46-V50 PolarHBondContact O-N 2.91Å; I47-V50 PolarHBondContact O-N 3.26Å
51I81.4Confident82.3Confident29 Ų2969 Ų6915%0.14938%0.379CS..  trans-100.499.8-172.4-55.5-176.1000111.1I47 D53 L56 R57 V60I47-I51 HydrophobicContact CG2-CD1 4.12Å; I47-I51 WeakPolarHBondContact O-CB 3.43Å; I47-I51 PolarHBondContact O-N 2.89Å; I51-D53 VanDerWaalsContact C-N 3.27Å; I51-D53 HydrophobicContact CG2-CB 4.37Å; I51-D53 WeakPolarHBondContact CG2-O 3.2Å; I51-D53 PolarHBondContact O-N 3.05Å; I51-L56 HydrophobicContact CD1-CD2 4.48Å; I51-L56 HydrophobicContact CD1-CG 4.38Å; I51-L56 HydrophobicContact CG2-CB 3.89Å; I51-L56 HydrophobicContact CG2-CD2 3.94Å; I51-L56 HydrophobicContact CG2-CG 4Å; I51-R57 HydrophobicContact CB-CB 4.34Å; I51-R57 HydrophobicContact CG2-CB 4Å; I51-R57 PolarHBondContact O-NH1 2.89Å; I51-V60 HydrophobicContact CD1-CB 4.34Å; I51-V60 HydrophobicContact CD1-CG2 3.9Å
52N81.9Confident83.4Confident152 Ų15267 Ų6781%0.81337%0.365SS*.  trans-69.3-21.7174.1-71.4-21.9000113.7D54N52-D54 PolarHBondContact O-N 3.45Å
53D86.8Confident84.4Confident51 Ų5165.2 Ų65.227%0.27335%0.351SS..  trans-85.8111179.3-174.9-32.9000110.8R6 I51 S55 L56 R57R6-D53 IonicContact CZ-OD2 3Å; R6-D53 IonicContact NH1-OD2 2.63Å; R6-D53 IonicContact NH2-OD2 3.69Å; R6-D53 PolarHBondContact NH2-OD2 3.23Å; I51-D53 VanDerWaalsContact C-N 3.27Å; I51-D53 HydrophobicContact CG2-CB 4.37Å; I51-D53 WeakPolarHBondContact CG2-O 3.2Å; I51-D53 PolarHBondContact O-N 3.05Å; D53-S55 VanDerWaalsContact C-N 3.28Å; D53-S55 PolarHBondContact O-N 3.33Å; D53-S55 WeakPolarHBondContact OD1-CB 3.23Å; D53-S55 PolarHBondContact OD1-N 2.86Å; D53-S55 PolarHBondContact OD1-OG 2.89Å; D53-L56 HydrophobicContact CB-CB 3.93Å; D53-L56 PolarHBondContact O-N 2.64Å; D53-L56 PolarHBondContact OD1-N 2.97Å; D53-R57 WeakPolarHBondContact O-CB 3.29Å; D53-R57 PolarHBondContact O-N 2.89Å
54D88Confident85.2Confident92 Ų9264.3 Ų64.349%0.49235%0.346SS..Hα-helixtrans-56.8-39-178.9-68.9-7000113.5N52 R57 Q58N52-D54 PolarHBondContact O-N 3.45Å; D54-R57 VanDerWaalsContact CG-NH2 3.26Å; D54-R57 PolarHBondContact O-N 2.94Å; D54-R57 IonicContact OD1-CZ 2.92Å; D54-R57 IonicContact OD1-NH1 3.91Å; D54-R57 PolarHBondContact OD1-NH1 3.44Å; D54-R57 IonicContact OD1-NH2 2.92Å; D54-R57 PolarHBondContact OD1-NH2 2.99Å; D54-R57 IonicContact OD2-NH2 2.83Å; D54-Q58 WeakPolarHBondContact O-CG 3.16Å; D54-Q58 PolarHBondContact O-N 3.46Å; D54-Q58 VanDerWaalsContact O-N 3.1Å
55S89.5Confident86.2Confident45 Ų4567.1 Ų67.132%0.31535%0.353SS..Hα-helixtrans-67.2-47.2179.368.90000110.4H7 D53 R57 Q58 V59H7-S55 PolarHBondContact NE2-OG 3.15Å; D53-S55 VanDerWaalsContact C-N 3.28Å; D53-S55 PolarHBondContact O-N 3.33Å; D53-S55 WeakPolarHBondContact OD1-CB 3.23Å; D53-S55 PolarHBondContact OD1-N 2.86Å; D53-S55 PolarHBondContact OD1-OG 2.89Å; S55-R57 VanDerWaalsContact C-N 3.29Å; S55-R57 PolarHBondContact O-N 3.03Å; S55-Q58 PolarHBondContact O-N 2.79Å; S55-V59 WeakPolarHBondContact O-CG2 3.4Å; S55-V59 PolarHBondContact O-N 2.58Å
56L90.4Very high87.2Confident23 Ų2363.4 Ų63.412%0.1233%0.328CS..Hα-helixtrans-63.2-39.1178.1-175.162.6000111.4H7 A10 I51 D53 Q58 V59 V60H7-L56 WeakPolarHBondContact NE2-CA 3.34Å; H7-L56 PolarHBondContact NE2-N 3.33Å; A10-L56 HydrophobicContact CB-CD1 3.73Å; I51-L56 HydrophobicContact CD1-CD2 4.48Å; I51-L56 HydrophobicContact CD1-CG 4.38Å; I51-L56 HydrophobicContact CG2-CB 3.89Å; I51-L56 HydrophobicContact CG2-CD2 3.94Å; I51-L56 HydrophobicContact CG2-CG 4Å; D53-L56 HydrophobicContact CB-CB 3.93Å; D53-L56 PolarHBondContact O-N 2.64Å; D53-L56 PolarHBondContact OD1-N 2.97Å; L56-Q58 PolarHBondContact O-N 3.44Å; L56-V59 PolarHBondContact O-N 3.21Å; L56-V60 HydrophobicContact CD1-CG2 4.37Å; L56-V60 HydrophobicContact CG-CG2 4.42Å; L56-V60 WeakPolarHBondContact O-CG2 3.39Å; L56-V60 PolarHBondContact O-N 3.2Å
57R89.8Confident88.1Confident58 Ų5858.4 Ų58.422%0.21930%0.302CS..Hα-helixtrans-60.3-45.1177.9-171.8170.961.7-110.60.1111.7I47 I51 D53 D54 S55 A61I47-R57 HydrophobicContact CG2-CG 3.73Å; I51-R57 HydrophobicContact CB-CB 4.34Å; I51-R57 HydrophobicContact CG2-CB 4Å; I51-R57 PolarHBondContact O-NH1 2.89Å; D53-R57 WeakPolarHBondContact O-CB 3.29Å; D53-R57 PolarHBondContact O-N 2.89Å; D54-R57 VanDerWaalsContact CG-NH2 3.26Å; D54-R57 PolarHBondContact O-N 2.94Å; D54-R57 IonicContact OD1-CZ 2.92Å; D54-R57 IonicContact OD1-NH1 3.91Å; D54-R57 PolarHBondContact OD1-NH1 3.44Å; D54-R57 IonicContact OD1-NH2 2.92Å; D54-R57 PolarHBondContact OD1-NH2 2.99Å; D54-R57 IonicContact OD2-NH2 2.83Å; S55-R57 VanDerWaalsContact C-N 3.29Å; S55-R57 PolarHBondContact O-N 3.03Å; R57-A61 WeakPolarHBondContact O-CB 3.37Å; R57-A61 PolarHBondContact O-N 2.88Å
58Q90.8Very high88.9Confident96 Ų9658.6 Ų58.645%0.44930%0.304SS..Hα-helixtrans-63-45.8175-71.1178.135.700111.6D54 S55 L56 V60 A61 C62 T116D54-Q58 WeakPolarHBondContact O-CG 3.16Å; D54-Q58 PolarHBondContact O-N 3.46Å; D54-Q58 VanDerWaalsContact O-N 3.1Å; S55-Q58 PolarHBondContact O-N 2.79Å; L56-Q58 PolarHBondContact O-N 3.44Å; Q58-V60 VanDerWaalsContact C-N 3.34Å; Q58-V60 PolarHBondContact O-N 3.24Å; Q58-A61 PolarHBondContact O-N 2.88Å; Q58-C62 WeakPolarHBondContact O-CB 3.49Å; Q58-C62 PolarHBondContact O-N 3.3Å; Q58-C62 PolarHBondContact O-SG 3.23Å; Q58-C62 VanDerWaalsContact O-SG 3.36Å; Q58-T116 HydrophobicContact CB-CG2 3.74Å; Q58-T116 PolarHBondContact OE1-OG1 3.12Å
59V93.4Very high89.8Confident1 Ų154.8 Ų54.81%0.00629%0.29CS..Hα-helixtrans-59.4-45179.41720000111.8H7 S55 L56 S63 F103 T116 F119H7-V59 HydrophobicContact CB-CG1 4.45Å; H7-V59 VanDerWaalsContact CD2-CG2 3.49Å; H7-V59 WeakPolarHBondContact CD2-CG2 3.44Å; S55-V59 WeakPolarHBondContact O-CG2 3.4Å; S55-V59 PolarHBondContact O-N 2.58Å; L56-V59 PolarHBondContact O-N 3.21Å; V59-S63 VanDerWaalsContact O-CB 3.28Å; V59-S63 WeakPolarHBondContact O-CB 3.33Å; V59-S63 PolarHBondContact O-N 2.9Å; V59-S63 PolarHBondContact O-OG 3.43Å; V59-F103 HydrophobicContact CB-CZ 4.14Å; V59-F103 HydrophobicContact CG1-CD1 4.36Å; V59-F103 HydrophobicContact CG1-CE1 3.49Å; V59-F103 VanDerWaalsContact CG1-CE1 3.49Å; V59-F103 HydrophobicContact CG1-CE2 4.47Å; V59-F103 HydrophobicContact CG1-CZ 3.58Å; V59-F103 HydrophobicContact CG2-CE1 4.19Å; V59-F103 HydrophobicContact CG2-CE2 3.72Å; V59-F103 HydrophobicContact CG2-CZ 3.38Å; V59-T116 HydrophobicContact CG2-CG2 4.05Å; V59-F119 HydrophobicContact CB-CE2 4.26Å; V59-F119 HydrophobicContact CG1-CE2 4.13Å; V59-F119 HydrophobicContact CG1-CZ 4.13Å; V59-F119 HydrophobicContact CG2-CE2 4.11Å
60V91.6Very high90.7Very high9 Ų948.1 Ų48.16%0.05526%0.264CS..Hα-helixtrans-62.6-49.6176.9169.80000110.6A10 C14 I47 I51 L56 Q58 C62 S63 M64A10-V60 HydrophobicContact CB-CG2 4.22Å; C14-V60 HydrophobicContact CB-CG1 4.48Å; I47-V60 HydrophobicContact CD1-CG1 3.45Å; I47-V60 VanDerWaalsContact CD1-CG1 3.45Å; I47-V60 HydrophobicContact CG1-CG1 3.73Å; I47-V60 HydrophobicContact CG2-CG1 4.17Å; I51-V60 HydrophobicContact CD1-CB 4.34Å; I51-V60 HydrophobicContact CD1-CG2 3.9Å; L56-V60 HydrophobicContact CD1-CG2 4.37Å; L56-V60 HydrophobicContact CG-CG2 4.42Å; L56-V60 WeakPolarHBondContact O-CG2 3.39Å; L56-V60 PolarHBondContact O-N 3.2Å; Q58-V60 VanDerWaalsContact C-N 3.34Å; Q58-V60 PolarHBondContact O-N 3.24Å; V60-C62 PolarHBondContact O-N 3.3Å; V60-S63 PolarHBondContact O-N 2.98Å; V60-M64 HydrophobicContact CG1-CG 4.46Å; V60-M64 HydrophobicContact CG1-SD 4.25Å; V60-M64 WeakPolarHBondContact O-CB 3.33Å; V60-M64 VanDerWaalsContact O-CG 3.31Å; V60-M64 WeakPolarHBondContact O-CG 3.22Å; V60-M64 PolarHBondContact O-N 3.24Å
61A90.8Very high91.4Very high51 Ų5143.4 Ų43.442%0.42124%0.235SC..Hα-helixtrans-60.1-47.5-179.600000112.5R57 Q58 M64 L65R57-A61 WeakPolarHBondContact O-CB 3.37Å; R57-A61 PolarHBondContact O-N 2.88Å; Q58-A61 PolarHBondContact O-N 2.88Å; A61-M64 PolarHBondContact O-N 2.83Å; A61-L65 WeakPolarHBondContact O-CB 3.47Å; A61-L65 PolarHBondContact O-N 2.65Å
62C93.4Very high91.9Very high34 Ų3444.4 Ų44.423%0.2324%0.243CC..Hα-helixtrans-60.9-46.5176.4-70.70000111.7Q58 V60 M64 L65 L66 F119 L121Q58-C62 WeakPolarHBondContact O-CB 3.49Å; Q58-C62 PolarHBondContact O-N 3.3Å; Q58-C62 PolarHBondContact O-SG 3.23Å; Q58-C62 VanDerWaalsContact O-SG 3.36Å; V60-C62 PolarHBondContact O-N 3.3Å; C62-M64 VanDerWaalsContact C-N 3.33Å; C62-M64 PolarHBondContact O-N 2.73Å; C62-L65 PolarHBondContact O-N 3.26Å; C62-L66 WeakPolarHBondContact O-CB 3.45Å; C62-L66 VanDerWaalsContact O-CG 3.24Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.07Å; C62-F119 HydrophobicContact CB-CD1 4.25Å; C62-F119 HydrophobicContact CB-CD2 4.03Å; C62-F119 HydrophobicContact CB-CE1 4.11Å; C62-F119 HydrophobicContact CB-CE2 3.89Å; C62-F119 HydrophobicContact CB-CG 4.22Å; C62-F119 HydrophobicContact CB-CZ 3.94Å; C62-L121 HydrophobicContact CB-CD1 4.01Å
63S95.2Very high92.6Very high0 Ų037.2 Ų37.20%020%0.204CC..Hα-helixtrans-62.6-40.7-179.7-56.90000112S11 F15 V59 V60 G67 F119S11-S63 VanDerWaalsContact CA-OG 3.23Å; S11-S63 WeakPolarHBondContact CA-OG 3.28Å; S11-S63 WeakPolarHBondContact CB-OG 3.47Å; S11-S63 WeakPolarHBondContact O-CB 3.34Å; F15-S63 WeakPolarHBondContact CA-O 3.48Å; V59-S63 VanDerWaalsContact O-CB 3.28Å; V59-S63 WeakPolarHBondContact O-CB 3.33Å; V59-S63 PolarHBondContact O-N 2.9Å; V59-S63 PolarHBondContact O-OG 3.43Å; V60-S63 PolarHBondContact O-N 2.98Å; S63-G67 PolarHBondContact O-N 2.9Å; S63-F119 WeakPolarHBondContact OG-CZ 3.23Å
64M92.4Very high92.9Very high26 Ų2637.3 Ų37.313%0.12821%0.205CC..Hα-helixtrans-66.6-44176.6-74.8-164.96800112.8C14 S18 I43 I47 V60 A61 C62 L66 G67 C68C14-M64 HydrophobicContact CB-CG 3.76Å; S18-M64 PolarHBondContact OG-O 2.98Å; I43-M64 HydrophobicContact CB-CE 3.97Å; I43-M64 HydrophobicContact CD1-CE 3.69Å; I43-M64 HydrophobicContact CG1-CE 4.34Å; I43-M64 HydrophobicContact CG2-CE 3.21Å; I43-M64 HydrophobicContact CG2-SD 3.41Å; I43-M64 WeakPolarHBondContact CG2-SD 3.29Å; I47-M64 HydrophobicContact CD1-SD 3.47Å; I47-M64 WeakPolarHBondContact CD1-SD 3.42Å; V60-M64 HydrophobicContact CG1-CG 4.46Å; V60-M64 HydrophobicContact CG1-SD 4.25Å; V60-M64 WeakPolarHBondContact O-CB 3.33Å; V60-M64 VanDerWaalsContact O-CG 3.31Å; V60-M64 WeakPolarHBondContact O-CG 3.22Å; V60-M64 PolarHBondContact O-N 3.24Å; A61-M64 PolarHBondContact O-N 2.83Å; C62-M64 VanDerWaalsContact C-N 3.33Å; C62-M64 PolarHBondContact O-N 2.73Å; M64-L66 VanDerWaalsContact C-N 3.34Å; M64-G67 PolarHBondContact O-N 3.04Å; M64-C68 PolarHBondContact O-N 2.86Å
65L92.9Very high93.1Very high111 Ų11135.1 Ų35.158%0.58119%0.19SC*.Hα-helixtrans-60.2-46.9176.5179.663.3000110.7A61 C62 G67 C68 V69A61-L65 WeakPolarHBondContact O-CB 3.47Å; A61-L65 PolarHBondContact O-N 2.65Å; C62-L65 PolarHBondContact O-N 3.26Å; L65-G67 VanDerWaalsContact C-N 3.34Å; L65-G67 PolarHBondContact O-N 3.49Å; L65-C68 WeakPolarHBondContact O-CB 3.34Å; L65-C68 PolarHBondContact O-N 3.29Å; L65-V69 WeakPolarHBondContact O-CG2 3.08Å; L65-V69 PolarHBondContact O-N 3.38Å
66L96.1Very high93.2Very high9 Ų935.5 Ų35.55%0.04719%0.188CC..Hα-helixtrans-61.3-42176.5-70.3170.1000111.8F15 C62 M64 C68 V69 Y70 S96 H99 F100 F119 L121F15-L66 HydrophobicContact CD2-CB 3.96Å; F15-L66 HydrophobicContact CE2-CB 4Å; C62-L66 WeakPolarHBondContact O-CB 3.45Å; C62-L66 VanDerWaalsContact O-CG 3.24Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.07Å; M64-L66 VanDerWaalsContact C-N 3.34Å; L66-C68 VanDerWaalsContact C-N 3.31Å; L66-C68 PolarHBondContact O-N 2.71Å; L66-V69 PolarHBondContact O-N 3.11Å; L66-Y70 WeakPolarHBondContact O-CB 3.23Å; L66-Y70 PolarHBondContact O-N 2.92Å; L66-S96 WeakPolarHBondContact O-CB 3.27Å; L66-H99 HydrophobicContact CD1-CB 3.86Å; L66-H99 HydrophobicContact CD2-CB 3.8Å; L66-F100 HydrophobicContact CB-CB 4.49Å; L66-F100 HydrophobicContact CD1-CB 4.04Å; L66-F119 HydrophobicContact CD1-CD1 3.58Å; L66-F119 HydrophobicContact CD1-CE1 3.79Å; L66-L121 HydrophobicContact CD1-CD1 4.38Å; L66-L121 HydrophobicContact CD2-CD2 4.32Å
67G96.2Very high93.3Very high0 Ų036.2 Ų36.20%019%0.194CC..Hα-helixtrans-61.6-3717500000113.1C19 S63 M64 L65 Y70 A71C19-G67 WeakPolarHBondContact CA-O 3.29Å; S63-G67 PolarHBondContact O-N 2.9Å; M64-G67 PolarHBondContact O-N 3.04Å; L65-G67 VanDerWaalsContact C-N 3.34Å; L65-G67 PolarHBondContact O-N 3.49Å; G67-Y70 PolarHBondContact O-N 3.34Å; G67-A71 WeakPolarHBondContact O-CB 3.35Å; G67-A71 PolarHBondContact O-N 2.8Å
68C92.6Very high93.3Very high20 Ų2036.7 Ų36.714%0.13520%0.204CC..Hα-helixtrans-66.7-46174.8-179.10000111.5S18 Y22 M64 L65 L66 Y70 A71 V72S18-C68 PolarHBondContact OG-N 3.01Å; Y22-C68 HydrophobicContact CD2-CB 3.62Å; Y22-C68 HydrophobicContact CE2-CB 3.88Å; Y22-C68 HydrophobicContact CG-CB 4.19Å; M64-C68 PolarHBondContact O-N 2.86Å; L65-C68 WeakPolarHBondContact O-CB 3.34Å; L65-C68 PolarHBondContact O-N 3.29Å; L66-C68 VanDerWaalsContact C-N 3.31Å; L66-C68 PolarHBondContact O-N 2.71Å; C68-Y70 VanDerWaalsContact C-N 3.3Å; C68-Y70 PolarHBondContact O-N 2.81Å; C68-A71 WeakPolarHBondContact O-CB 3.39Å; C68-A71 PolarHBondContact O-N 3.45Å; C68-V72 WeakPolarHBondContact O-CG2 3.46Å; C68-V72 PolarHBondContact O-N 3.43Å
69V95Very high93Very high47 Ų4737.9 Ų37.929%0.28521%0.207SC..Hα-helixtrans-60.5-41.5175.4176.30000111.1L65 L66 V72 G73 L92L65-V69 WeakPolarHBondContact O-CG2 3.08Å; L65-V69 PolarHBondContact O-N 3.38Å; L66-V69 PolarHBondContact O-N 3.11Å; V69-V72 PolarHBondContact O-N 3.36Å; V69-G73 PolarHBondContact O-N 3.23Å; V69-L92 HydrophobicContact CG1-CB 4.27Å; V69-L92 HydrophobicContact CG1-CD2 4.1Å
70Y96.9Very high92.2Very high58 Ų5838.9 Ų38.923%0.22722%0.218CC..Hα-helixtrans-61.7-44.1175.9-166.7-91000111.7F15 L66 G67 C68 V72 G73 L74 C93 S96 F97F15-Y70 HydrophobicContact CZ-CD1 4.41Å; F15-Y70 AromaticContact CZ-CD2 3.99Å; F15-Y70 HydrophobicContact CZ-CD2 3.99Å; F15-Y70 AromaticContact CZ-CG 3.84Å; F15-Y70 HydrophobicContact CZ-CG 3.84Å; L66-Y70 WeakPolarHBondContact O-CB 3.23Å; L66-Y70 PolarHBondContact O-N 2.92Å; G67-Y70 PolarHBondContact O-N 3.34Å; C68-Y70 VanDerWaalsContact C-N 3.3Å; C68-Y70 PolarHBondContact O-N 2.81Å; Y70-V72 PolarHBondContact O-N 3.49Å; Y70-G73 WeakPolarHBondContact O-CA 3.43Å; Y70-G73 PolarHBondContact O-N 2.94Å; Y70-G73 VanDerWaalsContact O-N 3.17Å; Y70-L74 HydrophobicContact CD1-CD1 3.8Å; Y70-L74 HydrophobicContact CD1-CG 3.91Å; Y70-L74 HydrophobicContact CE1-CD1 3.55Å; Y70-L74 HydrophobicContact CE1-CD2 4Å; Y70-L74 HydrophobicContact CE1-CG 3.68Å; Y70-L74 PolarHBondContact O-N 3.41Å; Y70-C93 HydrophobicContact CD2-CB 4.04Å; Y70-C93 VanDerWaalsContact CD2-O 3.22Å; Y70-C93 WeakPolarHBondContact CD2-O 3.21Å; Y70-C93 HydrophobicContact CE2-CB 3.73Å; Y70-C93 WeakPolarHBondContact CE2-O 3.39Å; Y70-S96 VanDerWaalsContact CA-OG 3.3Å; Y70-S96 WeakPolarHBondContact CA-OG 3.36Å; Y70-S96 VanDerWaalsContact CB-OG 3.31Å; Y70-S96 WeakPolarHBondContact CB-OG 3.46Å; Y70-S96 WeakPolarHBondContact CD2-OG 3.43Å; Y70-S96 PolarHBondContact N-OG 3.45Å; Y70-F97 HydrophobicContact CD2-CB 4.08Å; Y70-F97 HydrophobicContact CE2-CB 3.87Å; Y70-F97 HydrophobicContact CE2-CD2 4.41Å
71A94Very high91.3Very high0 Ų046.3 Ų46.30%025%0.25CC..Hα-helixtrans-61.5-42.1176.300000113C19 F23 G67 C68 G73 L74 Y75C19-A71 WeakPolarHBondContact O-CB 3.35Å; F23-A71 HydrophobicContact CB-CB 4.14Å; G67-A71 WeakPolarHBondContact O-CB 3.35Å; G67-A71 PolarHBondContact O-N 2.8Å; C68-A71 WeakPolarHBondContact O-CB 3.39Å; C68-A71 PolarHBondContact O-N 3.45Å; A71-G73 VanDerWaalsContact C-N 3.32Å; A71-L74 PolarHBondContact O-N 3Å; A71-Y75 WeakPolarHBondContact O-CB 3.33Å; A71-Y75 PolarHBondContact O-N 3.07Å
72V92.9Very high89.9Confident50 Ų5055.5 Ų55.530%0.30327%0.274SS..Hα-helixtrans-60.6-44.5173.1173.30000110.2L26 C68 V69 Y70 L74 Y75 L76 L92L26-V72 HydrophobicContact CD1-CG2 4.03Å; C68-V72 WeakPolarHBondContact O-CG2 3.46Å; C68-V72 PolarHBondContact O-N 3.43Å; V69-V72 PolarHBondContact O-N 3.36Å; Y70-V72 PolarHBondContact O-N 3.49Å; V72-L74 PolarHBondContact O-N 3.45Å; V72-Y75 PolarHBondContact O-N 2.49Å; V72-L76 HydrophobicContact CG1-CD1 4.21Å; V72-L76 HydrophobicContact CG1-CG 4.45Å; V72-L76 WeakPolarHBondContact O-CG 3.45Å; V72-L76 PolarHBondContact O-N 3.1Å; V72-L92 HydrophobicContact CG1-CD1 3.98Å
73G95.2Very high88.8Confident0 Ų064.7 Ų64.70%030%0.303CS..Hα-helixtrans-57.3-47.9175.100000112.9V69 Y70 A71 L76 C77 G89V69-G73 PolarHBondContact O-N 3.23Å; Y70-G73 WeakPolarHBondContact O-CA 3.43Å; Y70-G73 PolarHBondContact O-N 2.94Å; Y70-G73 VanDerWaalsContact O-N 3.17Å; A71-G73 VanDerWaalsContact C-N 3.32Å; G73-L76 PolarHBondContact O-N 3.25Å; G73-C77 PolarHBondContact O-N 2.94Å; G73-C77 PolarHBondContact O-SG 2.98Å; G73-G89 CarbonylContact C-O 3.51Å; G73-G89 VanDerWaalsContact CA-O 3.27Å; G73-G89 WeakPolarHBondContact CA-O 3.45Å; G73-G89 CarbonylContact O-C 3.59Å; G73-G89 VanDerWaalsContact O-CA 3.29Å; G73-G89 WeakPolarHBondContact O-CA 3Å
74L94.4Very high88Confident54 Ų5468.8 Ų68.828%0.28332%0.323SS..Hα-helixtrans-62.2-45.8177.6-75.1-178.1000111.5F23 Y70 A71 V72 L76 C77 T78 C93F23-L74 HydrophobicContact CD2-CB 3.72Å; F23-L74 HydrophobicContact CD2-CD1 4.26Å; F23-L74 HydrophobicContact CE2-CB 3.67Å; F23-L74 HydrophobicContact CE2-CD1 4.47Å; Y70-L74 HydrophobicContact CD1-CD1 3.8Å; Y70-L74 HydrophobicContact CD1-CG 3.91Å; Y70-L74 HydrophobicContact CE1-CD1 3.55Å; Y70-L74 HydrophobicContact CE1-CD2 4Å; Y70-L74 HydrophobicContact CE1-CG 3.68Å; Y70-L74 PolarHBondContact O-N 3.41Å; A71-L74 PolarHBondContact O-N 3Å; V72-L74 PolarHBondContact O-N 3.45Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.43Å; L74-C77 WeakPolarHBondContact O-CB 3.45Å; L74-C77 PolarHBondContact O-N 3.48Å; L74-C77 VanDerWaalsContact O-N 3.12Å; L74-T78 VanDerWaalsContact O-CG2 3.32Å; L74-T78 WeakPolarHBondContact O-CG2 3.43Å; L74-T78 PolarHBondContact O-N 3.36Å; L74-T78 VanDerWaalsContact O-N 3.12Å; L74-C93 PolarHBondContact N-SG 3.39Å
75Y92Very high87.5Confident46 Ų4668.6 Ų68.618%0.1832%0.323CS..Hα-helixtrans-58.1-46.4176.7173.2-104000111L26 F27 A71 V72 C77 T78 K79L26-Y75 HydrophobicContact CB-CD1 4.33Å; L26-Y75 HydrophobicContact CB-CD2 3.69Å; L26-Y75 HydrophobicContact CB-CE2 4.07Å; L26-Y75 HydrophobicContact CB-CG 3.82Å; L26-Y75 HydrophobicContact CD1-CD1 4.33Å; L26-Y75 HydrophobicContact CD1-CG 4.04Å; L26-Y75 HydrophobicContact CD2-CD1 4.46Å; L26-Y75 HydrophobicContact CG-CG 4.41Å; L26-Y75 WeakPolarHBondContact O-CE2 3.45Å; F27-Y75 AromaticContact CD2-CD2 3.87Å; F27-Y75 HydrophobicContact CD2-CD2 3.87Å; F27-Y75 HydrophobicContact CD2-CE2 4.47Å; F27-Y75 AromaticContact CE2-CD2 3.76Å; F27-Y75 HydrophobicContact CE2-CD2 3.76Å; F27-Y75 HydrophobicContact CZ-CD2 4.47Å; A71-Y75 WeakPolarHBondContact O-CB 3.33Å; A71-Y75 PolarHBondContact O-N 3.07Å; V72-Y75 PolarHBondContact O-N 2.49Å; Y75-C77 VanDerWaalsContact C-N 3.29Å; Y75-C77 PolarHBondContact O-N 3.49Å; Y75-T78 PolarHBondContact O-N 2.98Å; Y75-T78 VanDerWaalsContact O-N 3.07Å; Y75-T78 PolarHBondContact O-OG1 3.33Å; Y75-K79 HydrophobicContact CE1-CG 4.5Å; Y75-K79 VanDerWaalsContact CE2-CE 3.42Å; Y75-K79 PolarHBondContact O-N 2.85Å; Y75-K79 WeakPolarHBondContact OH-CE 3.44Å; Y75-K79 PolarHBondContact OH-NZ 3.06Å
76L91.9Very high87.2Confident53 Ų5364.7 Ų64.728%0.27731%0.306SS..Hα-helixtrans-62.7-34.7175.8-69.9178.2000112.7V72 G73 L74 T78 K79 G80 S86 V88 L92V72-L76 HydrophobicContact CG1-CD1 4.21Å; V72-L76 HydrophobicContact CG1-CG 4.45Å; V72-L76 WeakPolarHBondContact O-CG 3.45Å; V72-L76 PolarHBondContact O-N 3.1Å; G73-L76 PolarHBondContact O-N 3.25Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.43Å; L76-T78 VanDerWaalsContact C-N 3.27Å; L76-T78 PolarHBondContact O-N 3.12Å; L76-K79 PolarHBondContact O-N 2.52Å; L76-G80 PolarHBondContact O-N 2.92Å; L76-S86 VanDerWaalsContact O-CB 3.29Å; L76-S86 WeakPolarHBondContact O-CB 3.31Å; L76-V88 HydrophobicContact CD1-CG1 4.07Å; L76-L92 HydrophobicContact CD1-CD1 3.98Å
77C92.5Very high87.1Confident37 Ų3764.7 Ų64.725%0.2531%0.306CS..Hα-helixtrans-61.4-36.5173.2-67.70000112G73 L74 Y75 K79 G80 L90G73-C77 PolarHBondContact O-N 2.94Å; G73-C77 PolarHBondContact O-SG 2.98Å; L74-C77 WeakPolarHBondContact O-CB 3.45Å; L74-C77 PolarHBondContact O-N 3.48Å; L74-C77 VanDerWaalsContact O-N 3.12Å; Y75-C77 VanDerWaalsContact C-N 3.29Å; Y75-C77 PolarHBondContact O-N 3.49Å; C77-K79 VanDerWaalsContact C-N 3.26Å; C77-K79 PolarHBondContact O-N 3.3Å; C77-G80 PolarHBondContact O-N 3.39Å; C77-G80 VanDerWaalsContact O-N 3.11Å; C77-L90 PolarHBondContact SG-N 3.04Å; C77-L90 VanDerWaalsContact SG-N 3.43Å
78T89Confident87Confident68 Ų6866.6 Ų66.642%0.41732%0.318SS..Hα-helixtrans-71.4-19177.472.20000114.2F23 F27 L74 Y75 L76F23-T78 HydrophobicContact CE2-CG2 4.3Å; F23-T78 HydrophobicContact CZ-CG2 4.3Å; F27-T78 HydrophobicContact CE2-CG2 4.01Å; F27-T78 HydrophobicContact CZ-CG2 3.61Å; F27-T78 VanDerWaalsContact CZ-OG1 3.25Å; F27-T78 WeakPolarHBondContact CZ-OG1 3.22Å; L74-T78 VanDerWaalsContact O-CG2 3.32Å; L74-T78 WeakPolarHBondContact O-CG2 3.43Å; L74-T78 PolarHBondContact O-N 3.36Å; L74-T78 VanDerWaalsContact O-N 3.12Å; Y75-T78 PolarHBondContact O-N 2.98Å; Y75-T78 VanDerWaalsContact O-N 3.07Å; Y75-T78 PolarHBondContact O-OG1 3.33Å; L76-T78 VanDerWaalsContact C-N 3.27Å; L76-T78 PolarHBondContact O-N 3.12Å
79K84.4Confident87.1Confident122 Ų12265.7 Ų65.753%0.5331%0.311SS..Hα-helixtrans-84.6-14.9171.8-57.8-60178.7177.40112.4Y75 L76 C77Y75-K79 HydrophobicContact CE1-CG 4.5Å; Y75-K79 VanDerWaalsContact CE2-CE 3.42Å; Y75-K79 PolarHBondContact O-N 2.85Å; Y75-K79 WeakPolarHBondContact OH-CE 3.44Å; Y75-K79 PolarHBondContact OH-NZ 3.06Å; L76-K79 PolarHBondContact O-N 2.52Å; C77-K79 VanDerWaalsContact C-N 3.26Å; C77-K79 PolarHBondContact O-N 3.3Å
80G76.3Confident87.2Confident22 Ų2264.9 Ų64.923%0.22731%0.306CS..SBendtrans-80.4163.3170.200000112L76 C77L76-G80 PolarHBondContact O-N 2.92Å; C77-G80 PolarHBondContact O-N 3.39Å; C77-G80 VanDerWaalsContact O-N 3.11Å
81F73.5Confident87.2Confident165 Ų16562.7 Ų62.772%0.72430%0.297SS*.BIsolated β-bridgetrans-102.1155.1169-74.3-86000109.4R83 Q84 P85F81-R83 PolarHBondContact O-N 2.83Å; F81-R83 VanDerWaalsContact O-N 3.14Å; F81-Q84 PolarHBondContact N-O 2.92Å; F81-Q84 CarbonylContact O-C 3.6Å; F81-Q84 WeakPolarHBondContact O-CA 3.35Å; F81-Q84 PolarHBondContact O-N 3.02Å; F81-P85 VanDerWaalsContact O-N 3.1Å
82W61.9Low87.4Confident243 Ų24364.5 Ų64.592%0.9231%0.306SS*.THydrogen-bonded Turntrans-57.9-30.4176-66.2-9.4000113.3Q84 Y156W82-Q84 VanDerWaalsContact C-N 3.28Å; W82-Y156 PolarHBondContact O-OH 3.49Å; W82-Y156 VanDerWaalsContact O-OH 3.1Å
83R69.6Low87.6Confident227 Ų22762.6 Ų62.686%0.85730%0.295SS*.THydrogen-bonded Turntrans-77.3-13.2173.9-73.6-174.6163149.9-2.5114F81 P152F81-R83 PolarHBondContact O-N 2.83Å; F81-R83 VanDerWaalsContact O-N 3.14Å; R83-P152 WeakPolarHBondContact O-CG 3.24Å
84Q78.5Confident87.8Confident86 Ų8663.4 Ų63.440%0.40230%0.3SS..BIsolated β-bridgetrans-148.273.9-179.5-168.5-177.7-23.600108.6F81 W82 R150F81-Q84 PolarHBondContact N-O 2.92Å; F81-Q84 CarbonylContact O-C 3.6Å; F81-Q84 WeakPolarHBondContact O-CA 3.35Å; F81-Q84 PolarHBondContact O-N 3.02Å; W82-Q84 VanDerWaalsContact C-N 3.28Å; Q84-R150 HydrophobicContact CG-CG 4.44Å; Q84-R150 VanDerWaalsContact NE2-CG 3.3Å; Q84-R150 VanDerWaalsContact NE2-NE 3.17Å
85P80.9Confident87.9Confident22 Ų2261.9 Ų61.914%0.14329%0.292CS..  trans-63.1149.6-17828-34.6000109.9F81 C87 L90 T155 Y156F81-P85 VanDerWaalsContact O-N 3.1Å; P85-C87 PolarHBondContact O-N 2.79Å; P85-L90 HydrophobicContact CB-CD1 3.98Å; P85-T155 HydrophobicContact CG-CG2 4.06Å; P85-Y156 HydrophobicContact CG-CE1 4.3Å; P85-Y156 HydrophobicContact CG-CE2 4.22Å
86S88.5Confident88.2Confident30 Ų3059.8 Ų59.821%0.2128%0.284CS..  trans-71.698.7171.6-1770000108.9L76 V88 G89 L90L76-S86 VanDerWaalsContact O-CB 3.29Å; L76-S86 WeakPolarHBondContact O-CB 3.31Å; S86-V88 PolarHBondContact O-N 2.89Å; S86-G89 PolarHBondContact O-N 3.08Å; S86-G89 VanDerWaalsContact O-N 3.09Å; S86-G89 PolarHBondContact OG-N 3.43Å; S86-L90 PolarHBondContact O-N 2.76Å
87C92.9Very high88.5Confident8 Ų861.1 Ų61.15%0.05429%0.288CS..Hα-helixtrans-57.3-37.8175.853.80000111.3P85 Y91 Y138 T155 L221P85-C87 PolarHBondContact O-N 2.79Å; C87-Y91 WeakPolarHBondContact O-CB 3.3Å; C87-Y91 PolarHBondContact O-N 3.45Å; C87-Y138 PolarHBondContact SG-OH 2.71Å; C87-Y138 VanDerWaalsContact SG-OH 3.39Å; C87-T155 HydrophobicContact CB-CG2 4.06Å; C87-L221 HydrophobicContact CB-CD2 4.31Å; C87-L221 WeakPolarHBondContact CB-O 3.21Å; C87-L221 WeakPolarHBondContact O-CD2 3.48Å
88V93.9Very high88.8Confident41 Ų4159.3 Ų59.325%0.24828%0.276CS..Hα-helixtrans-65.1-44.4173.2178.60000111.6L76 S86 L90 Y91 L92 Y138L76-V88 HydrophobicContact CD1-CG1 4.07Å; S86-V88 PolarHBondContact O-N 2.89Å; V88-L90 PolarHBondContact O-N 3.28Å; V88-Y91 PolarHBondContact O-N 3.4Å; V88-L92 HydrophobicContact CG1-CD1 4.26Å; V88-L92 HydrophobicContact CG1-CG 4.36Å; V88-L92 WeakPolarHBondContact O-CG 3.16Å; V88-L92 PolarHBondContact O-N 3.11Å; V88-Y138 HydrophobicContact CG2-CD1 4.24Å; V88-Y138 HydrophobicContact CG2-CE1 3.32Å; V88-Y138 HydrophobicContact CG2-CE2 4.13Å; V88-Y138 WeakPolarHBondContact CG2-OH 3.14Å
89G95.3Very high89.2Confident0 Ų056.4 Ų56.40%026%0.258CS..Hα-helixtrans-58.7-49177.600000111.7G73 S86 L92 C93G73-G89 CarbonylContact C-O 3.51Å; G73-G89 VanDerWaalsContact CA-O 3.27Å; G73-G89 WeakPolarHBondContact CA-O 3.45Å; G73-G89 CarbonylContact O-C 3.59Å; G73-G89 VanDerWaalsContact O-CA 3.29Å; G73-G89 WeakPolarHBondContact O-CA 3Å; S86-G89 PolarHBondContact O-N 3.08Å; S86-G89 VanDerWaalsContact O-N 3.09Å; S86-G89 PolarHBondContact OG-N 3.43Å; G89-L92 PolarHBondContact O-N 3.14Å; G89-C93 PolarHBondContact O-N 2.89Å; G89-C93 PolarHBondContact O-SG 3.31Å; G89-C93 VanDerWaalsContact O-SG 3.36Å
90L96.7Very high89.8Confident31 Ų3151.1 Ų51.116%0.16223%0.234CC..Hα-helixtrans-62.2-43.6176.4-71175.1000111.7C77 P85 S86 V88 L92 C93 V94 T155 L159 L221C77-L90 PolarHBondContact SG-N 3.04Å; C77-L90 VanDerWaalsContact SG-N 3.43Å; P85-L90 HydrophobicContact CB-CD1 3.98Å; S86-L90 PolarHBondContact O-N 2.76Å; V88-L90 PolarHBondContact O-N 3.28Å; L90-L92 PolarHBondContact O-N 3.19Å; L90-C93 WeakPolarHBondContact O-CB 3.08Å; L90-C93 PolarHBondContact O-N 3.01Å; L90-V94 WeakPolarHBondContact O-CG1 3.23Å; L90-V94 WeakPolarHBondContact O-CG2 3.16Å; L90-V94 PolarHBondContact O-N 3.04Å; L90-T155 HydrophobicContact CD1-CG2 3.85Å; L90-L159 HydrophobicContact CD1-CD2 4.38Å; L90-L159 HydrophobicContact CD2-CD2 4.41Å; L90-L221 HydrophobicContact CB-CD1 4.22Å; L90-L221 HydrophobicContact CB-CD2 4.07Å
91Y97.5Very high90.9Very high11 Ų1150.3 Ų50.34%0.04323%0.226CC..Hα-helixtrans-57.4-48.4176.6176.4-93.5000111.6C87 V88 C93 V94 L95 W135 T218 L222C87-Y91 WeakPolarHBondContact O-CB 3.3Å; C87-Y91 PolarHBondContact O-N 3.45Å; V88-Y91 PolarHBondContact O-N 3.4Å; Y91-C93 VanDerWaalsContact C-N 3.34Å; Y91-C93 PolarHBondContact O-N 3.22Å; Y91-V94 WeakPolarHBondContact O-CG2 3.47Å; Y91-V94 PolarHBondContact O-N 3.35Å; Y91-L95 HydrophobicContact CE1-CB 4.47Å; Y91-L95 HydrophobicContact CE1-CD2 3.71Å; Y91-L95 WeakPolarHBondContact O-CB 3.41Å; Y91-L95 PolarHBondContact O-N 3.34Å; Y91-W135 AromaticContact CE1-NE1 3.48Å; Y91-W135 AromaticContact CZ-NE1 3.57Å; Y91-W135 PolarHBondContact OH-NE1 2.95Å; Y91-W135 VanDerWaalsContact OH-NE1 3.13Å; Y91-T218 HydrophobicContact CE2-CG2 4.46Å; Y91-L222 HydrophobicContact CD2-CD1 3.49Å; Y91-L222 VanDerWaalsContact CD2-CD1 3.49Å; Y91-L222 HydrophobicContact CD2-CD2 4Å; Y91-L222 HydrophobicContact CD2-CG 3.61Å; Y91-L222 HydrophobicContact CE2-CD1 3.59Å; Y91-L222 HydrophobicContact CE2-CG 4.22Å; Y91-L222 HydrophobicContact CG-CD1 3.99Å; Y91-L222 HydrophobicContact CG-CD2 3.83Å; Y91-L222 HydrophobicContact CG-CG 4Å
92L97.3Very high92Very high39 Ų3942.5 Ų42.520%0.20419%0.191CC..Hα-helixtrans-62.7-40.9178.1-69.1-179.8000111.7V69 V72 L76 V88 G89 L90 S96V69-L92 HydrophobicContact CG1-CB 4.27Å; V69-L92 HydrophobicContact CG1-CD2 4.1Å; V72-L92 HydrophobicContact CG1-CD1 3.98Å; L76-L92 HydrophobicContact CD1-CD1 3.98Å; V88-L92 HydrophobicContact CG1-CD1 4.26Å; V88-L92 HydrophobicContact CG1-CG 4.36Å; V88-L92 WeakPolarHBondContact O-CG 3.16Å; V88-L92 PolarHBondContact O-N 3.11Å; G89-L92 PolarHBondContact O-N 3.14Å; L90-L92 PolarHBondContact O-N 3.19Å; L92-S96 WeakPolarHBondContact O-CB 3.45Å; L92-S96 PolarHBondContact O-N 3.36Å; L92-S96 PolarHBondContact O-OG 3.38Å
93C98.1Very high93.7Very high10 Ų1030.9 Ų30.97%0.06815%0.147CC..Hα-helixtrans-60.4-52.1174.8-720000111.7Y70 L74 G89 L90 Y91 L95 S96 F97Y70-C93 HydrophobicContact CD2-CB 4.04Å; Y70-C93 VanDerWaalsContact CD2-O 3.22Å; Y70-C93 WeakPolarHBondContact CD2-O 3.21Å; Y70-C93 HydrophobicContact CE2-CB 3.73Å; Y70-C93 WeakPolarHBondContact CE2-O 3.39Å; L74-C93 PolarHBondContact N-SG 3.39Å; G89-C93 PolarHBondContact O-N 2.89Å; G89-C93 PolarHBondContact O-SG 3.31Å; G89-C93 VanDerWaalsContact O-SG 3.36Å; L90-C93 WeakPolarHBondContact O-CB 3.08Å; L90-C93 PolarHBondContact O-N 3.01Å; Y91-C93 VanDerWaalsContact C-N 3.34Å; Y91-C93 PolarHBondContact O-N 3.22Å; C93-L95 PolarHBondContact O-N 3.29Å; C93-S96 PolarHBondContact O-OG 3.26Å; C93-F97 WeakPolarHBondContact O-CB 3.38Å; C93-F97 PolarHBondContact O-N 3.33Å
94V98.3Very high95Very high17 Ų1722.3 Ų22.310%0.10312%0.116CC..Hα-helixtrans-70.4-34.4-176.2-59.20000112.6L90 Y91 F98 L159 V162 L221L90-V94 WeakPolarHBondContact O-CG1 3.23Å; L90-V94 WeakPolarHBondContact O-CG2 3.16Å; L90-V94 PolarHBondContact O-N 3.04Å; Y91-V94 WeakPolarHBondContact O-CG2 3.47Å; Y91-V94 PolarHBondContact O-N 3.35Å; V94-F98 VanDerWaalsContact O-CB 3.25Å; V94-F98 WeakPolarHBondContact O-CB 3.41Å; V94-F98 PolarHBondContact O-N 2.89Å; V94-L159 HydrophobicContact CG1-CD1 3.87Å; V94-V162 HydrophobicContact CB-CG1 3.63Å; V94-V162 HydrophobicContact CG1-CG1 3.77Å; V94-V162 HydrophobicContact CG2-CG1 3.95Å; V94-L221 HydrophobicContact CG2-CD1 4.16Å
95L97.5Very high95.9Very high22 Ų2218.8 Ų18.812%0.11510%0.101CC..Hα-helixtrans-65.4-52.6176.7-179.365.4000111.1Y91 C93 F98 H99 W214Y91-L95 HydrophobicContact CE1-CB 4.47Å; Y91-L95 HydrophobicContact CE1-CD2 3.71Å; Y91-L95 WeakPolarHBondContact O-CB 3.41Å; Y91-L95 PolarHBondContact O-N 3.34Å; C93-L95 PolarHBondContact O-N 3.29Å; L95-F98 PolarHBondContact O-N 3.05Å; L95-H99 PolarHBondContact O-CD2 2.93Å; L95-H99 PolarHBondContact O-N 3.35Å; L95-W214 HydrophobicContact CD1-CH2 3.79Å; L95-W214 HydrophobicContact CD1-CZ2 4.23Å
96S97.9Very high96.6Very high2 Ų217.8 Ų17.81%0.0149%0.094CC..Hα-helixtrans-66.9-38.8-179.354.30000112.4L66 Y70 L92 C93 F100L66-S96 WeakPolarHBondContact O-CB 3.27Å; Y70-S96 VanDerWaalsContact CA-OG 3.3Å; Y70-S96 WeakPolarHBondContact CA-OG 3.36Å; Y70-S96 VanDerWaalsContact CB-OG 3.31Å; Y70-S96 WeakPolarHBondContact CB-OG 3.46Å; Y70-S96 WeakPolarHBondContact CD2-OG 3.43Å; Y70-S96 PolarHBondContact N-OG 3.45Å; L92-S96 WeakPolarHBondContact O-CB 3.45Å; L92-S96 PolarHBondContact O-N 3.36Å; L92-S96 PolarHBondContact O-OG 3.38Å; C93-S96 PolarHBondContact O-OG 3.26Å; S96-F100 WeakPolarHBondContact O-CB 3.33Å; S96-F100 PolarHBondContact O-N 3.03Å
97F98.4Very high97Very high80 Ų8016.5 Ų16.535%0.3519%0.086SC..Hα-helixtrans-62.9-44.9175.2-175.9-98.4000111.6Y70 C93 H99 F100 S101 E166Y70-F97 HydrophobicContact CD2-CB 4.08Å; Y70-F97 HydrophobicContact CE2-CB 3.87Å; Y70-F97 HydrophobicContact CE2-CD2 4.41Å; C93-F97 WeakPolarHBondContact O-CB 3.38Å; C93-F97 PolarHBondContact O-N 3.33Å; F97-H99 PolarHBondContact O-N 2.67Å; F97-F100 HydrophobicContact CD2-CD1 4.2Å; F97-F100 HydrophobicContact CE2-CD1 4.35Å; F97-F100 HydrophobicContact CE2-CE1 4.39Å; F97-F100 PolarHBondContact O-N 3.27Å; F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 2.88Å; F97-S101 PolarHBondContact O-OG 3.26Å; F97-E166 HydrophobicContact CE1-CG 4.28Å; F97-E166 WeakPolarHBondContact CE1-OE1 3.39Å
98F98.1Very high97.1Very high0 Ų019.6 Ų19.60%010%0.101CC..Hα-helixtrans-54.2-50.7179.1172.1-88.5000112.4V94 L95 F100 S101 E102 L120 E166 K170 W211 W214V94-F98 VanDerWaalsContact O-CB 3.25Å; V94-F98 WeakPolarHBondContact O-CB 3.41Å; V94-F98 PolarHBondContact O-N 2.89Å; L95-F98 PolarHBondContact O-N 3.05Å; F98-F100 VanDerWaalsContact C-N 3.34Å; F98-F100 PolarHBondContact O-N 3.36Å; F98-S101 PolarHBondContact O-OG 3.4Å; F98-S101 VanDerWaalsContact O-OG 3.04Å; F98-E102 VanDerWaalsContact O-CB 3.23Å; F98-E102 WeakPolarHBondContact O-CB 3.28Å; F98-E102 PolarHBondContact O-N 3.26Å; F98-L120 HydrophobicContact CE1-CD1 4.13Å; F98-L120 HydrophobicContact CZ-CD1 4.24Å; F98-E166 WeakPolarHBondContact CD2-OE2 3.44Å; F98-K170 PolarHBondContact O-NZ 3.3Å; F98-W211 HydrophobicContact CE1-CE3 4.38Å; F98-W211 AromaticContact CE1-CZ3 3.66Å; F98-W211 HydrophobicContact CE1-CZ3 3.66Å; F98-W211 HydrophobicContact CE2-CE3 4.14Å; F98-W211 HydrophobicContact CE2-CZ3 4.17Å; F98-W211 AromaticContact CZ-CE3 3.63Å; F98-W211 HydrophobicContact CZ-CE3 3.63Å; F98-W211 AromaticContact CZ-CZ3 3.36Å; F98-W211 HydrophobicContact CZ-CZ3 3.36Å; F98-W214 HydrophobicContact CB-CH2 4.29Å; F98-W214 HydrophobicContact CB-CZ2 3.37Å; F98-W214 AromaticContact CD1-CH2 3.97Å; F98-W214 HydrophobicContact CD1-CH2 3.97Å; F98-W214 AromaticContact CD1-CZ2 3.86Å; F98-W214 HydrophobicContact CD1-CZ2 3.86Å; F98-W214 HydrophobicContact CD1-CZ3 4.48Å; F98-W214 AromaticContact CD2-CD1 3.76Å; F98-W214 AromaticContact CD2-CD2 3.69Å; F98-W214 HydrophobicContact CD2-CD2 3.69Å; F98-W214 AromaticContact CD2-CE2 3.37Å; F98-W214 HydrophobicContact CD2-CE3 4.32Å; F98-W214 AromaticContact CD2-CG 3.97Å; F98-W214 HydrophobicContact CD2-CG 3.97Å; F98-W214 HydrophobicContact CD2-CH2 4.43Å; F98-W214 AromaticContact CD2-CZ2 3.81Å; F98-W214 HydrophobicContact CD2-CZ2 3.81Å; F98-W214 AromaticContact CD2-NE1 3.4Å; F98-W214 HydrophobicContact CE2-CD2 4Å; F98-W214 HydrophobicContact CE2-CE3 4.32Å; F98-W214 HydrophobicContact CE2-CG 4.24Å; F98-W214 HydrophobicContact CG-CD2 4.16Å; F98-W214 AromaticContact CG-CE2 3.48Å; F98-W214 VanDerWaalsContact CG-CE2 3.48Å; F98-W214 AromaticContact CG-CH2 3.96Å; F98-W214 HydrophobicContact CG-CH2 3.96Å; F98-W214 AromaticContact CG-CZ2 3.38Å; F98-W214 HydrophobicContact CG-CZ2 3.38Å; F98-W214 AromaticContact CG-NE1 3.74Å
99H97.6Very high97.2Very high7 Ų721.9 Ų21.93%0.03211%0.108CC..Hα-helixtrans-64.9-39.8-178.9-73.7-65.9000111.8L66 L95 F97 F103 F119 L120 L121 H123 Y127L66-H99 HydrophobicContact CD1-CB 3.86Å; L66-H99 HydrophobicContact CD2-CB 3.8Å; L95-H99 PolarHBondContact O-CD2 2.93Å; L95-H99 PolarHBondContact O-N 3.35Å; F97-H99 PolarHBondContact O-N 2.67Å; H99-F103 PolarHBondContact O-N 3.02Å; H99-F119 WeakPolarHBondContact CB-O 3.37Å; H99-F119 PolarHBondContact ND1-O 3.44Å; H99-F119 WeakPolarHBondContact O-CD1 3.48Å; H99-L120 PolarHBondContact CE1-O 3.32Å; H99-L120 PolarHBondContact ND1-O 2.97Å; H99-L120 VanDerWaalsContact ND1-O 3.16Å; H99-L121 HydrophobicContact CB-CD2 4.23Å; H99-H123 AromaticContact CE1-CD2 4Å; H99-H123 AromaticContact CE1-NE2 3.82Å; H99-Y127 PolarHBondContact NE2-OH 2.86Å
100F98Very high97Very high10 Ų1021.9 Ų21.94%0.04411%0.108CC..Hα-helixtrans-66.6-52.7176.6156.7-107.7000111.7F12 F15 L66 S96 F97 F98 E102 F103 F104F12-F100 HydrophobicContact CD2-CZ 4.15Å; F15-F100 HydrophobicContact CB-CD2 3.7Å; F15-F100 HydrophobicContact CB-CE2 3.68Å; F15-F100 HydrophobicContact CB-CG 4.24Å; F15-F100 HydrophobicContact CB-CZ 4.2Å; F15-F100 AromaticContact CD1-CD1 3.85Å; F15-F100 HydrophobicContact CD1-CD1 3.85Å; F15-F100 HydrophobicContact CD1-CD2 4.34Å; F15-F100 AromaticContact CD1-CE1 3.81Å; F15-F100 HydrophobicContact CD1-CE1 3.81Å; F15-F100 HydrophobicContact CD1-CE2 4.31Å; F15-F100 HydrophobicContact CD1-CG 4.12Å; F15-F100 HydrophobicContact CD1-CZ 4.05Å; F15-F100 HydrophobicContact CD2-CB 3.65Å; F15-F100 AromaticContact CD2-CD1 3.96Å; F15-F100 HydrophobicContact CD2-CD1 3.96Å; F15-F100 AromaticContact CD2-CD2 3.77Å; F15-F100 HydrophobicContact CD2-CD2 3.77Å; F15-F100 HydrophobicContact CD2-CE2 4.47Å; F15-F100 AromaticContact CD2-CG 3.48Å; F15-F100 HydrophobicContact CD2-CG 3.48Å; F15-F100 VanDerWaalsContact CD2-CG 3.48Å; F15-F100 AromaticContact CE1-CD1 3.86Å; F15-F100 HydrophobicContact CE1-CD1 3.86Å; F15-F100 HydrophobicContact CE1-CE1 4.05Å; F15-F100 HydrophobicContact CE1-CG 4.38Å; F15-F100 HydrophobicContact CE2-CB 3.66Å; F15-F100 AromaticContact CE2-CD1 3.96Å; F15-F100 HydrophobicContact CE2-CD1 3.96Å; F15-F100 AromaticContact CE2-CG 3.77Å; F15-F100 HydrophobicContact CE2-CG 3.77Å; F15-F100 HydrophobicContact CG-CB 4.36Å; F15-F100 AromaticContact CG-CD1 3.91Å; F15-F100 HydrophobicContact CG-CD1 3.91Å; F15-F100 AromaticContact CG-CD2 3.67Å; F15-F100 HydrophobicContact CG-CD2 3.67Å; F15-F100 HydrophobicContact CG-CE1 4.13Å; F15-F100 AromaticContact CG-CE2 3.91Å; F15-F100 HydrophobicContact CG-CE2 3.91Å; F15-F100 AromaticContact CG-CG 3.67Å; F15-F100 HydrophobicContact CG-CG 3.67Å; F15-F100 HydrophobicContact CG-CZ 4.13Å; F15-F100 HydrophobicContact CZ-CB 4.39Å; F15-F100 AromaticContact CZ-CD1 3.91Å; F15-F100 HydrophobicContact CZ-CD1 3.91Å; F15-F100 HydrophobicContact CZ-CG 4.21Å; L66-F100 HydrophobicContact CB-CB 4.49Å; L66-F100 HydrophobicContact CD1-CB 4.04Å; S96-F100 WeakPolarHBondContact O-CB 3.33Å; S96-F100 PolarHBondContact O-N 3.03Å; F97-F100 HydrophobicContact CD2-CD1 4.2Å; F97-F100 HydrophobicContact CE2-CD1 4.35Å; F97-F100 HydrophobicContact CE2-CE1 4.39Å; F97-F100 PolarHBondContact O-N 3.27Å; F98-F100 VanDerWaalsContact C-N 3.34Å; F98-F100 PolarHBondContact O-N 3.36Å; F100-E102 PolarHBondContact O-N 3.37Å; F100-F103 PolarHBondContact O-N 3.02Å; F100-F104 HydrophobicContact CE2-CB 4.05Å; F100-F104 HydrophobicContact CE2-CD2 4.47Å; F100-F104 HydrophobicContact CE2-CG 4.32Å; F100-F104 HydrophobicContact CZ-CB 4.16Å; F100-F104 HydrophobicContact CZ-CD1 4.48Å; F100-F104 HydrophobicContact CZ-CD2 4.46Å; F100-F104 HydrophobicContact CZ-CG 4.12Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 3.1Å
101S98.1Very high96.7Very high6 Ų622.2 Ų22.24%0.04211%0.113CC..Hα-helixtrans-66.2-29.9-175.166.10000111.6F97 F98 S105 E166 K170F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 2.88Å; F97-S101 PolarHBondContact O-OG 3.26Å; F98-S101 PolarHBondContact O-OG 3.4Å; F98-S101 VanDerWaalsContact O-OG 3.04Å; S101-S105 WeakPolarHBondContact O-CB 3.23Å; S101-S105 PolarHBondContact O-N 3.44Å; S101-S105 PolarHBondContact O-OG 2.9Å; S101-E166 WeakPolarHBondContact CB-OE1 3.3Å; S101-E166 PolarHBondContact OG-OE1 2.94Å; S101-K170 WeakPolarHBondContact OG-CE 3.2Å; S101-K170 PolarHBondContact OG-NZ 2.89Å
102E97.6Very high96.3Very high0 Ų027.7 Ų27.70%014%0.137CC..Hα-helixtrans-61.2-58172.4-169.379.8172.300110.5F98 F100 F104 S105 I106 S118 L120 R169 K170 H182F98-E102 VanDerWaalsContact O-CB 3.23Å; F98-E102 WeakPolarHBondContact O-CB 3.28Å; F98-E102 PolarHBondContact O-N 3.26Å; F100-E102 PolarHBondContact O-N 3.37Å; E102-F104 VanDerWaalsContact C-N 3.3Å; E102-F104 PolarHBondContact O-N 3.46Å; E102-S105 PolarHBondContact O-N 3.26Å; E102-I106 VanDerWaalsContact O-CG1 3.28Å; E102-I106 WeakPolarHBondContact O-CG1 3.38Å; E102-I106 PolarHBondContact O-N 3.46Å; E102-S118 WeakPolarHBondContact CG-O 3.22Å; E102-L120 HydrophobicContact CG-CD1 3.71Å; E102-L120 HydrophobicContact CG-CG 4.11Å; E102-R169 IonicContact OE1-CZ 2.63Å; E102-R169 IonicContact OE1-NE 3.44Å; E102-R169 PolarHBondContact OE1-NE 3.18Å; E102-R169 IonicContact OE1-NH2 2.8Å; E102-R169 PolarHBondContact OE1-NH2 3.35Å; E102-R169 WeakPolarHBondContact OE2-CD 3.42Å; E102-R169 IonicContact OE2-CZ 3.96Å; E102-R169 IonicContact OE2-NE 3.13Å; E102-R169 PolarHBondContact OE2-NE 2.95Å; E102-K170 IonicContact OE2-NZ 2.9Å; E102-K170 PolarHBondContact OE2-NZ 3.42Å; E102-H182 IonicContact OE1-CD2 3.06Å; E102-H182 IonicContact OE1-CE1 3.25Å; E102-H182 IonicContact OE1-NE2 3.57Å; E102-H182 PolarHBondContact OE1-NE2 3.26Å
103F97.1Very high95.8Very high0 Ų027.1 Ų27.10%014%0.136CC..Hα-helixtrans-56-47.8177.2177.9-89000111.3H7 V59 H99 F100 S105 I106 A107 L114 S115 S118 F119H7-F103 HydrophobicContact CB-CE1 4.27Å; H7-F103 HydrophobicContact CB-CZ 3.99Å; V59-F103 HydrophobicContact CB-CZ 4.14Å; V59-F103 HydrophobicContact CG1-CD1 4.36Å; V59-F103 HydrophobicContact CG1-CE1 3.49Å; V59-F103 VanDerWaalsContact CG1-CE1 3.49Å; V59-F103 HydrophobicContact CG1-CE2 4.47Å; V59-F103 HydrophobicContact CG1-CZ 3.58Å; V59-F103 HydrophobicContact CG2-CE1 4.19Å; V59-F103 HydrophobicContact CG2-CE2 3.72Å; V59-F103 HydrophobicContact CG2-CZ 3.38Å; H99-F103 PolarHBondContact O-N 3.02Å; F100-F103 PolarHBondContact O-N 3.02Å; F103-S105 VanDerWaalsContact C-N 3.34Å; F103-S105 PolarHBondContact O-N 2.83Å; F103-I106 PolarHBondContact O-N 3.29Å; F103-A107 HydrophobicContact CE1-CB 4.25Å; F103-A107 WeakPolarHBondContact O-CB 3.03Å; F103-A107 PolarHBondContact O-N 3.49Å; F103-L114 HydrophobicContact CD2-CD1 4.08Å; F103-L114 HydrophobicContact CE1-CD1 4.49Å; F103-L114 HydrophobicContact CE2-CD1 3.58Å; F103-L114 HydrophobicContact CE2-CG 4.37Å; F103-L114 HydrophobicContact CZ-CD1 3.79Å; F103-L114 HydrophobicContact CZ-CD2 4.46Å; F103-L114 HydrophobicContact CZ-CG 4.45Å; F103-S115 WeakPolarHBondContact CE2-O 3.4Å; F103-S118 PolarHBondContact N-O 2.92Å; F103-F119 HydrophobicContact CB-CB 4.43Å; F103-F119 HydrophobicContact CB-CD1 3.57Å; F103-F119 HydrophobicContact CB-CD2 3.93Å; F103-F119 HydrophobicContact CB-CE1 3.63Å; F103-F119 HydrophobicContact CB-CE2 3.96Å; F103-F119 HydrophobicContact CB-CG 3.72Å; F103-F119 HydrophobicContact CB-CZ 3.82Å; F103-F119 HydrophobicContact CD1-CE1 4.12Å; F103-F119 AromaticContact CD1-CE2 3.76Å; F103-F119 HydrophobicContact CD1-CE2 3.76Å; F103-F119 AromaticContact CD1-CZ 3.53Å; F103-F119 HydrophobicContact CD1-CZ 3.53Å; F103-F119 AromaticContact CD2-CD2 3.33Å; F103-F119 HydrophobicContact CD2-CD2 3.33Å; F103-F119 HydrophobicContact CD2-CE1 4.48Å; F103-F119 AromaticContact CD2-CE2 3.25Å; F103-F119 HydrophobicContact CD2-CE2 3.25Å; F103-F119 AromaticContact CD2-CG 3.99Å; F103-F119 HydrophobicContact CD2-CG 3.99Å; F103-F119 AromaticContact CD2-CZ 3.87Å; F103-F119 HydrophobicContact CD2-CZ 3.87Å; F103-F119 HydrophobicContact CE1-CE2 4.11Å; F103-F119 HydrophobicContact CE1-CZ 4.1Å; F103-F119 AromaticContact CE2-CD2 3.98Å; F103-F119 HydrophobicContact CE2-CD2 3.98Å; F103-F119 AromaticContact CE2-CE2 3.62Å; F103-F119 HydrophobicContact CE2-CE2 3.62Å; F103-F119 HydrophobicContact CE2-CZ 4.38Å; F103-F119 HydrophobicContact CG-CD1 4.08Å; F103-F119 AromaticContact CG-CD2 3.66Å; F103-F119 HydrophobicContact CG-CD2 3.66Å; F103-F119 AromaticContact CG-CE1 3.82Å; F103-F119 HydrophobicContact CG-CE1 3.82Å; F103-F119 AromaticContact CG-CE2 3.34Å; F103-F119 HydrophobicContact CG-CE2 3.34Å; F103-F119 AromaticContact CG-CG 4Å; F103-F119 HydrophobicContact CG-CG 4Å; F103-F119 AromaticContact CG-CZ 3.43Å; F103-F119 HydrophobicContact CG-CZ 3.43Å; F103-F119 VanDerWaalsContact CG-CZ 3.43Å; F103-F119 HydrophobicContact CZ-CE2 4.05Å
104F97.2Very high95.6Very high47 Ų4728.3 Ų28.321%0.20614%0.142CC..Hα-helixtrans-60.7-42.1-178.2-175.9-112.1000112.1A8 F12 F100 E102 A107 L108A8-F104 HydrophobicContact CB-CD2 4.36Å; A8-F104 HydrophobicContact CB-CE2 4.21Å; A8-F104 WeakPolarHBondContact O-CE2 3.4Å; F12-F104 HydrophobicContact CB-CD2 4.14Å; F12-F104 HydrophobicContact CB-CE2 3.63Å; F12-F104 HydrophobicContact CB-CZ 4.22Å; F12-F104 HydrophobicContact CD2-CE2 4.24Å; F12-F104 HydrophobicContact CD2-CZ 4.02Å; F12-F104 HydrophobicContact CG-CE2 4.26Å; F12-F104 HydrophobicContact CG-CZ 4.37Å; F100-F104 HydrophobicContact CE2-CB 4.05Å; F100-F104 HydrophobicContact CE2-CD2 4.47Å; F100-F104 HydrophobicContact CE2-CG 4.32Å; F100-F104 HydrophobicContact CZ-CB 4.16Å; F100-F104 HydrophobicContact CZ-CD1 4.48Å; F100-F104 HydrophobicContact CZ-CD2 4.46Å; F100-F104 HydrophobicContact CZ-CG 4.12Å; F100-F104 WeakPolarHBondContact O-CB 3.34Å; F100-F104 PolarHBondContact O-N 3.1Å; E102-F104 VanDerWaalsContact C-N 3.3Å; E102-F104 PolarHBondContact O-N 3.46Å; F104-A107 PolarHBondContact O-N 3.48Å; F104-L108 HydrophobicContact CD1-CD1 4.03Å; F104-L108 HydrophobicContact CE1-CD1 3.49Å; F104-L108 VanDerWaalsContact CE1-CD1 3.49Å; F104-L108 HydrophobicContact CE1-CG 4.49Å; F104-L108 HydrophobicContact CE2-CD1 4.14Å; F104-L108 HydrophobicContact CE2-CG 4.4Å; F104-L108 HydrophobicContact CZ-CD1 3.56Å; F104-L108 HydrophobicContact CZ-CG 4.3Å; F104-L108 WeakPolarHBondContact O-CG 3.47Å; F104-L108 PolarHBondContact O-N 3.49Å; F104-L108 VanDerWaalsContact O-N 3.14Å
105S97.2Very high95.3Very high12 Ų1229.7 Ų29.78%0.08415%0.152CC..Hα-helixtrans-66.9-40.5177.9-58.20000111.8S101 E102 F103 A107 L108 F109 K170S101-S105 WeakPolarHBondContact O-CB 3.23Å; S101-S105 PolarHBondContact O-N 3.44Å; S101-S105 PolarHBondContact O-OG 2.9Å; E102-S105 PolarHBondContact O-N 3.26Å; F103-S105 VanDerWaalsContact C-N 3.34Å; F103-S105 PolarHBondContact O-N 2.83Å; S105-A107 VanDerWaalsContact C-N 3.34Å; S105-L108 PolarHBondContact O-N 3.45Å; S105-F109 WeakPolarHBondContact O-CB 3.41Å; S105-F109 VanDerWaalsContact O-CD2 3.27Å; S105-F109 WeakPolarHBondContact O-CD2 3.47Å; S105-F109 PolarHBondContact O-N 3.21Å; S105-K170 WeakPolarHBondContact OG-CG 3.42Å
106I96.2Very high95Very high0 Ų030.4 Ų30.40%016%0.157CC..Hα-helixtrans-64.9-41.2175.8-62.1-69.8000110.7E102 F103 L108 S110 S111 L114 I173 F180E102-I106 VanDerWaalsContact O-CG1 3.28Å; E102-I106 WeakPolarHBondContact O-CG1 3.38Å; E102-I106 PolarHBondContact O-N 3.46Å; F103-I106 PolarHBondContact O-N 3.29Å; I106-L108 PolarHBondContact O-N 3.44Å; I106-S110 WeakPolarHBondContact CG2-O 3.45Å; I106-S110 CarbonylContact O-C 3.56Å; I106-S110 WeakPolarHBondContact O-CA 3.31Å; I106-S110 PolarHBondContact O-N 2.8Å; I106-S111 PolarHBondContact O-N 2.94Å; I106-L114 HydrophobicContact CB-CD1 4.32Å; I106-L114 HydrophobicContact CG2-CB 4.26Å; I106-L114 HydrophobicContact CG2-CD1 3.86Å; I106-I173 HydrophobicContact CD1-CD1 4.07Å; I106-I173 HydrophobicContact CD1-CG1 4.21Å; I106-I173 HydrophobicContact CD1-CG2 3.94Å; I106-I173 HydrophobicContact CG1-CD1 4.47Å; I106-F180 HydrophobicContact CD1-CD1 3.41Å; I106-F180 VanDerWaalsContact CD1-CD1 3.41Å; I106-F180 HydrophobicContact CD1-CE1 3.62Å; I106-F180 HydrophobicContact CD1-CG 4.5Å
107A95.6Very high94.7Very high4 Ų434 Ų343%0.03318%0.177CC..Hα-helixtrans-63.8-30.1179.100000112.9A8 F103 F104 S105 L114A8-A107 HydrophobicContact CB-CB 3.71Å; F103-A107 HydrophobicContact CE1-CB 4.25Å; F103-A107 WeakPolarHBondContact O-CB 3.03Å; F103-A107 PolarHBondContact O-N 3.49Å; F104-A107 PolarHBondContact O-N 3.48Å; S105-A107 VanDerWaalsContact C-N 3.34Å; A107-L114 HydrophobicContact CB-CD1 3.81Å; A107-L114 HydrophobicContact CB-CD2 3.96Å
108L95.9Very high94.6Very high72 Ų7230.2 Ų30.238%0.37716%0.16SC..Hα-helixtrans-86.4-42.3177.9-70.4179.4000114A8 F104 S105 I106A8-L108 HydrophobicContact CB-CD2 3.88Å; A8-L108 HydrophobicContact CB-CG 4.29Å; F104-L108 HydrophobicContact CD1-CD1 4.03Å; F104-L108 HydrophobicContact CE1-CD1 3.49Å; F104-L108 VanDerWaalsContact CE1-CD1 3.49Å; F104-L108 HydrophobicContact CE1-CG 4.49Å; F104-L108 HydrophobicContact CE2-CD1 4.14Å; F104-L108 HydrophobicContact CE2-CG 4.4Å; F104-L108 HydrophobicContact CZ-CD1 3.56Å; F104-L108 HydrophobicContact CZ-CG 4.3Å; F104-L108 WeakPolarHBondContact O-CG 3.47Å; F104-L108 PolarHBondContact O-N 3.49Å; F104-L108 VanDerWaalsContact O-N 3.14Å; S105-L108 PolarHBondContact O-N 3.45Å; I106-L108 PolarHBondContact O-N 3.44Å
109F95.1Very high94.4Very high90 Ų9030.3 Ų30.340%0.39516%0.161SC..Hα-helixtrans-113.3-24.5-166.5-59.3-71.6000114S105 I173 V174 G177 D178S105-F109 WeakPolarHBondContact O-CB 3.41Å; S105-F109 VanDerWaalsContact O-CD2 3.27Å; S105-F109 WeakPolarHBondContact O-CD2 3.47Å; S105-F109 PolarHBondContact O-N 3.21Å; F109-I173 HydrophobicContact CB-CG2 4.22Å; F109-V174 HydrophobicContact CD1-CG1 4.46Å; F109-V174 HydrophobicContact CD1-CG2 4.28Å; F109-V174 HydrophobicContact CD2-CG2 3.68Å; F109-V174 HydrophobicContact CE1-CG1 4.36Å; F109-V174 HydrophobicContact CE1-CG2 4.22Å; F109-V174 HydrophobicContact CE2-CG2 3.62Å; F109-V174 HydrophobicContact CG-CG2 4.03Å; F109-V174 HydrophobicContact CZ-CG2 3.9Å; F109-G177 CarbonylContact O-C 3.57Å; F109-G177 WeakPolarHBondContact O-CA 3.44Å; F109-D178 PolarHBondContact O-N 2.63Å
110S92.4Very high94.2Very high0 Ų031.1 Ų31.10%017%0.165CC..  trans-130.249.2-173.9-51.40000110.5I106 K112 S113 G177 F180I106-S110 WeakPolarHBondContact CG2-O 3.45Å; I106-S110 CarbonylContact O-C 3.56Å; I106-S110 WeakPolarHBondContact O-CA 3.31Å; I106-S110 PolarHBondContact O-N 2.8Å; S110-K112 PolarHBondContact O-N 2.81Å; S110-S113 PolarHBondContact O-N 2.88Å; S110-S113 PolarHBondContact O-OG 3.29Å; S110-G177 VanDerWaalsContact CB-O 3.31Å; S110-G177 WeakPolarHBondContact CB-O 3.32Å; S110-G177 PolarHBondContact OG-O 3.43Å; S110-F180 WeakPolarHBondContact OG-CB 3.43Å
111S90.3Very high93.7Very high37 Ų3733.1 Ų33.126%0.25918%0.176SC..G310 helixtrans-64.5-26.4-166.369.50000113.1I106 S113 L114 D178I106-S111 PolarHBondContact O-N 2.94Å; S111-S113 VanDerWaalsContact C-N 3.28Å; S111-S113 PolarHBondContact O-N 2.93Å; S111-L114 VanDerWaalsContact O-CB 3.28Å; S111-L114 WeakPolarHBondContact O-CB 3.4Å; S111-L114 PolarHBondContact O-N 2.66Å; S111-D178 PolarHBondContact N-OD1 3.05Å
112K88.6Confident92.9Very high126 Ų12637.6 Ų37.655%0.54820%0.199SC..G310 helixtrans-68.2-21.7175.5-68.5-177.9-173.7155.60114.6S110 D178S110-K112 PolarHBondContact O-N 2.81Å; K112-D178 HydrophobicContact CD-CB 4.07Å; K112-D178 VanDerWaalsContact CD-OD2 3.29Å; K112-D178 WeakPolarHBondContact CD-OD2 3.31Å; K112-D178 WeakPolarHBondContact CE-OD2 3.34Å; K112-D178 PolarHBondContact N-OD1 3.37Å; K112-D178 IonicContact NZ-OD2 3.22Å; K112-D178 PolarHBondContact NZ-OD2 3.2Å
113S87.3Confident91.9Very high27 Ų2739.7 Ų39.719%0.18921%0.209CC..G310 helixtrans-102.15.8175.9550000112.9S110 S111 S115 F180S110-S113 PolarHBondContact O-N 2.88Å; S110-S113 PolarHBondContact O-OG 3.29Å; S111-S113 VanDerWaalsContact C-N 3.28Å; S111-S113 PolarHBondContact O-N 2.93Å; S113-S115 PolarHBondContact O-N 3.44Å; S113-F180 PolarHBondContact OG-O 2.91Å
114L93Very high91.4Very high36 Ų3642.8 Ų42.819%0.18823%0.23CC..  trans-66.6125.8-175-175.867.5000111.1P4 H7 F103 I106 A107 S111P4-L114 HydrophobicContact CB-CD2 3.75Å; P4-L114 HydrophobicContact CG-CD2 4.43Å; H7-L114 HydrophobicContact CB-CD2 4.14Å; F103-L114 HydrophobicContact CD2-CD1 4.08Å; F103-L114 HydrophobicContact CE1-CD1 4.49Å; F103-L114 HydrophobicContact CE2-CD1 3.58Å; F103-L114 HydrophobicContact CE2-CG 4.37Å; F103-L114 HydrophobicContact CZ-CD1 3.79Å; F103-L114 HydrophobicContact CZ-CD2 4.46Å; F103-L114 HydrophobicContact CZ-CG 4.45Å; I106-L114 HydrophobicContact CB-CD1 4.32Å; I106-L114 HydrophobicContact CG2-CB 4.26Å; I106-L114 HydrophobicContact CG2-CD1 3.86Å; A107-L114 HydrophobicContact CB-CD1 3.81Å; A107-L114 HydrophobicContact CB-CD2 3.96Å; S111-L114 VanDerWaalsContact O-CB 3.28Å; S111-L114 WeakPolarHBondContact O-CB 3.4Å; S111-L114 PolarHBondContact O-N 2.66Å
115S92.5Very high91Very high46 Ų4645.3 Ų45.332%0.32225%0.25SC..  trans-143169.8168.1720000109.8F103 S113 D117 S118F103-S115 WeakPolarHBondContact CE2-O 3.4Å; S113-S115 PolarHBondContact O-N 3.44Å; S115-D117 PolarHBondContact O-N 2.8Å; S115-D117 WeakPolarHBondContact OG-CB 3.33Å; S115-D117 PolarHBondContact OG-N 3.31Å; S115-D117 PolarHBondContact OG-OD2 3.14Å; S115-S118 PolarHBondContact N-OG 3.45Å; S115-S118 WeakPolarHBondContact O-CB 3.2Å; S115-S118 PolarHBondContact O-N 3.17Å; S115-S118 PolarHBondContact O-OG 2.93Å; S115-S118 VanDerWaalsContact O-OG 3.11Å
116T91.3Very high90.7Very high36 Ų3650.8 Ų50.822%0.22127%0.274CS..G310 helixtrans-63-25.2172.348.40000111.9Q58 V59 S118 F119Q58-T116 HydrophobicContact CB-CG2 3.74Å; Q58-T116 PolarHBondContact OE1-OG1 3.12Å; V59-T116 HydrophobicContact CG2-CG2 4.05Å; T116-S118 PolarHBondContact O-N 3.18Å; T116-F119 WeakPolarHBondContact O-CD2 3.48Å; T116-F119 PolarHBondContact O-N 3.31Å
117D92Very high90.3Very high79 Ų7952.6 Ų52.642%0.42228%0.281SS..G310 helixtrans-66.6-16172.8-44.2-47.5000112.9S115 F119 L120 N122S115-D117 PolarHBondContact O-N 2.8Å; S115-D117 WeakPolarHBondContact OG-CB 3.33Å; S115-D117 PolarHBondContact OG-N 3.31Å; S115-D117 PolarHBondContact OG-OD2 3.14Å; D117-F119 PolarHBondContact O-N 3.44Å; D117-L120 WeakPolarHBondContact O-CA 3.37Å; D117-L120 PolarHBondContact O-N 3.31Å; D117-N122 WeakPolarHBondContact CA-OD1 3.34Å; D117-N122 PolarHBondContact OD1-ND2 2.93Å
118S94.6Very high90.2Very high0 Ų058 Ų580%030%0.3CS..G310 helixtrans-67.2-14.7178.5-58.60000113.3E102 F103 S115 T116 L120E102-S118 WeakPolarHBondContact CG-O 3.22Å; F103-S118 PolarHBondContact N-O 2.92Å; S115-S118 PolarHBondContact N-OG 3.45Å; S115-S118 WeakPolarHBondContact O-CB 3.2Å; S115-S118 PolarHBondContact O-N 3.17Å; S115-S118 PolarHBondContact O-OG 2.93Å; S115-S118 VanDerWaalsContact O-OG 3.11Å; T116-S118 PolarHBondContact O-N 3.18Å; S118-L120 PolarHBondContact O-N 3.22Å
119F94.7Very high90.1Very high2 Ų259.2 Ų59.21%0.00931%0.307CS..G310 helixtrans-65.2-19.8165.5-81.8-78.5000112.7V59 C62 S63 L66 H99 F103 T116 D117 L121V59-F119 HydrophobicContact CB-CE2 4.26Å; V59-F119 HydrophobicContact CG1-CE2 4.13Å; V59-F119 HydrophobicContact CG1-CZ 4.13Å; V59-F119 HydrophobicContact CG2-CE2 4.11Å; C62-F119 HydrophobicContact CB-CD1 4.25Å; C62-F119 HydrophobicContact CB-CD2 4.03Å; C62-F119 HydrophobicContact CB-CE1 4.11Å; C62-F119 HydrophobicContact CB-CE2 3.89Å; C62-F119 HydrophobicContact CB-CG 4.22Å; C62-F119 HydrophobicContact CB-CZ 3.94Å; S63-F119 WeakPolarHBondContact OG-CZ 3.23Å; L66-F119 HydrophobicContact CD1-CD1 3.58Å; L66-F119 HydrophobicContact CD1-CE1 3.79Å; H99-F119 WeakPolarHBondContact CB-O 3.37Å; H99-F119 PolarHBondContact ND1-O 3.44Å; H99-F119 WeakPolarHBondContact O-CD1 3.48Å; F103-F119 HydrophobicContact CB-CB 4.43Å; F103-F119 HydrophobicContact CB-CD1 3.57Å; F103-F119 HydrophobicContact CB-CD2 3.93Å; F103-F119 HydrophobicContact CB-CE1 3.63Å; F103-F119 HydrophobicContact CB-CE2 3.96Å; F103-F119 HydrophobicContact CB-CG 3.72Å; F103-F119 HydrophobicContact CB-CZ 3.82Å; F103-F119 HydrophobicContact CD1-CE1 4.12Å; F103-F119 AromaticContact CD1-CE2 3.76Å; F103-F119 HydrophobicContact CD1-CE2 3.76Å; F103-F119 AromaticContact CD1-CZ 3.53Å; F103-F119 HydrophobicContact CD1-CZ 3.53Å; F103-F119 AromaticContact CD2-CD2 3.33Å; F103-F119 HydrophobicContact CD2-CD2 3.33Å; F103-F119 HydrophobicContact CD2-CE1 4.48Å; F103-F119 AromaticContact CD2-CE2 3.25Å; F103-F119 HydrophobicContact CD2-CE2 3.25Å; F103-F119 AromaticContact CD2-CG 3.99Å; F103-F119 HydrophobicContact CD2-CG 3.99Å; F103-F119 AromaticContact CD2-CZ 3.87Å; F103-F119 HydrophobicContact CD2-CZ 3.87Å; F103-F119 HydrophobicContact CE1-CE2 4.11Å; F103-F119 HydrophobicContact CE1-CZ 4.1Å; F103-F119 AromaticContact CE2-CD2 3.98Å; F103-F119 HydrophobicContact CE2-CD2 3.98Å; F103-F119 AromaticContact CE2-CE2 3.62Å; F103-F119 HydrophobicContact CE2-CE2 3.62Å; F103-F119 HydrophobicContact CE2-CZ 4.38Å; F103-F119 HydrophobicContact CG-CD1 4.08Å; F103-F119 AromaticContact CG-CD2 3.66Å; F103-F119 HydrophobicContact CG-CD2 3.66Å; F103-F119 AromaticContact CG-CE1 3.82Å; F103-F119 HydrophobicContact CG-CE1 3.82Å; F103-F119 AromaticContact CG-CE2 3.34Å; F103-F119 HydrophobicContact CG-CE2 3.34Å; F103-F119 AromaticContact CG-CG 4Å; F103-F119 HydrophobicContact CG-CG 4Å; F103-F119 AromaticContact CG-CZ 3.43Å; F103-F119 HydrophobicContact CG-CZ 3.43Å; F103-F119 VanDerWaalsContact CG-CZ 3.43Å; F103-F119 HydrophobicContact CZ-CE2 4.05Å; T116-F119 WeakPolarHBondContact O-CD2 3.48Å; T116-F119 PolarHBondContact O-N 3.31Å; D117-F119 PolarHBondContact O-N 3.44Å; F119-L121 HydrophobicContact CB-CB 4.47Å; F119-L121 HydrophobicContact CB-CD1 3.98Å; F119-L121 HydrophobicContact CB-CG 3.96Å; F119-L121 HydrophobicContact CG-CD1 4.36Å; F119-L121 PolarHBondContact O-N 3.01Å
120L92.7Very high90.1Very high23 Ų2356.3 Ų56.312%0.1230%0.299CS..  trans55.336.8-172.2-54.2177.3000111.7F98 H99 E102 D117 S118 H123 R169F98-L120 HydrophobicContact CE1-CD1 4.13Å; F98-L120 HydrophobicContact CZ-CD1 4.24Å; H99-L120 PolarHBondContact CE1-O 3.32Å; H99-L120 PolarHBondContact ND1-O 2.97Å; H99-L120 VanDerWaalsContact ND1-O 3.16Å; E102-L120 HydrophobicContact CG-CD1 3.71Å; E102-L120 HydrophobicContact CG-CG 4.11Å; D117-L120 WeakPolarHBondContact O-CA 3.37Å; D117-L120 PolarHBondContact O-N 3.31Å; S118-L120 PolarHBondContact O-N 3.22Å; L120-H123 PolarHBondContact O-CD2 2.84Å; L120-H123 PolarHBondContact O-NE2 2.95Å; L120-R169 VanDerWaalsContact CD1-NH2 3.3Å
121L88.3Confident90.2Very high53 Ų5356.4 Ų56.428%0.27730%0.3SS..  trans-87-32.9174.7-73.3170.3000111.5C62 L66 H99 F119 H123C62-L121 HydrophobicContact CB-CD1 4.01Å; L66-L121 HydrophobicContact CD1-CD1 4.38Å; L66-L121 HydrophobicContact CD2-CD2 4.32Å; H99-L121 HydrophobicContact CB-CD2 4.23Å; F119-L121 HydrophobicContact CB-CB 4.47Å; F119-L121 HydrophobicContact CB-CD1 3.98Å; F119-L121 HydrophobicContact CB-CG 3.96Å; F119-L121 HydrophobicContact CG-CD1 4.36Å; F119-L121 PolarHBondContact O-N 3.01Å; L121-H123 PolarHBondContact O-N 3.29Å
122N81.9Confident90.5Very high100 Ų10059.5 Ų59.554%0.53531%0.312SS..SBendtrans-8364.9172.462.6-32.9000110.7D117D117-N122 WeakPolarHBondContact CA-OD1 3.34Å; D117-N122 PolarHBondContact OD1-ND2 2.93Å
123H75.8Confident90.9Very high44 Ų4456 Ų5620%0.20430%0.304CS..  trans-76.2168.9173.7-85.5-65.2000112.9H99 L120 L121 Y127 W211H99-H123 AromaticContact CE1-CD2 4Å; H99-H123 AromaticContact CE1-NE2 3.82Å; L120-H123 PolarHBondContact O-CD2 2.84Å; L120-H123 PolarHBondContact O-NE2 2.95Å; L121-H123 PolarHBondContact O-N 3.29Å; H123-Y127 VanDerWaalsContact CB-CB 3.46Å; H123-Y127 HydrophobicContact CB-CD1 3.36Å; H123-Y127 HydrophobicContact CB-CD2 4.18Å; H123-Y127 HydrophobicContact CB-CE1 4.12Å; H123-Y127 HydrophobicContact CB-CG 3.39Å; H123-Y127 AromaticContact CD2-CD1 3.54Å; H123-Y127 AromaticContact CD2-CD2 3.61Å; H123-Y127 AromaticContact CD2-CE1 3.42Å; H123-Y127 VanDerWaalsContact CD2-CE1 3.42Å; H123-Y127 WeakPolarHBondContact CD2-CE1 3.43Å; H123-Y127 AromaticContact CD2-CE2 3.52Å; H123-Y127 AromaticContact CD2-CG 3.62Å; H123-Y127 AromaticContact CD2-CZ 3.41Å; H123-Y127 VanDerWaalsContact CD2-CZ 3.41Å; H123-Y127 AromaticContact CG-CD1 3.66Å; H123-Y127 AromaticContact CG-CD2 3.77Å; H123-Y127 AromaticContact CG-CG 3.5Å; H123-Y127 VanDerWaalsContact CG-CG 3.5Å; H123-Y127 AromaticContact NE2-CD2 3.88Å; H123-Y127 AromaticContact NE2-CE2 3.62Å; H123-Y127 AromaticContact NE2-CZ 3.84Å; H123-W211 AromaticContact CE1-CH2 3.88Å; H123-W211 AromaticContact NE2-CH2 3.95Å
124S86.8Confident91.4Very high64 Ų6454.7 Ų54.745%0.44830%0.295SS..  trans-67.3165.917574.90000112.4E126 Y127 W128S124-E126 WeakPolarHBondContact CB-OE2 3.32Å; S124-E126 PolarHBondContact O-N 3.23Å; S124-E126 PolarHBondContact OG-OE2 3.46Å; S124-Y127 WeakPolarHBondContact O-CB 3.49Å; S124-Y127 PolarHBondContact O-N 2.93Å; S124-Y127 VanDerWaalsContact O-N 3.15Å; S124-W128 PolarHBondContact O-N 3.35Å
125V89.1Confident91.5Very high101 Ų10158 Ų5861%0.61231%0.305SS*.Hα-helixtrans-59.3-35.2179.3177.30000111.1Y127 W128 I129V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 2.88Å; V125-W128 PolarHBondContact O-N 2.92Å; V125-I129 HydrophobicContact CG1-CD1 3.84Å; V125-I129 HydrophobicContact CG1-CG1 4.26Å; V125-I129 WeakPolarHBondContact O-CG1 3.49Å; V125-I129 PolarHBondContact O-N 3.49Å
126E90.6Very high91.8Very high126 Ų12662.7 Ų62.759%0.58932%0.32SS*.Hα-helixtrans-62.8-37.1179.3-57.872.6-155.400112.1S124 I129 A130S124-E126 WeakPolarHBondContact CB-OE2 3.32Å; S124-E126 PolarHBondContact O-N 3.23Å; S124-E126 PolarHBondContact OG-OE2 3.46Å; E126-I129 PolarHBondContact O-N 3.23Å; E126-A130 WeakPolarHBondContact O-CB 3.23Å; E126-A130 PolarHBondContact O-N 3.23Å
127Y89.1Confident92.1Very high38 Ų3861.8 Ų61.815%0.14931%0.313CS..Hα-helixtrans-64.3-44.3175177.2-92.6000111.4H99 H123 S124 V125 A130 A131 W211H99-Y127 PolarHBondContact NE2-OH 2.86Å; H123-Y127 VanDerWaalsContact CB-CB 3.46Å; H123-Y127 HydrophobicContact CB-CD1 3.36Å; H123-Y127 HydrophobicContact CB-CD2 4.18Å; H123-Y127 HydrophobicContact CB-CE1 4.12Å; H123-Y127 HydrophobicContact CB-CG 3.39Å; H123-Y127 AromaticContact CD2-CD1 3.54Å; H123-Y127 AromaticContact CD2-CD2 3.61Å; H123-Y127 AromaticContact CD2-CE1 3.42Å; H123-Y127 VanDerWaalsContact CD2-CE1 3.42Å; H123-Y127 WeakPolarHBondContact CD2-CE1 3.43Å; H123-Y127 AromaticContact CD2-CE2 3.52Å; H123-Y127 AromaticContact CD2-CG 3.62Å; H123-Y127 AromaticContact CD2-CZ 3.41Å; H123-Y127 VanDerWaalsContact CD2-CZ 3.41Å; H123-Y127 AromaticContact CG-CD1 3.66Å; H123-Y127 AromaticContact CG-CD2 3.77Å; H123-Y127 AromaticContact CG-CG 3.5Å; H123-Y127 VanDerWaalsContact CG-CG 3.5Å; H123-Y127 AromaticContact NE2-CD2 3.88Å; H123-Y127 AromaticContact NE2-CE2 3.62Å; H123-Y127 AromaticContact NE2-CZ 3.84Å; S124-Y127 WeakPolarHBondContact O-CB 3.49Å; S124-Y127 PolarHBondContact O-N 2.93Å; S124-Y127 VanDerWaalsContact O-N 3.15Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 2.88Å; Y127-A130 PolarHBondContact O-N 3.5Å; Y127-A131 WeakPolarHBondContact O-CB 3.5Å; Y127-A131 PolarHBondContact O-N 3.29Å; Y127-W211 HydrophobicContact CD2-CH2 4.4Å; Y127-W211 HydrophobicContact CE2-CH2 4.04Å
128W91.7Very high92.3Very high117 Ų11759.5 Ų59.544%0.44330%0.298SS..Hα-helixtrans-66.7-39.8178.6-72.1110.8000112S124 V125 A130 A131 I132S124-W128 PolarHBondContact O-N 3.35Å; V125-W128 PolarHBondContact O-N 2.92Å; W128-A130 VanDerWaalsContact C-N 3.34Å; W128-A131 PolarHBondContact O-N 3.18Å; W128-I132 WeakPolarHBondContact O-CB 3.39Å; W128-I132 WeakPolarHBondContact O-CD1 3.31Å; W128-I132 WeakPolarHBondContact O-CG1 3.44Å; W128-I132 PolarHBondContact O-N 3.48Å
129I94.2Very high92.3Very high99 Ų9962.8 Ų62.851%0.50832%0.318SS..Hα-helixtrans-57.6-50.1171.5-68.9169.2000109.7V125 E126 A131 I132 S133V125-I129 HydrophobicContact CG1-CD1 3.84Å; V125-I129 HydrophobicContact CG1-CG1 4.26Å; V125-I129 WeakPolarHBondContact O-CG1 3.49Å; V125-I129 PolarHBondContact O-N 3.49Å; E126-I129 PolarHBondContact O-N 3.23Å; I129-A131 PolarHBondContact O-N 2.88Å; I129-I132 PolarHBondContact O-N 3.39Å; I129-S133 WeakPolarHBondContact O-CB 3.47Å; I129-S133 PolarHBondContact O-N 2.7Å; I129-S133 PolarHBondContact O-OG 2.83Å
130A95Very high92.3Very high29 Ų2965.6 Ų65.624%0.2434%0.335CS..Hα-helixtrans-59.2-47.8179.400000112E126 Y127 W128 I132 S133 S134 Y231E126-A130 WeakPolarHBondContact O-CB 3.23Å; E126-A130 PolarHBondContact O-N 3.23Å; Y127-A130 PolarHBondContact O-N 3.5Å; W128-A130 VanDerWaalsContact C-N 3.34Å; A130-I132 PolarHBondContact O-N 2.94Å; A130-S133 PolarHBondContact O-N 3.23Å; A130-S134 WeakPolarHBondContact O-CB 3.17Å; A130-S134 PolarHBondContact O-N 3.34Å; A130-Y231 HydrophobicContact CB-CE2 3.76Å; A130-Y231 PolarHBondContact O-OH 2.6Å
131A94.7Very high92.4Very high2 Ų265.7 Ų65.72%0.01734%0.335CS..Hα-helixtrans-61.1-46.1179.300000112.1Y127 W128 I129 S134 W135 Y231Y127-A131 WeakPolarHBondContact O-CB 3.5Å; Y127-A131 PolarHBondContact O-N 3.29Å; W128-A131 PolarHBondContact O-N 3.18Å; I129-A131 PolarHBondContact O-N 2.88Å; A131-S134 WeakPolarHBondContact O-CB 3.3Å; A131-S134 PolarHBondContact O-N 2.96Å; A131-W135 HydrophobicContact CB-CH2 4.27Å; A131-W135 HydrophobicContact CB-CZ2 4.15Å; A131-W135 VanDerWaalsContact O-CD2 3.28Å; A131-W135 PolarHBondContact O-N 3.31Å; A131-Y231 WeakPolarHBondContact CA-OH 3.06Å; A131-Y231 PolarHBondContact N-OH 3.33Å
132I96.3Very high92.6Very high101 Ų10166.7 Ų66.752%0.51834%0.34SS..Hα-helixtrans-64.1-43.1177.4-68167.9000110.5W128 I129 A130 S134 W135 F136W128-I132 WeakPolarHBondContact O-CB 3.39Å; W128-I132 WeakPolarHBondContact O-CD1 3.31Å; W128-I132 WeakPolarHBondContact O-CG1 3.44Å; W128-I132 PolarHBondContact O-N 3.48Å; I129-I132 PolarHBondContact O-N 3.39Å; A130-I132 PolarHBondContact O-N 2.94Å; I132-S134 VanDerWaalsContact C-N 3.35Å; I132-S134 PolarHBondContact O-N 3.38Å; I132-W135 HydrophobicContact CG1-CE3 4.48Å; I132-W135 HydrophobicContact CG1-CZ3 4.47Å; I132-W135 PolarHBondContact O-N 3.16Å; I132-F136 VanDerWaalsContact O-CB 3.24Å; I132-F136 WeakPolarHBondContact O-CB 3.15Å; I132-F136 PolarHBondContact O-N 2.83Å
133S97.3Very high93.1Very high52 Ų5270.5 Ų70.536%0.36435%0.349SS..Hα-helixtrans-60.7-43175-64.20000112.1I129 A130 F136 E137I129-S133 WeakPolarHBondContact O-CB 3.47Å; I129-S133 PolarHBondContact O-N 2.7Å; I129-S133 PolarHBondContact O-OG 2.83Å; A130-S133 PolarHBondContact O-N 3.23Å; S133-F136 PolarHBondContact O-N 3.39Å; S133-E137 WeakPolarHBondContact O-CB 3.25Å; S133-E137 PolarHBondContact O-N 2.88Å
134S97.6Very high94Very high0 Ų074.8 Ų74.80%037%0.369CS..Hα-helixtrans-59.1-46.6175.4156.30000112A130 A131 I132 Y138 Q219 N224 C227A130-S134 WeakPolarHBondContact O-CB 3.17Å; A130-S134 PolarHBondContact O-N 3.34Å; A131-S134 WeakPolarHBondContact O-CB 3.3Å; A131-S134 PolarHBondContact O-N 2.96Å; I132-S134 VanDerWaalsContact C-N 3.35Å; I132-S134 PolarHBondContact O-N 3.38Å; S134-Y138 WeakPolarHBondContact O-CB 3.43Å; S134-Y138 PolarHBondContact O-N 2.86Å; S134-Q219 PolarHBondContact OG-NE2 3.08Å; S134-Q219 PolarHBondContact OG-OE1 2.74Å; S134-N224 PolarHBondContact O-ND2 3.4Å; S134-C227 VanDerWaalsContact CA-SG 3.6Å
135W96.7Very high94.3Very high107 Ų10777.7 Ų77.741%0.40537%0.374SS..Hα-helixtrans-69.5-38.7178.3-58.3-26.1000112.1Y91 A131 I132 Y138 V139Y91-W135 AromaticContact CE1-NE1 3.48Å; Y91-W135 AromaticContact CZ-NE1 3.57Å; Y91-W135 PolarHBondContact OH-NE1 2.95Å; Y91-W135 VanDerWaalsContact OH-NE1 3.13Å; A131-W135 HydrophobicContact CB-CH2 4.27Å; A131-W135 HydrophobicContact CB-CZ2 4.15Å; A131-W135 VanDerWaalsContact O-CD2 3.28Å; A131-W135 PolarHBondContact O-N 3.31Å; I132-W135 HydrophobicContact CG1-CE3 4.48Å; I132-W135 HydrophobicContact CG1-CZ3 4.47Å; I132-W135 PolarHBondContact O-N 3.16Å; W135-Y138 PolarHBondContact O-N 3.29Å; W135-V139 WeakPolarHBondContact O-CB 3.35Å; W135-V139 VanDerWaalsContact O-CG2 3.26Å; W135-V139 WeakPolarHBondContact O-CG2 3.22Å; W135-V139 PolarHBondContact O-N 2.68Å
136F97.3Very high94.3Very high144 Ų14475.4 Ų75.463%0.63236%0.361SS*.Hα-helixtrans-61.9-50.5176.7179.5-100.5000111.6I132 S133 Y138 V139 V140I132-F136 VanDerWaalsContact O-CB 3.24Å; I132-F136 WeakPolarHBondContact O-CB 3.15Å; I132-F136 PolarHBondContact O-N 2.83Å; S133-F136 PolarHBondContact O-N 3.39Å; F136-Y138 VanDerWaalsContact C-N 3.33Å; F136-Y138 PolarHBondContact O-N 3.41Å; F136-V139 PolarHBondContact O-N 3.08Å; F136-V140 HydrophobicContact CD1-CG2 4.3Å; F136-V140 HydrophobicContact CD2-CG2 4.3Å; F136-V140 HydrophobicContact CE1-CG2 3.93Å; F136-V140 HydrophobicContact CE2-CG2 3.92Å; F136-V140 HydrophobicContact CG-CG2 4.48Å; F136-V140 HydrophobicContact CZ-CG2 3.73Å; F136-V140 WeakPolarHBondContact O-CB 3.25Å; F136-V140 VanDerWaalsContact O-CG2 3.32Å; F136-V140 WeakPolarHBondContact O-CG2 3.2Å; F136-V140 PolarHBondContact O-N 3.19Å
137E97.5Very high94.3Very high17 Ų1774.9 Ų74.98%0.07936%0.362CS..Hα-helixtrans-56.8-47.6174.9178.5-179.6165.400111.2S133 V139 V140 E141 N224 P225 I226 C227S133-E137 WeakPolarHBondContact O-CB 3.25Å; S133-E137 PolarHBondContact O-N 2.88Å; E137-V139 VanDerWaalsContact C-N 3.34Å; E137-V139 PolarHBondContact O-N 3.17Å; E137-V140 PolarHBondContact O-N 3.49Å; E137-E141 HydrophobicContact CG-CG 4.44Å; E137-E141 WeakPolarHBondContact O-CB 3.41Å; E137-E141 WeakPolarHBondContact O-CG 3.24Å; E137-E141 PolarHBondContact O-N 3.37Å; E137-N224 HydrophobicContact CG-CB 4.37Å; E137-N224 WeakPolarHBondContact OE1-CA 3.2Å; E137-N224 WeakPolarHBondContact OE1-CB 3.42Å; E137-P225 WeakPolarHBondContact OE1-CD 3.46Å; E137-I226 PolarHBondContact OE1-N 3.34Å; E137-C227 PolarHBondContact OE1-N 3Å; E137-C227 WeakPolarHBondContact OE2-CA 3.49Å; E137-C227 WeakPolarHBondContact OE2-CB 2.99Å; E137-C227 PolarHBondContact OE2-N 3.26Å; E137-C227 PolarHBondContact OE2-SG 2.88Å
138Y96Very high94.4Very high30 Ų3075.3 Ų75.312%0.11837%0.373CS..Hα-helixtrans-57.1-48179.5178-93.9000111.9C87 V88 S134 W135 F136 L142 K149 L222 N224C87-Y138 PolarHBondContact SG-OH 2.71Å; C87-Y138 VanDerWaalsContact SG-OH 3.39Å; V88-Y138 HydrophobicContact CG2-CD1 4.24Å; V88-Y138 HydrophobicContact CG2-CE1 3.32Å; V88-Y138 HydrophobicContact CG2-CE2 4.13Å; V88-Y138 WeakPolarHBondContact CG2-OH 3.14Å; S134-Y138 WeakPolarHBondContact O-CB 3.43Å; S134-Y138 PolarHBondContact O-N 2.86Å; W135-Y138 PolarHBondContact O-N 3.29Å; F136-Y138 VanDerWaalsContact C-N 3.33Å; F136-Y138 PolarHBondContact O-N 3.41Å; Y138-L142 HydrophobicContact CE1-CD2 4.01Å; Y138-L142 VanDerWaalsContact O-CB 3.25Å; Y138-L142 WeakPolarHBondContact O-CB 3.19Å; Y138-L142 PolarHBondContact O-N 2.96Å; Y138-K149 HydrophobicContact CD2-CD 3.93Å; Y138-K149 HydrophobicContact CE2-CD 3.84Å; Y138-K149 HydrophobicContact CE2-CG 4.26Å; Y138-L222 HydrophobicContact CD2-CB 4.12Å; Y138-L222 HydrophobicContact CD2-CD2 3.95Å; Y138-L222 HydrophobicContact CE2-CD2 4.15Å; Y138-L222 HydrophobicContact CG-CD2 4.48Å; Y138-N224 WeakPolarHBondContact CA-OD1 3.47Å
139V95.1Very high94.3Very high69 Ų6970.3 Ų70.342%0.41836%0.355SS..Hα-helixtrans-65.8-48.1-178.8171.20000111W135 F136 E137 E141 L142 Y143W135-V139 WeakPolarHBondContact O-CB 3.35Å; W135-V139 VanDerWaalsContact O-CG2 3.26Å; W135-V139 WeakPolarHBondContact O-CG2 3.22Å; W135-V139 PolarHBondContact O-N 2.68Å; F136-V139 PolarHBondContact O-N 3.08Å; E137-V139 VanDerWaalsContact C-N 3.34Å; E137-V139 PolarHBondContact O-N 3.17Å; V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 3.47Å; V139-L142 PolarHBondContact O-N 3.21Å; V139-Y143 HydrophobicContact CG1-CD2 3.88Å; V139-Y143 HydrophobicContact CG1-CE2 3.62Å; V139-Y143 WeakPolarHBondContact O-CD2 3.39Å; V139-Y143 PolarHBondContact O-N 3.25Å
140V95.5Very high94Very high61 Ų6172 Ų7237%0.3736%0.355SS..Hα-helixtrans-58-48.2179.4169.30000110.8F136 E137 Y143 Q144F136-V140 HydrophobicContact CD1-CG2 4.3Å; F136-V140 HydrophobicContact CD2-CG2 4.3Å; F136-V140 HydrophobicContact CE1-CG2 3.93Å; F136-V140 HydrophobicContact CE2-CG2 3.92Å; F136-V140 HydrophobicContact CG-CG2 4.48Å; F136-V140 HydrophobicContact CZ-CG2 3.73Å; F136-V140 WeakPolarHBondContact O-CB 3.25Å; F136-V140 VanDerWaalsContact O-CG2 3.32Å; F136-V140 WeakPolarHBondContact O-CG2 3.2Å; F136-V140 PolarHBondContact O-N 3.19Å; E137-V140 PolarHBondContact O-N 3.49Å; V140-Y143 PolarHBondContact O-N 3.38Å; V140-Q144 HydrophobicContact CG1-CG 4.38Å; V140-Q144 WeakPolarHBondContact O-CB 3.42Å; V140-Q144 WeakPolarHBondContact O-CG 3.43Å; V140-Q144 PolarHBondContact O-N 3.19Å
141E94.5Very high93.9Very high26 Ų2674.6 Ų74.612%0.12136%0.362CS..Hα-helixtrans-71.9-29.1180-71-171.6173.800113.1E137 V139 Y143 F145 K149E137-E141 HydrophobicContact CG-CG 4.44Å; E137-E141 WeakPolarHBondContact O-CB 3.41Å; E137-E141 WeakPolarHBondContact O-CG 3.24Å; E137-E141 PolarHBondContact O-N 3.37Å; V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 3.47Å; E141-Y143 VanDerWaalsContact C-N 3.25Å; E141-Y143 PolarHBondContact O-N 2.97Å; E141-F145 HydrophobicContact CG-CD2 4.29Å; E141-F145 CarbonylContact O-C 3.04Å; E141-F145 VanDerWaalsContact O-CA 3.23Å; E141-F145 WeakPolarHBondContact O-CA 3.31Å; E141-F145 PolarHBondContact O-N 2.95Å; E141-K149 WeakPolarHBondContact OE2-CE 3.49Å; E141-K149 IonicContact OE2-NZ 2.63Å; E141-K149 PolarHBondContact OE2-NZ 3.47Å
142L92.3Very high93.8Very high73 Ų7376.6 Ų76.638%0.38238%0.375SS..Hα-helixtrans-61.4-37.6172.9-177.565.4000111.4Y138 V139 K149Y138-L142 HydrophobicContact CE1-CD2 4.01Å; Y138-L142 VanDerWaalsContact O-CB 3.25Å; Y138-L142 WeakPolarHBondContact O-CB 3.19Å; Y138-L142 PolarHBondContact O-N 2.96Å; V139-L142 PolarHBondContact O-N 3.21Å; L142-K149 HydrophobicContact CB-CG 4.49Å; L142-K149 HydrophobicContact CD1-CB 4.31Å; L142-K149 HydrophobicContact CD1-CG 4.39Å
143Y92.9Very high93.8Very high181 Ų18178.1 Ų78.171%0.7138%0.383SS*.Hα-helixtrans-77.7-44176.9-75.1-69.3000113V139 V140 E141V139-Y143 HydrophobicContact CG1-CD2 3.88Å; V139-Y143 HydrophobicContact CG1-CE2 3.62Å; V139-Y143 WeakPolarHBondContact O-CD2 3.39Å; V139-Y143 PolarHBondContact O-N 3.25Å; V140-Y143 PolarHBondContact O-N 3.38Å; E141-Y143 VanDerWaalsContact C-N 3.25Å; E141-Y143 PolarHBondContact O-N 2.97Å
144Q93.8Very high93.7Very high134 Ų13479.2 Ų79.263%0.62638%0.384SS*.Hα-helixtrans-85.4-35.7-173.7-62.9-62.2-5300113V140V140-Q144 HydrophobicContact CG1-CG 4.38Å; V140-Q144 WeakPolarHBondContact O-CB 3.42Å; V140-Q144 WeakPolarHBondContact O-CG 3.43Å; V140-Q144 PolarHBondContact O-N 3.19Å
145F93.1Very high93.7Very high125 Ų12579.4 Ų79.455%0.54839%0.385SS..  trans-13659.6-171.5-51-70.2000111.6E141 N147 A148E141-F145 HydrophobicContact CG-CD2 4.29Å; E141-F145 CarbonylContact O-C 3.04Å; E141-F145 VanDerWaalsContact O-CA 3.23Å; E141-F145 WeakPolarHBondContact O-CA 3.31Å; E141-F145 PolarHBondContact O-N 2.95Å; F145-N147 PolarHBondContact O-N 3.27Å; F145-A148 HydrophobicContact CB-CB 3.93Å; F145-A148 VanDerWaalsContact O-CB 3.3Å; F145-A148 WeakPolarHBondContact O-CB 3.3Å; F145-A148 PolarHBondContact O-N 2.93Å
146P89.8Confident93.6Very high53 Ų5379.2 Ų79.234%0.34439%0.385SS..THydrogen-bonded Turntrans-57-31.5-174.421.9-33.9000113.2A148 K149 R150P146-A148 VanDerWaalsContact C-N 3.32Å; P146-A148 PolarHBondContact O-N 2.99Å; P146-K149 PolarHBondContact O-N 3.31Å; P146-R150 WeakPolarHBondContact O-CG 3.43Å; P146-R150 PolarHBondContact O-N 2.7Å
147N91Very high93.7Very high115 Ų11575.8 Ų75.862%0.61538%0.376SS*.THydrogen-bonded Turntrans-67.7-29.4176.7-67.5-27.5000113F145 K149 R150 Q151F145-N147 PolarHBondContact O-N 3.27Å; N147-K149 PolarHBondContact O-N 2.9Å; N147-R150 PolarHBondContact O-N 3.46Å; N147-Q151 PolarHBondContact O-NE2 3.48Å
148A90.5Very high93.7Very high46 Ų4675 Ų7538%0.3837%0.372SS..THydrogen-bonded Turntrans-68-27.1175.500000111.9F145 P146 Q151F145-A148 HydrophobicContact CB-CB 3.93Å; F145-A148 VanDerWaalsContact O-CB 3.3Å; F145-A148 WeakPolarHBondContact O-CB 3.3Å; F145-A148 PolarHBondContact O-N 2.93Å; P146-A148 VanDerWaalsContact C-N 3.32Å; P146-A148 PolarHBondContact O-N 2.99Å; A148-Q151 VanDerWaalsContact O-CG 3.26Å; A148-Q151 WeakPolarHBondContact O-CG 3.39Å
149K89.7Confident93.8Very high12 Ų1275.1 Ų75.15%0.05238%0.375CS..THydrogen-bonded Turntrans-85.7-9.6174.4-60.8-56.6-180-167.80114.3Y138 E141 L142 P146 N147 Q151 L222 C223 N224Y138-K149 HydrophobicContact CD2-CD 3.93Å; Y138-K149 HydrophobicContact CE2-CD 3.84Å; Y138-K149 HydrophobicContact CE2-CG 4.26Å; E141-K149 WeakPolarHBondContact OE2-CE 3.49Å; E141-K149 IonicContact OE2-NZ 2.63Å; E141-K149 PolarHBondContact OE2-NZ 3.47Å; L142-K149 HydrophobicContact CB-CG 4.49Å; L142-K149 HydrophobicContact CD1-CB 4.31Å; L142-K149 HydrophobicContact CD1-CG 4.39Å; P146-K149 PolarHBondContact O-N 3.31Å; N147-K149 PolarHBondContact O-N 2.9Å; K149-Q151 VanDerWaalsContact C-N 3.35Å; K149-Q151 PolarHBondContact O-N 3.42Å; K149-L222 WeakPolarHBondContact CD-O 3.46Å; K149-L222 PolarHBondContact NZ-O 3.33Å; K149-C223 HydrophobicContact CD-CB 4.18Å; K149-C223 PolarHBondContact NZ-O 3.23Å; K149-N224 PolarHBondContact NZ-OD1 3.42Å
150R87.5Confident94Very high136 Ų13674 Ų7451%0.51337%0.373SS..  trans-97.950.9179.4-65.5-177.9-179.1-175.8-0.5111.8Q84 P146 N147 P152Q84-R150 HydrophobicContact CG-CG 4.44Å; Q84-R150 VanDerWaalsContact NE2-CG 3.3Å; Q84-R150 VanDerWaalsContact NE2-NE 3.17Å; P146-R150 WeakPolarHBondContact O-CG 3.43Å; P146-R150 PolarHBondContact O-N 2.7Å; N147-R150 PolarHBondContact O-N 3.46Å; R150-P152 VanDerWaalsContact O-CD 3.27Å; R150-P152 WeakPolarHBondContact O-CD 3.41Å
151Q93.3Very high94.1Very high83 Ų8373.5 Ų73.539%0.38837%0.368SS..  trans-114.781.3-175.5-61.1-59.9-36.300110.6N147 A148 K149 L153 I154 T155N147-Q151 PolarHBondContact O-NE2 3.48Å; A148-Q151 VanDerWaalsContact O-CG 3.26Å; A148-Q151 WeakPolarHBondContact O-CG 3.39Å; K149-Q151 VanDerWaalsContact C-N 3.35Å; K149-Q151 PolarHBondContact O-N 3.42Å; Q151-L153 VanDerWaalsContact C-N 3.29Å; Q151-L153 PolarHBondContact O-N 3.34Å; Q151-I154 HydrophobicContact CB-CB 4Å; Q151-I154 HydrophobicContact CB-CD1 3.75Å; Q151-I154 HydrophobicContact CB-CG1 3.93Å; Q151-I154 HydrophobicContact CG-CD1 4.08Å; Q151-I154 PolarHBondContact O-N 2.83Å; Q151-I154 VanDerWaalsContact O-N 3.1Å; Q151-T155 PolarHBondContact O-N 2.94Å; Q151-T155 PolarHBondContact O-OG1 3.41Å
152P93.1Very high94.3Very high44 Ų4472.3 Ų72.329%0.28636%0.362SS..Hα-helixtrans-58.3-38.5-172.423.2-35.1000112.9R83 R150 I154 T155 Y156R83-P152 WeakPolarHBondContact O-CG 3.24Å; R150-P152 VanDerWaalsContact O-CD 3.27Å; R150-P152 WeakPolarHBondContact O-CD 3.41Å; P152-I154 PolarHBondContact O-N 3.3Å; P152-T155 PolarHBondContact O-N 3.35Å; P152-Y156 HydrophobicContact CB-CD2 4.46Å; P152-Y156 HydrophobicContact CB-CE2 4.29Å; P152-Y156 WeakPolarHBondContact O-CB 3.39Å; P152-Y156 WeakPolarHBondContact O-CD2 3.43Å; P152-Y156 PolarHBondContact O-N 2.95Å
153L94.9Very high94.6Very high132 Ų13273.1 Ų73.169%0.69137%0.367SS*.Hα-helixtrans-61.5-45.8178.1-179.861.6000111.5Q151 Y156 V157Q151-L153 VanDerWaalsContact C-N 3.29Å; Q151-L153 PolarHBondContact O-N 3.34Å; L153-Y156 PolarHBondContact O-N 2.96Å; L153-V157 HydrophobicContact CD1-CG2 4.47Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.43Å
154I96.4Very high94.9Very high76 Ų7669 Ų6939%0.3936%0.356SS..Hα-helixtrans-64-45.6178.5-58-178.8000109.6Q151 P152 Y156 V157 G158 V220Q151-I154 HydrophobicContact CB-CB 4Å; Q151-I154 HydrophobicContact CB-CD1 3.75Å; Q151-I154 HydrophobicContact CB-CG1 3.93Å; Q151-I154 HydrophobicContact CG-CD1 4.08Å; Q151-I154 PolarHBondContact O-N 2.83Å; Q151-I154 VanDerWaalsContact O-N 3.1Å; P152-I154 PolarHBondContact O-N 3.3Å; I154-Y156 VanDerWaalsContact C-N 3.32Å; I154-Y156 PolarHBondContact O-N 3.01Å; I154-V157 PolarHBondContact O-N 3.33Å; I154-G158 PolarHBondContact O-N 3.44Å; I154-V220 HydrophobicContact CG2-CG1 3.93Å; I154-V220 WeakPolarHBondContact CG2-O 3.46Å
155T96.1Very high95.2Very high3 Ų362.6 Ų62.62%0.01833%0.326CS..Hα-helixtrans-57.2-43.6175.7-60.40000112.1P85 C87 L90 Q151 P152 G158 L159 L221P85-T155 HydrophobicContact CG-CG2 4.06Å; C87-T155 HydrophobicContact CB-CG2 4.06Å; L90-T155 HydrophobicContact CD1-CG2 3.85Å; Q151-T155 PolarHBondContact O-N 2.94Å; Q151-T155 PolarHBondContact O-OG1 3.41Å; P152-T155 PolarHBondContact O-N 3.35Å; T155-G158 PolarHBondContact O-N 2.92Å; T155-L159 WeakPolarHBondContact O-CB 3.12Å; T155-L159 PolarHBondContact O-N 2.87Å; T155-L221 HydrophobicContact CG2-CD2 4.44Å; T155-L221 HydrophobicContact CG2-CG 4.24Å; T155-L221 PolarHBondContact OG1-O 2.94Å
156Y96.2Very high95.4Very high103 Ų10357.4 Ų57.440%0.40430%0.303SS..Hα-helixtrans-71.3-35178.5-72.8-50.9000113.5W82 P85 P152 L153 I154 G158 L159 A160W82-Y156 PolarHBondContact O-OH 3.49Å; W82-Y156 VanDerWaalsContact O-OH 3.1Å; P85-Y156 HydrophobicContact CG-CE1 4.3Å; P85-Y156 HydrophobicContact CG-CE2 4.22Å; P152-Y156 HydrophobicContact CB-CD2 4.46Å; P152-Y156 HydrophobicContact CB-CE2 4.29Å; P152-Y156 WeakPolarHBondContact O-CB 3.39Å; P152-Y156 WeakPolarHBondContact O-CD2 3.43Å; P152-Y156 PolarHBondContact O-N 2.95Å; L153-Y156 PolarHBondContact O-N 2.96Å; I154-Y156 VanDerWaalsContact C-N 3.32Å; I154-Y156 PolarHBondContact O-N 3.01Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; Y156-L159 HydrophobicContact CD1-CD2 4.29Å; Y156-L159 PolarHBondContact O-N 3.31Å; Y156-A160 WeakPolarHBondContact O-CB 3.44Å; Y156-A160 PolarHBondContact O-N 3.35Å
157V98Very high95.8Very high73 Ų7360.5 Ų60.544%0.44232%0.316SS..Hα-helixtrans-61.9-45.6170.8169.50000110.1L153 I154 L159 A160 L161 V220L153-V157 HydrophobicContact CD1-CG2 4.47Å; L153-V157 VanDerWaalsContact O-CG2 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.47Å; L153-V157 PolarHBondContact O-N 3.43Å; I154-V157 PolarHBondContact O-N 3.33Å; V157-L159 PolarHBondContact O-N 2.67Å; V157-A160 PolarHBondContact O-N 3.3Å; V157-L161 HydrophobicContact CG1-CD1 4.43Å; V157-L161 WeakPolarHBondContact O-CG 3.39Å; V157-L161 PolarHBondContact O-N 3.18Å; V157-V220 HydrophobicContact CG1-CG1 4.33Å
158G98.5Very high96.2Very high0 Ų056.6 Ų56.60%030%0.295CS..Hα-helixtrans-59.5-45.1174.600000112.5I154 T155 Y156 A160 L161 V162 G217I154-G158 PolarHBondContact O-N 3.44Å; T155-G158 PolarHBondContact O-N 2.92Å; Y156-G158 VanDerWaalsContact C-N 3.34Å; G158-A160 VanDerWaalsContact C-N 3.34Å; G158-A160 PolarHBondContact O-N 2.83Å; G158-L161 PolarHBondContact O-N 3.42Å; G158-V162 VanDerWaalsContact O-CG2 3.32Å; G158-V162 WeakPolarHBondContact O-CG2 3.3Å; G158-V162 PolarHBondContact O-N 2.91Å; G158-G217 WeakPolarHBondContact CA-O 3.49Å
159L98.1Very high96.5Very high33 Ų3355.4 Ų55.417%0.17328%0.28CS..Hα-helixtrans-59.4-42.8174.7-17862.1000112L90 V94 T155 Y156 V157 V162 L163 L221L90-L159 HydrophobicContact CD1-CD2 4.38Å; L90-L159 HydrophobicContact CD2-CD2 4.41Å; V94-L159 HydrophobicContact CG1-CD1 3.87Å; T155-L159 WeakPolarHBondContact O-CB 3.12Å; T155-L159 PolarHBondContact O-N 2.87Å; Y156-L159 HydrophobicContact CD1-CD2 4.29Å; Y156-L159 PolarHBondContact O-N 3.31Å; V157-L159 PolarHBondContact O-N 2.67Å; L159-V162 PolarHBondContact O-N 3.47Å; L159-L163 HydrophobicContact CD1-CD1 4.42Å; L159-L163 HydrophobicContact CD1-CG 4.3Å; L159-L163 HydrophobicContact CG-CD1 4.18Å; L159-L163 HydrophobicContact CG-CG 4.46Å; L159-L163 VanDerWaalsContact O-CG 3.3Å; L159-L163 WeakPolarHBondContact O-CG 3.12Å; L159-L163 PolarHBondContact O-N 3.24Å; L159-L221 HydrophobicContact CB-CD1 4.27Å; L159-L221 HydrophobicContact CD1-CD1 4.2Å
160A98.6Very high96.9Very high45 Ų4556 Ų5637%0.37228%0.283SS..Hα-helixtrans-61.8-44.5176.600000111.8Y156 V157 G158 V162 L163 I164Y156-A160 WeakPolarHBondContact O-CB 3.44Å; Y156-A160 PolarHBondContact O-N 3.35Å; V157-A160 PolarHBondContact O-N 3.3Å; G158-A160 VanDerWaalsContact C-N 3.34Å; G158-A160 PolarHBondContact O-N 2.83Å; A160-V162 VanDerWaalsContact C-N 3.33Å; A160-V162 PolarHBondContact O-N 3.28Å; A160-L163 PolarHBondContact O-N 2.86Å; A160-I164 WeakPolarHBondContact O-CB 3.49Å; A160-I164 WeakPolarHBondContact O-CD1 3.14Å; A160-I164 VanDerWaalsContact O-CG1 3.23Å; A160-I164 WeakPolarHBondContact O-CG1 3.37Å; A160-I164 PolarHBondContact O-N 3.02Å
161L98.7Very high97.4Very high50 Ų5050.8 Ų50.826%0.26227%0.269SS..Hα-helixtrans-59.6-43.6175.2-68.6173.4000111.9V157 G158 I164 G165 L213 V220V157-L161 HydrophobicContact CG1-CD1 4.43Å; V157-L161 WeakPolarHBondContact O-CG 3.39Å; V157-L161 PolarHBondContact O-N 3.18Å; G158-L161 PolarHBondContact O-N 3.42Å; L161-I164 PolarHBondContact O-N 3.22Å; L161-G165 PolarHBondContact O-N 2.71Å; L161-L213 HydrophobicContact CD2-CD2 4.1Å; L161-V220 HydrophobicContact CD1-CG2 4.28Å
162V98.7Very high97.6Very high2 Ų246.8 Ų46.81%0.01225%0.25CS..Hα-helixtrans-60.4-47.7176.3168.80000111.5V94 G158 L159 A160 G165 E166 T218 L221V94-V162 HydrophobicContact CB-CG1 3.63Å; V94-V162 HydrophobicContact CG1-CG1 3.77Å; V94-V162 HydrophobicContact CG2-CG1 3.95Å; G158-V162 VanDerWaalsContact O-CG2 3.32Å; G158-V162 WeakPolarHBondContact O-CG2 3.3Å; G158-V162 PolarHBondContact O-N 2.91Å; L159-V162 PolarHBondContact O-N 3.47Å; A160-V162 VanDerWaalsContact C-N 3.33Å; A160-V162 PolarHBondContact O-N 3.28Å; V162-G165 PolarHBondContact O-N 3.09Å; V162-E166 VanDerWaalsContact O-CB 3.24Å; V162-E166 WeakPolarHBondContact O-CB 3.3Å; V162-E166 PolarHBondContact O-N 2.87Å; V162-T218 HydrophobicContact CG2-CG2 4.05Å; V162-L221 HydrophobicContact CG2-CD1 4.49Å
163L98.7Very high97.8Very high90 Ų9044.7 Ų44.747%0.47124%0.236SC..Hα-helixtrans-65.3-42.7-179.9-68.5175.3000111.9L159 A160 E166 I167L159-L163 HydrophobicContact CD1-CD1 4.42Å; L159-L163 HydrophobicContact CD1-CG 4.3Å; L159-L163 HydrophobicContact CG-CD1 4.18Å; L159-L163 HydrophobicContact CG-CG 4.46Å; L159-L163 VanDerWaalsContact O-CG 3.3Å; L159-L163 WeakPolarHBondContact O-CG 3.12Å; L159-L163 PolarHBondContact O-N 3.24Å; A160-L163 PolarHBondContact O-N 2.86Å; L163-E166 PolarHBondContact O-N 2.99Å; L163-I167 WeakPolarHBondContact O-CB 3.26Å; L163-I167 WeakPolarHBondContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.3Å; L163-I167 PolarHBondContact O-N 3.25Å
164I98.6Very high97.9Very high94 Ų9441.5 Ų41.548%0.48222%0.222SC..Hα-helixtrans-62.4-45.8175.7-66.7164.8000110.1A160 L161 E166 I167 L168 L213A160-I164 WeakPolarHBondContact O-CB 3.49Å; A160-I164 WeakPolarHBondContact O-CD1 3.14Å; A160-I164 VanDerWaalsContact O-CG1 3.23Å; A160-I164 WeakPolarHBondContact O-CG1 3.37Å; A160-I164 PolarHBondContact O-N 3.02Å; L161-I164 PolarHBondContact O-N 3.22Å; I164-E166 PolarHBondContact O-N 3.48Å; I164-I167 PolarHBondContact O-N 3.48Å; I164-L168 WeakPolarHBondContact O-CB 3.41Å; I164-L168 PolarHBondContact O-N 3.37Å; I164-L213 HydrophobicContact CG2-CD1 3.9Å
165G98.7Very high97.9Very high0 Ų040.8 Ų40.80%022%0.219CC..Hα-helixtrans-61.8-43.3178.900000112.6L161 V162 L168 R169 G210L161-G165 PolarHBondContact O-N 2.71Å; V162-G165 PolarHBondContact O-N 3.09Å; G165-L168 PolarHBondContact O-N 3.11Å; G165-R169 VanDerWaalsContact O-CB 3.31Å; G165-R169 WeakPolarHBondContact O-CB 3.25Å; G165-R169 PolarHBondContact O-N 3.44Å; G165-G210 CarbonylContact C-O 2.86Å; G165-G210 VanDerWaalsContact CA-O 3.25Å; G165-G210 WeakPolarHBondContact CA-O 3.39Å; G165-G210 CarbonylContact O-C 3.59Å; G165-G210 WeakPolarHBondContact O-CA 3.39Å
166E98.5Very high97.8Very high15 Ų1541.1 Ų41.17%0.0722%0.222CC..Hα-helixtrans-62-48.8176.5179.365.1173.900111.7F97 F98 S101 V162 L163 I164 L168 R169 K170F97-E166 HydrophobicContact CE1-CG 4.28Å; F97-E166 WeakPolarHBondContact CE1-OE1 3.39Å; F98-E166 WeakPolarHBondContact CD2-OE2 3.44Å; S101-E166 WeakPolarHBondContact CB-OE1 3.3Å; S101-E166 PolarHBondContact OG-OE1 2.94Å; V162-E166 VanDerWaalsContact O-CB 3.24Å; V162-E166 WeakPolarHBondContact O-CB 3.3Å; V162-E166 PolarHBondContact O-N 2.87Å; L163-E166 PolarHBondContact O-N 2.99Å; I164-E166 PolarHBondContact O-N 3.48Å; E166-L168 PolarHBondContact O-N 3.31Å; E166-R169 PolarHBondContact O-N 3.37Å; E166-K170 VanDerWaalsContact CD-NZ 3.28Å; E166-K170 WeakPolarHBondContact O-CD 3.25Å; E166-K170 PolarHBondContact O-N 3.45Å; E166-K170 WeakPolarHBondContact OE1-CE 3.36Å; E166-K170 IonicContact OE1-NZ 2.89Å; E166-K170 PolarHBondContact OE1-NZ 3.36Å; E166-K170 IonicContact OE2-NZ 2.86Å; E166-K170 PolarHBondContact OE2-NZ 3.37Å
167I98.5Very high97.6Very high119 Ų11937 Ų3761%0.6121%0.21SC*.Hα-helixtrans-60.6-48.5177.9-70.1164.4000110.7L163 I164 R169 K170 A171L163-I167 WeakPolarHBondContact O-CB 3.26Å; L163-I167 WeakPolarHBondContact O-CD1 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.3Å; L163-I167 PolarHBondContact O-N 3.25Å; I164-I167 PolarHBondContact O-N 3.48Å; I167-R169 VanDerWaalsContact C-N 3.3Å; I167-R169 PolarHBondContact O-N 3.05Å; I167-K170 PolarHBondContact O-N 3.5Å; I167-A171 VanDerWaalsContact O-CB 3.25Å; I167-A171 WeakPolarHBondContact O-CB 3.29Å; I167-A171 PolarHBondContact O-N 2.88Å
168L98.2Very high97.3Very high33 Ų3336 Ų3617%0.17320%0.203CC..Hα-helixtrans-63.3-39.1-177.7-174.162.4000111.5I164 G165 E166 A172 V199 P206 T209I164-L168 WeakPolarHBondContact O-CB 3.41Å; I164-L168 PolarHBondContact O-N 3.37Å; G165-L168 PolarHBondContact O-N 3.11Å; E166-L168 PolarHBondContact O-N 3.31Å; L168-A172 PolarHBondContact O-N 3.38Å; L168-V199 HydrophobicContact CD1-CB 4.27Å; L168-V199 HydrophobicContact CD1-CG1 4.11Å; L168-P206 HydrophobicContact CD1-CB 3.81Å; L168-P206 HydrophobicContact CG-CB 4.01Å; L168-P206 WeakPolarHBondContact CG-O 3.44Å; L168-T209 HydrophobicContact CD2-CG2 3.53Å
169R97.8Very high96.9Very high20 Ų2037.2 Ų37.28%0.07521%0.211CC..Hα-helixtrans-65.3-46.1176.4-172.7176.3-179.8110-3.1112E102 L120 G165 E166 I167 A172 I173E102-R169 IonicContact OE1-CZ 2.63Å; E102-R169 IonicContact OE1-NE 3.44Å; E102-R169 PolarHBondContact OE1-NE 3.18Å; E102-R169 IonicContact OE1-NH2 2.8Å; E102-R169 PolarHBondContact OE1-NH2 3.35Å; E102-R169 WeakPolarHBondContact OE2-CD 3.42Å; E102-R169 IonicContact OE2-CZ 3.96Å; E102-R169 IonicContact OE2-NE 3.13Å; E102-R169 PolarHBondContact OE2-NE 2.95Å; L120-R169 VanDerWaalsContact CD1-NH2 3.3Å; G165-R169 VanDerWaalsContact O-CB 3.31Å; G165-R169 WeakPolarHBondContact O-CB 3.25Å; G165-R169 PolarHBondContact O-N 3.44Å; E166-R169 PolarHBondContact O-N 3.37Å; I167-R169 VanDerWaalsContact C-N 3.3Å; I167-R169 PolarHBondContact O-N 3.05Å; R169-A172 VanDerWaalsContact O-CB 3.3Å; R169-A172 WeakPolarHBondContact O-CB 3.05Å; R169-A172 PolarHBondContact O-N 2.89Å; R169-I173 PolarHBondContact O-N 3.24Å
170K98.2Very high96.5Very high26 Ų2636.3 Ų36.311%0.11321%0.206CC..Hα-helixtrans-69.3-36.6179.4-8758.6179.2-177.40111.8F98 S101 E102 S105 E166 I167 A172 I173 V174F98-K170 PolarHBondContact O-NZ 3.3Å; S101-K170 WeakPolarHBondContact OG-CE 3.2Å; S101-K170 PolarHBondContact OG-NZ 2.89Å; E102-K170 IonicContact OE2-NZ 2.9Å; E102-K170 PolarHBondContact OE2-NZ 3.42Å; S105-K170 WeakPolarHBondContact OG-CG 3.42Å; E166-K170 VanDerWaalsContact CD-NZ 3.28Å; E166-K170 WeakPolarHBondContact O-CD 3.25Å; E166-K170 PolarHBondContact O-N 3.45Å; E166-K170 WeakPolarHBondContact OE1-CE 3.36Å; E166-K170 IonicContact OE1-NZ 2.89Å; E166-K170 PolarHBondContact OE1-NZ 3.36Å; E166-K170 IonicContact OE2-NZ 2.86Å; E166-K170 PolarHBondContact OE2-NZ 3.37Å; I167-K170 PolarHBondContact O-N 3.5Å; K170-A172 VanDerWaalsContact C-N 3.27Å; K170-A172 PolarHBondContact O-N 2.95Å; K170-I173 PolarHBondContact O-N 2.84Å; K170-V174 VanDerWaalsContact O-CG2 3.31Å; K170-V174 WeakPolarHBondContact O-CG2 3.34Å; K170-V174 PolarHBondContact O-N 2.81Å
171A98.2Very high96Very high25 Ų2536.1 Ų36.121%0.20720%0.2CC..Hα-helixtrans-62.5-34.3171.900000112.4I167 N175 V199I167-A171 VanDerWaalsContact O-CB 3.25Å; I167-A171 WeakPolarHBondContact O-CB 3.29Å; I167-A171 PolarHBondContact O-N 2.88Å; A171-N175 VanDerWaalsContact O-CB 3.3Å; A171-N175 WeakPolarHBondContact O-CB 3.49Å; A171-N175 PolarHBondContact O-N 2.97Å; A171-N175 PolarHBondContact O-OD1 3.4Å; A171-V199 HydrophobicContact CB-CG1 3.57Å; A171-V199 HydrophobicContact CB-CG2 4.24Å
172A97.8Very high95.5Very high0 Ų035.6 Ų35.60%020%0.196CC..Hα-helixtrans-62.8-46.1172.400000111.8L168 R169 K170 N175 A176 P206L168-A172 PolarHBondContact O-N 3.38Å; R169-A172 VanDerWaalsContact O-CB 3.3Å; R169-A172 WeakPolarHBondContact O-CB 3.05Å; R169-A172 PolarHBondContact O-N 2.89Å; K170-A172 VanDerWaalsContact C-N 3.27Å; K170-A172 PolarHBondContact O-N 2.95Å; A172-N175 PolarHBondContact O-N 3.49Å; A172-A176 VanDerWaalsContact O-CB 3.26Å; A172-A176 WeakPolarHBondContact O-CB 3.47Å; A172-A176 PolarHBondContact O-N 3.1Å; A172-P206 HydrophobicContact CB-CB 4Å; A172-P206 HydrophobicContact CB-CG 3.69Å
173I97.1Very high94.8Very high0 Ų041.6 Ų41.60%023%0.228CC..Hα-helixtrans-60.7-49.9177.3-65.4168000110.4I106 F109 R169 K170 N175 A176 G177 F180I106-I173 HydrophobicContact CD1-CD1 4.07Å; I106-I173 HydrophobicContact CD1-CG1 4.21Å; I106-I173 HydrophobicContact CD1-CG2 3.94Å; I106-I173 HydrophobicContact CG1-CD1 4.47Å; F109-I173 HydrophobicContact CB-CG2 4.22Å; R169-I173 PolarHBondContact O-N 3.24Å; K170-I173 PolarHBondContact O-N 2.84Å; I173-N175 PolarHBondContact O-N 3.37Å; I173-A176 PolarHBondContact O-N 3.11Å; I173-G177 PolarHBondContact O-N 3.29Å; I173-F180 HydrophobicContact CD1-CE1 4.28Å; I173-F180 HydrophobicContact CD1-CZ 4.28Å; I173-F180 HydrophobicContact CG1-CD1 3.99Å; I173-F180 HydrophobicContact CG1-CD2 3.99Å; I173-F180 HydrophobicContact CG1-CE1 3.76Å; I173-F180 HydrophobicContact CG1-CE2 3.75Å; I173-F180 HydrophobicContact CG1-CG 4.1Å; I173-F180 HydrophobicContact CG1-CZ 3.63Å
174V96.9Very high94Very high65 Ų6538.5 Ų38.539%0.39421%0.212SC..Hα-helixtrans-59.5-45.9179.9172.20000111.5F109 K170F109-V174 HydrophobicContact CD1-CG1 4.46Å; F109-V174 HydrophobicContact CD1-CG2 4.28Å; F109-V174 HydrophobicContact CD2-CG2 3.68Å; F109-V174 HydrophobicContact CE1-CG1 4.36Å; F109-V174 HydrophobicContact CE1-CG2 4.22Å; F109-V174 HydrophobicContact CE2-CG2 3.62Å; F109-V174 HydrophobicContact CG-CG2 4.03Å; F109-V174 HydrophobicContact CZ-CG2 3.9Å; K170-V174 VanDerWaalsContact O-CG2 3.31Å; K170-V174 WeakPolarHBondContact O-CG2 3.34Å; K170-V174 PolarHBondContact O-N 2.81Å
175N96.1Very high93.1Very high61 Ų6135.5 Ų35.533%0.32620%0.2SC..Hα-helixtrans-73.7-33-176.7-76.627.5000113.4A171 A172 I173 N197 G198 V199 Y200A171-N175 VanDerWaalsContact O-CB 3.3Å; A171-N175 WeakPolarHBondContact O-CB 3.49Å; A171-N175 PolarHBondContact O-N 2.97Å; A171-N175 PolarHBondContact O-OD1 3.4Å; A172-N175 PolarHBondContact O-N 3.49Å; I173-N175 PolarHBondContact O-N 3.37Å; N175-N197 PolarHBondContact ND2-O 2.77Å; N175-G198 VanDerWaalsContact ND2-CA 3.28Å; N175-G198 WeakPolarHBondContact ND2-CA 3.18Å; N175-V199 HydrophobicContact CB-CG2 4.23Å; N175-V199 PolarHBondContact ND2-N 3.13Å; N175-Y200 HydrophobicContact CB-CD2 4.02Å; N175-Y200 HydrophobicContact CB-CE2 4.05Å
176A94.1Very high92.3Very high10 Ų1042.2 Ų42.28%0.08323%0.229CC..Hα-helixtrans-81.7-28177.800000112.7A172 I173 D178 C179 F180 Y200A172-A176 VanDerWaalsContact O-CB 3.26Å; A172-A176 WeakPolarHBondContact O-CB 3.47Å; A172-A176 PolarHBondContact O-N 3.1Å; I173-A176 PolarHBondContact O-N 3.11Å; A176-D178 PolarHBondContact O-N 3.38Å; A176-C179 VanDerWaalsContact O-CB 3.32Å; A176-C179 WeakPolarHBondContact O-CB 3.32Å; A176-C179 PolarHBondContact O-N 3.36Å; A176-C179 VanDerWaalsContact O-N 3.07Å; A176-F180 HydrophobicContact CB-CB 3.9Å; A176-F180 HydrophobicContact CB-CD2 4.34Å; A176-Y200 HydrophobicContact CB-CE2 3.97Å
177G92.7Very high91.3Very high15 Ų1551.9 Ų51.916%0.15527%0.265CS..G310 helixtrans54.3-133.5-177.500000111.9F109 S110 I173 C179 F180F109-G177 CarbonylContact O-C 3.57Å; F109-G177 WeakPolarHBondContact O-CA 3.44Å; S110-G177 VanDerWaalsContact CB-O 3.31Å; S110-G177 WeakPolarHBondContact CB-O 3.32Å; S110-G177 PolarHBondContact OG-O 3.43Å; I173-G177 PolarHBondContact O-N 3.29Å; G177-C179 PolarHBondContact O-N 3.48Å; G177-F180 VanDerWaalsContact O-CB 3.27Å; G177-F180 WeakPolarHBondContact O-CB 3.3Å; G177-F180 PolarHBondContact O-N 3.36Å
178D90.7Very high90.3Very high52 Ų5253 Ų5328%0.27826%0.262SS..G310 helixtrans-59.8-15177.2-81.7-20.2000115.3F109 S111 K112 A176 F180 R189F109-D178 PolarHBondContact O-N 2.63Å; S111-D178 PolarHBondContact N-OD1 3.05Å; K112-D178 HydrophobicContact CD-CB 4.07Å; K112-D178 VanDerWaalsContact CD-OD2 3.29Å; K112-D178 WeakPolarHBondContact CD-OD2 3.31Å; K112-D178 WeakPolarHBondContact CE-OD2 3.34Å; K112-D178 PolarHBondContact N-OD1 3.37Å; K112-D178 IonicContact NZ-OD2 3.22Å; K112-D178 PolarHBondContact NZ-OD2 3.2Å; A176-D178 PolarHBondContact O-N 3.38Å; D178-F180 VanDerWaalsContact C-N 3.28Å; D178-R189 PolarHBondContact O-NH2 2.91Å
179C89.1Confident89.2Confident27 Ų2755 Ų5518%0.18227%0.267CS..G310 helixtrans-76.9-17173.3-64.60000112.4A176 G177A176-C179 VanDerWaalsContact O-CB 3.32Å; A176-C179 WeakPolarHBondContact O-CB 3.32Å; A176-C179 PolarHBondContact O-N 3.36Å; A176-C179 VanDerWaalsContact O-N 3.07Å; G177-C179 PolarHBondContact O-N 3.48Å
180F89.7Confident88Confident13 Ų1359.6 Ų59.66%0.05730%0.299CS..  trans-69.8143.8176.1-168.8-91.2000111.5I106 S110 S113 I173 A176 G177 D178 H182I106-F180 HydrophobicContact CD1-CD1 3.41Å; I106-F180 VanDerWaalsContact CD1-CD1 3.41Å; I106-F180 HydrophobicContact CD1-CE1 3.62Å; I106-F180 HydrophobicContact CD1-CG 4.5Å; S110-F180 WeakPolarHBondContact OG-CB 3.43Å; S113-F180 PolarHBondContact OG-O 2.91Å; I173-F180 HydrophobicContact CD1-CE1 4.28Å; I173-F180 HydrophobicContact CD1-CZ 4.28Å; I173-F180 HydrophobicContact CG1-CD1 3.99Å; I173-F180 HydrophobicContact CG1-CD2 3.99Å; I173-F180 HydrophobicContact CG1-CE1 3.76Å; I173-F180 HydrophobicContact CG1-CE2 3.75Å; I173-F180 HydrophobicContact CG1-CG 4.1Å; I173-F180 HydrophobicContact CG1-CZ 3.63Å; A176-F180 HydrophobicContact CB-CB 3.9Å; A176-F180 HydrophobicContact CB-CD2 4.34Å; G177-F180 VanDerWaalsContact O-CB 3.27Å; G177-F180 WeakPolarHBondContact O-CB 3.3Å; G177-F180 PolarHBondContact O-N 3.36Å; D178-F180 VanDerWaalsContact C-N 3.28Å; F180-H182 AromaticContact CE1-CD2 3.96Å; F180-H182 AromaticContact CE1-NE2 3.89Å
181T89.1Confident86.9Confident41 Ų4163.3 Ų63.325%0.25232%0.317SS..  trans-156.5144.5170.6167.80000109.3L183 S185T181-L183 WeakPolarHBondContact CG2-O 3.47Å; T181-L183 PolarHBondContact O-N 2.64Å; T181-L183 PolarHBondContact OG1-N 3.03Å; T181-L183 VanDerWaalsContact OG1-N 3.08Å; T181-L183 PolarHBondContact OG1-O 3.45Å; T181-S185 WeakPolarHBondContact CG2-OG 3.48Å
182H87Confident86.1Confident39 Ų3963.3 Ų63.318%0.18131%0.313CS..SBendtrans-72.3-16.6172.8-60.2105.8000113.2E102 F180 R242E102-H182 IonicContact OE1-CD2 3.06Å; E102-H182 IonicContact OE1-CE1 3.25Å; E102-H182 IonicContact OE1-NE2 3.57Å; E102-H182 PolarHBondContact OE1-NE2 3.26Å; F180-H182 AromaticContact CE1-CD2 3.96Å; F180-H182 AromaticContact CE1-NE2 3.89Å; H182-R242 PolarHBondContact O-NH2 3.38Å
183L85.4Confident85.6Confident129 Ų12969.8 Ų69.868%0.67534%0.343SS*.SBendtrans-106.4139-179.3-60.7179.5000110.9T181 S185T181-L183 WeakPolarHBondContact CG2-O 3.47Å; T181-L183 PolarHBondContact O-N 2.64Å; T181-L183 PolarHBondContact OG1-N 3.03Å; T181-L183 VanDerWaalsContact OG1-N 3.08Å; T181-L183 PolarHBondContact OG1-O 3.45Å; L183-S185 PolarHBondContact O-N 2.9Å; L183-S185 VanDerWaalsContact O-N 3.12Å
184V82.3Confident85.4Confident24 Ų2471.7 Ų71.715%0.14535%0.353CS..  trans-59.9119172.8179.10000108.6F186 R242 E246 L249V184-F186 HydrophobicContact CB-CE2 4.35Å; V184-F186 HydrophobicContact CG1-CE2 4.41Å; V184-F186 HydrophobicContact CG1-CZ 4.36Å; V184-F186 VanDerWaalsContact O-CD2 3.3Å; V184-F186 WeakPolarHBondContact O-CD2 3.34Å; V184-F186 PolarHBondContact O-N 3.48Å; V184-R242 HydrophobicContact CG2-CG 4.06Å; V184-E246 HydrophobicContact CG1-CB 4.29Å; V184-E246 HydrophobicContact CG2-CB 4.48Å; V184-L249 HydrophobicContact CG1-CD1 3.39Å
185S79.3Confident85.2Confident31 Ų3170.6 Ų70.622%0.21734%0.344CS..  trans-81.4108.2-179.5-72.10000110.7T181 L183 R187 F253T181-S185 WeakPolarHBondContact CG2-OG 3.48Å; L183-S185 PolarHBondContact O-N 2.9Å; L183-S185 VanDerWaalsContact O-N 3.12Å; S185-R187 VanDerWaalsContact C-N 3.29Å; S185-F253 VanDerWaalsContact O-CE2 3.26Å; S185-F253 WeakPolarHBondContact O-CE2 3.36Å; S185-F253 WeakPolarHBondContact O-CZ 3.35Å
186F80.6Confident85.2Confident142 Ų14270.1 Ų70.162%0.62334%0.343SS*.SBendtrans-78.9-12.7174.4-65.9-86.6000113.5V184 L249V184-F186 HydrophobicContact CB-CE2 4.35Å; V184-F186 HydrophobicContact CG1-CE2 4.41Å; V184-F186 HydrophobicContact CG1-CZ 4.36Å; V184-F186 VanDerWaalsContact O-CD2 3.3Å; V184-F186 WeakPolarHBondContact O-CD2 3.34Å; V184-F186 PolarHBondContact O-N 3.48Å; F186-L249 HydrophobicContact CD1-CD1 3.74Å; F186-L249 HydrophobicContact CD1-CD2 4.15Å; F186-L249 HydrophobicContact CE1-CD1 3.94Å; F186-L249 HydrophobicContact CG-CD1 4.32Å
187R78.6Confident85.3Confident218 Ų21875.3 Ų75.382%0.82337%0.37SS*.SBendtrans-117132.7177.1-64.3-174.2-178.1-176.11.2110.3S185 R189S185-R187 VanDerWaalsContact C-N 3.29Å; R187-R189 PolarHBondContact O-N 2.88Å
188R76.6Confident85.4Confident143 Ų14376.5 Ų76.554%0.5438%0.383SS..  trans-74.8117171.4-173.7176.1172.1-166.2-14.4109.1H192 F253R188-H192 HydrophobicContact CG-CB 4.21Å; R188-F253 HydrophobicContact CB-CD1 3.79Å; R188-F253 HydrophobicContact CB-CD2 4.39Å; R188-F253 HydrophobicContact CB-CE1 4Å; R188-F253 HydrophobicContact CB-CG 4.01Å; R188-F253 HydrophobicContact CB-CZ 4.39Å; R188-F253 HydrophobicContact CG-CB 4.47Å; R188-F253 HydrophobicContact CG-CG 4.33Å; R188-F253 PolarHBondContact NH1-O 3.26Å
189R76.2Confident85.7Confident75 Ų7575.1 Ų75.128%0.28338%0.376SS..  trans-76.3147167.8-64.6-176.9-72.1176.94.6109.3D178 R187 E191 H192D178-R189 PolarHBondContact O-NH2 2.91Å; R187-R189 PolarHBondContact O-N 2.88Å; R189-E191 PolarHBondContact O-N 2.84Å; R189-E191 VanDerWaalsContact O-N 3.15Å; R189-H192 HydrophobicContact CB-CB 4.43Å; R189-H192 WeakPolarHBondContact O-CB 3.27Å; R189-H192 PolarHBondContact O-N 3.25Å
190P72.7Confident86.1Confident115 Ų11575.2 Ų75.275%0.74737%0.373SS*.THydrogen-bonded Turntrans-54.1-33.9178.6-23.431.7000113H192P190-H192 VanDerWaalsContact C-N 3.29Å; P190-H192 PolarHBondContact O-N 3.29Å
191E75.3Confident86.5Confident104 Ų10477.9 Ų77.949%0.48639%0.393SS..THydrogen-bonded Turntrans-82.2-5.3-178.6-50.471.9-15300112.9R189 Q193R189-E191 PolarHBondContact O-N 2.84Å; R189-E191 VanDerWaalsContact O-N 3.15Å; E191-Q193 PolarHBondContact O-N 3.2Å
192H79.8Confident86.9Confident26 Ų2681.8 Ų81.812%0.1241%0.411CS..  trans-70.2108-176.1-158.2156.8000109.6R188 R189 P190 F254R188-H192 HydrophobicContact CG-CB 4.21Å; R189-H192 HydrophobicContact CB-CB 4.43Å; R189-H192 WeakPolarHBondContact O-CB 3.27Å; R189-H192 PolarHBondContact O-N 3.25Å; P190-H192 VanDerWaalsContact C-N 3.29Å; P190-H192 PolarHBondContact O-N 3.29Å; H192-F254 AromaticContact CD2-CZ 3.69Å; H192-F254 WeakPolarHBondContact O-CE1 3.3Å
193Q88.4Confident87.4Confident135 Ų13580.3 Ų80.363%0.63141%0.405SS*.  trans-104.6148175.7-62.9-176.219.800110.4E191 I195E191-Q193 PolarHBondContact O-N 3.2Å; Q193-I195 HydrophobicContact CB-CD1 4.19Å; Q193-I195 PolarHBondContact O-N 3.02Å
194L92.1Very high88Confident40 Ų4074.6 Ų74.621%0.20938%0.375CS..  trans-78.8108.4171.5177.660.2000108.7T196 F254 K257 Y258 Y261L194-T196 HydrophobicContact CD1-CG2 4.49Å; L194-T196 HydrophobicContact CD2-CG2 4.23Å; L194-T196 HydrophobicContact CG-CG2 3.9Å; L194-F254 HydrophobicContact CB-CD1 3.83Å; L194-F254 HydrophobicContact CB-CD2 4.13Å; L194-F254 HydrophobicContact CB-CE1 3.89Å; L194-F254 HydrophobicContact CB-CE2 4.18Å; L194-F254 HydrophobicContact CB-CG 3.96Å; L194-F254 HydrophobicContact CB-CZ 4.05Å; L194-F254 HydrophobicContact CD1-CD2 4.29Å; L194-F254 HydrophobicContact CD1-CE2 4.48Å; L194-F254 HydrophobicContact CD2-CB 4.4Å; L194-F254 HydrophobicContact CD2-CG 4.49Å; L194-K257 HydrophobicContact CD2-CB 4.03Å; L194-Y258 HydrophobicContact CD1-CD2 3.68Å; L194-Y258 HydrophobicContact CD1-CE2 4.27Å; L194-Y258 HydrophobicContact CD2-CD2 4.3Å; L194-Y261 HydrophobicContact CD1-CD1 4.4Å
195I93.8Very high88.7Confident43 Ų4373.9 Ų73.922%0.22137%0.37CS..  trans-87.8120.6178.5-51.6-57.5000109.5Q193 Y200Q193-I195 HydrophobicContact CB-CD1 4.19Å; Q193-I195 PolarHBondContact O-N 3.02Å; I195-Y200 HydrophobicContact CB-CD2 4.46Å; I195-Y200 HydrophobicContact CG2-CD2 3.76Å; I195-Y200 HydrophobicContact CG2-CE2 4.28Å; I195-Y200 HydrophobicContact CG2-CG 4.21Å
196T95.7Very high89.6Confident50 Ų5072.4 Ų72.431%0.30736%0.359SS..  trans-1257.7-179.7610000113.1L194 S201 Y261L194-T196 HydrophobicContact CD1-CG2 4.49Å; L194-T196 HydrophobicContact CD2-CG2 4.23Å; L194-T196 HydrophobicContact CG-CG2 3.9Å; T196-S201 WeakPolarHBondContact O-CA 3.36Å; T196-S201 WeakPolarHBondContact O-CB 3.25Å; T196-S201 PolarHBondContact O-N 2.98Å; T196-Y261 HydrophobicContact CG2-CD1 4.17Å; T196-Y261 HydrophobicContact CG2-CD2 3.46Å; T196-Y261 VanDerWaalsContact CG2-CD2 3.46Å; T196-Y261 HydrophobicContact CG2-CE1 4.35Å; T196-Y261 HydrophobicContact CG2-CE2 3.68Å; T196-Y261 HydrophobicContact CG2-CG 3.71Å
197N95.3Very high90.4Very high119 Ų11966.2 Ų66.264%0.63633%0.334SS*.SBendtrans-106161.1-171.7-65-19.1000112.7N175 V199 Y200N175-N197 PolarHBondContact ND2-O 2.77Å; N197-V199 PolarHBondContact O-N 3.04Å; N197-Y200 PolarHBondContact O-N 3.42Å
198G96.5Very high91.3Very high41 Ų4156.8 Ų56.842%0.42330%0.298SS..THydrogen-bonded Turntrans56.2-124.9-177.100000111.7N175 Y200 S201N175-G198 VanDerWaalsContact ND2-CA 3.28Å; N175-G198 WeakPolarHBondContact ND2-CA 3.18Å; G198-Y200 PolarHBondContact O-N 2.63Å; G198-Y200 VanDerWaalsContact O-N 3.13Å; G198-S201 WeakPolarHBondContact O-CB 3.32Å; G198-S201 PolarHBondContact O-N 3.07Å; G198-S201 PolarHBondContact O-OG 3.12Å
199V97.2Very high92.3Very high23 Ų2351 Ų5114%0.13928%0.278CS..Hα-helixtrans-60.6-27.1-177.6-67.60000113.8L168 A171 N175 N197 S201 I202 C203 P206L168-V199 HydrophobicContact CD1-CB 4.27Å; L168-V199 HydrophobicContact CD1-CG1 4.11Å; A171-V199 HydrophobicContact CB-CG1 3.57Å; A171-V199 HydrophobicContact CB-CG2 4.24Å; N175-V199 HydrophobicContact CB-CG2 4.23Å; N175-V199 PolarHBondContact ND2-N 3.13Å; N197-V199 PolarHBondContact O-N 3.04Å; V199-S201 PolarHBondContact O-N 3.37Å; V199-I202 PolarHBondContact O-N 2.95Å; V199-I202 VanDerWaalsContact O-N 3.14Å; V199-C203 PolarHBondContact O-N 3.12Å; V199-P206 HydrophobicContact CB-CB 4.09Å; V199-P206 HydrophobicContact CB-CG 4.26Å; V199-P206 HydrophobicContact CG2-CB 4Å; V199-P206 HydrophobicContact CG2-CG 3.77Å
200Y97.6Very high93.4Very high28 Ų2847.4 Ų47.411%0.1127%0.265CS..Hα-helixtrans-69.4-19.7174.5-70.4-84.2000112.8N175 A176 I195 N197 G198 I202 C203 R204 P206 Y261 V265N175-Y200 HydrophobicContact CB-CD2 4.02Å; N175-Y200 HydrophobicContact CB-CE2 4.05Å; A176-Y200 HydrophobicContact CB-CE2 3.97Å; I195-Y200 HydrophobicContact CB-CD2 4.46Å; I195-Y200 HydrophobicContact CG2-CD2 3.76Å; I195-Y200 HydrophobicContact CG2-CE2 4.28Å; I195-Y200 HydrophobicContact CG2-CG 4.21Å; N197-Y200 PolarHBondContact O-N 3.42Å; G198-Y200 PolarHBondContact O-N 2.63Å; G198-Y200 VanDerWaalsContact O-N 3.13Å; Y200-I202 VanDerWaalsContact C-N 3.26Å; Y200-I202 PolarHBondContact O-N 3.44Å; Y200-C203 CarbonylContact C-O 3.11Å; Y200-C203 VanDerWaalsContact CA-O 3.32Å; Y200-C203 WeakPolarHBondContact CA-O 3.5Å; Y200-R204 WeakPolarHBondContact CD1-O 3.42Å; Y200-P206 HydrophobicContact CD1-CG 3.91Å; Y200-P206 HydrophobicContact CD2-CG 4.29Å; Y200-P206 HydrophobicContact CE1-CG 3.73Å; Y200-P206 HydrophobicContact CE2-CG 4.11Å; Y200-P206 HydrophobicContact CG-CG 4.19Å; Y200-Y261 WeakPolarHBondContact O-CE2 3.46Å; Y200-Y261 PolarHBondContact O-OH 2.63Å; Y200-V265 WeakPolarHBondContact O-CG1 3.32Å
201S97.3Very high94.5Very high70 Ų7043.4 Ų43.449%0.4924%0.235SC..Hα-helixtrans-74.5-18.1172.270.30000113.3T196 G198 V199T196-S201 WeakPolarHBondContact O-CA 3.36Å; T196-S201 WeakPolarHBondContact O-CB 3.25Å; T196-S201 PolarHBondContact O-N 2.98Å; G198-S201 WeakPolarHBondContact O-CB 3.32Å; G198-S201 PolarHBondContact O-N 3.07Å; G198-S201 PolarHBondContact O-OG 3.12Å; V199-S201 PolarHBondContact O-N 3.37Å
202I97.4Very high95.6Very high122 Ų12239.6 Ų39.663%0.62622%0.218SC*.Hα-helixtrans-93.6-44.7-178.5-57.3172.4000110.6V199 Y200 P266V199-I202 PolarHBondContact O-N 2.95Å; V199-I202 VanDerWaalsContact O-N 3.14Å; Y200-I202 VanDerWaalsContact C-N 3.26Å; Y200-I202 PolarHBondContact O-N 3.44Å; I202-P266 WeakPolarHBondContact O-CD 3.32Å; I202-P266 WeakPolarHBondContact O-CG 3.37Å
203C97.5Very high96.5Very high9 Ų940.8 Ų40.86%0.06123%0.225CC..  trans-147.7150.8175.863.70000110.8V199 Y200 P206 P266V199-C203 PolarHBondContact O-N 3.12Å; Y200-C203 CarbonylContact C-O 3.11Å; Y200-C203 VanDerWaalsContact CA-O 3.32Å; Y200-C203 WeakPolarHBondContact CA-O 3.5Å; C203-P206 WeakPolarHBondContact O-CD 3.37Å; C203-P206 VanDerWaalsContact SG-CA 3.53Å; C203-P266 CarbonylContact C-O 3.03Å; C203-P266 VanDerWaalsContact CA-O 3.27Å; C203-P266 WeakPolarHBondContact CA-O 3.24Å
204R97.7Very high97Very high9 Ų934.8 Ų34.83%0.03420%0.196CC..SBendtrans-74.2-27.8-174-57.2-172.4-51.9-112.73113.7Y200 P206 E247 Y261 R262 V265 P266 S267 R273Y200-R204 WeakPolarHBondContact CD1-O 3.42Å; R204-P206 VanDerWaalsContact C-CD 3.41Å; R204-P206 WeakPolarHBondContact O-CD 3.41Å; R204-E247 IonicContact CZ-OE1 3.91Å; R204-E247 VanDerWaalsContact CZ-OE1 3.25Å; R204-E247 IonicContact CZ-OE2 3.92Å; R204-E247 IonicContact NE-OE1 2.71Å; R204-E247 PolarHBondContact NE-OE1 3.3Å; R204-E247 VanDerWaalsContact NH2-CD 3.28Å; R204-E247 IonicContact NH2-OE1 3.07Å; R204-E247 PolarHBondContact NH2-OE1 3.36Å; R204-E247 IonicContact NH2-OE2 3.25Å; R204-E247 PolarHBondContact NH2-OE2 2.88Å; R204-Y261 WeakPolarHBondContact CA-OH 3.47Å; R204-Y261 HydrophobicContact CB-CE1 4.03Å; R204-Y261 HydrophobicContact CG-CD1 4.31Å; R204-Y261 HydrophobicContact CG-CE1 3.62Å; R204-Y261 HydrophobicContact CG-CE2 4.48Å; R204-R262 PolarHBondContact NH1-O 3.47Å; R204-V265 VanDerWaalsContact CD-O 3.29Å; R204-V265 WeakPolarHBondContact CD-O 3.46Å; R204-V265 HydrophobicContact CG-CB 3.81Å; R204-V265 HydrophobicContact CG-CG1 3.64Å; R204-V265 WeakPolarHBondContact CG-O 3.26Å; R204-V265 PolarHBondContact NH1-O 3.39Å; R204-P266 WeakPolarHBondContact CG-O 3.23Å; R204-P266 PolarHBondContact N-O 3.38Å; R204-S267 PolarHBondContact N-O 3.34Å; R204-R273 PolarHBondContact NH1-OXT 2.92Å; R204-R273 VanDerWaalsContact NH1-OXT 3.11Å; R204-R273 PolarHBondContact NH2-O 3.34Å; R204-R273 PolarHBondContact NH2-OXT 3.48Å
205H97.3Very high97.2Very high8 Ų833 Ų334%0.03719%0.187CC..  trans-126.161.4-176.8-59.4-84.6000112.4S207 Y208 T209 I243 E247 S267H205-S207 VanDerWaalsContact C-N 3.27Å; H205-S207 PolarHBondContact O-N 2.99Å; H205-Y208 HydrophobicContact CB-CD2 3.55Å; H205-Y208 HydrophobicContact CB-CE2 4.29Å; H205-Y208 HydrophobicContact CB-CG 4.03Å; H205-Y208 AromaticContact CG-CD2 3.82Å; H205-Y208 AromaticContact ND1-CD2 3.75Å; H205-Y208 AromaticContact ND1-CE2 3.59Å; H205-Y208 WeakPolarHBondContact O-CB 3.44Å; H205-Y208 PolarHBondContact O-N 3.34Å; H205-T209 PolarHBondContact O-N 2.96Å; H205-T209 PolarHBondContact O-OG1 3.41Å; H205-I243 HydrophobicContact CB-CD1 4.4Å; H205-E247 IonicContact CD2-OE1 3.94Å; H205-E247 IonicContact NE2-OE1 2.71Å; H205-E247 PolarHBondContact NE2-OE1 3.36Å; H205-S267 PolarHBondContact N-O 3.29Å
206P97.9Very high97.5Very high0 Ų032 Ų320%018%0.184CC..Hα-helixtrans-60.7-33-174.221.1-29.2000113.2L168 A172 V199 Y200 C203 R204 Y208 T209 G210L168-P206 HydrophobicContact CD1-CB 3.81Å; L168-P206 HydrophobicContact CG-CB 4.01Å; L168-P206 WeakPolarHBondContact CG-O 3.44Å; A172-P206 HydrophobicContact CB-CB 4Å; A172-P206 HydrophobicContact CB-CG 3.69Å; V199-P206 HydrophobicContact CB-CB 4.09Å; V199-P206 HydrophobicContact CB-CG 4.26Å; V199-P206 HydrophobicContact CG2-CB 4Å; V199-P206 HydrophobicContact CG2-CG 3.77Å; Y200-P206 HydrophobicContact CD1-CG 3.91Å; Y200-P206 HydrophobicContact CD2-CG 4.29Å; Y200-P206 HydrophobicContact CE1-CG 3.73Å; Y200-P206 HydrophobicContact CE2-CG 4.11Å; Y200-P206 HydrophobicContact CG-CG 4.19Å; C203-P206 WeakPolarHBondContact O-CD 3.37Å; C203-P206 VanDerWaalsContact SG-CA 3.53Å; R204-P206 VanDerWaalsContact C-CD 3.41Å; R204-P206 WeakPolarHBondContact O-CD 3.41Å; P206-Y208 VanDerWaalsContact C-N 3.31Å; P206-Y208 PolarHBondContact O-N 3.45Å; P206-T209 PolarHBondContact O-N 3.35Å; P206-G210 PolarHBondContact O-N 2.98Å
207S97.2Very high97.6Very high12 Ų1229.7 Ų29.78%0.08417%0.169CC..Hα-helixtrans-65.7-32.3175.258.30000113.3H205 W211H205-S207 VanDerWaalsContact C-N 3.27Å; H205-S207 PolarHBondContact O-N 2.99Å; S207-W211 WeakPolarHBondContact O-CB 3.44Å; S207-W211 PolarHBondContact O-N 2.7Å
208Y97.4Very high97.8Very high21 Ų2124.1 Ų24.18%0.08214%0.14CC..Hα-helixtrans-76.3-42.8176.7-63.7-13.2000111.2H205 P206 G210 W211 L212 L239 R242 I243 E246H205-Y208 HydrophobicContact CB-CD2 3.55Å; H205-Y208 HydrophobicContact CB-CE2 4.29Å; H205-Y208 HydrophobicContact CB-CG 4.03Å; H205-Y208 AromaticContact CG-CD2 3.82Å; H205-Y208 AromaticContact ND1-CD2 3.75Å; H205-Y208 AromaticContact ND1-CE2 3.59Å; H205-Y208 WeakPolarHBondContact O-CB 3.44Å; H205-Y208 PolarHBondContact O-N 3.34Å; P206-Y208 VanDerWaalsContact C-N 3.31Å; P206-Y208 PolarHBondContact O-N 3.45Å; Y208-G210 VanDerWaalsContact C-N 3.27Å; Y208-G210 PolarHBondContact O-N 3.17Å; Y208-W211 PolarHBondContact O-N 3.05Å; Y208-L212 PolarHBondContact O-N 3.37Å; Y208-L239 HydrophobicContact CD1-CD2 3.94Å; Y208-L239 HydrophobicContact CD2-CD2 4.33Å; Y208-L239 HydrophobicContact CG-CD2 3.78Å; Y208-L239 WeakPolarHBondContact O-CD1 3.45Å; Y208-R242 HydrophobicContact CE2-CG 4.42Å; Y208-R242 PolarHBondContact OH-NE 3.38Å; Y208-R242 PolarHBondContact OH-NH2 2.94Å; Y208-I243 HydrophobicContact CD2-CD1 3.97Å; Y208-I243 HydrophobicContact CD2-CG1 3.55Å; Y208-I243 HydrophobicContact CE2-CG1 3.88Å; Y208-E246 WeakPolarHBondContact CE2-OE2 3.12Å; Y208-E246 VanDerWaalsContact CZ-OE2 3.28Å; Y208-E246 PolarHBondContact OH-OE2 3.39Å
209T98.1Very high97.9Very high20 Ų2022.2 Ų22.212%0.12312%0.119CC..Hα-helixtrans-59.5-43.3171-56.80000110.7L168 H205 P206 L212 L213 G268L168-T209 HydrophobicContact CD2-CG2 3.53Å; H205-T209 PolarHBondContact O-N 2.96Å; H205-T209 PolarHBondContact O-OG1 3.41Å; P206-T209 PolarHBondContact O-N 3.35Å; T209-L212 PolarHBondContact O-N 3.45Å; T209-L213 HydrophobicContact CG2-CD1 4.15Å; T209-L213 WeakPolarHBondContact O-CG 3.48Å; T209-L213 PolarHBondContact O-N 2.95Å; T209-G268 WeakPolarHBondContact CG2-O 3.48Å; T209-G268 WeakPolarHBondContact OG1-CA 3.49Å; T209-G268 PolarHBondContact OG1-O 2.95Å
210G98.3Very high97.9Very high0 Ų022.2 Ų22.20%012%0.119CC..Hα-helixtrans-59.9-46.7175.800000112.2G165 P206 Y208 L212 L213 W214G165-G210 CarbonylContact C-O 2.86Å; G165-G210 VanDerWaalsContact CA-O 3.25Å; G165-G210 WeakPolarHBondContact CA-O 3.39Å; G165-G210 CarbonylContact O-C 3.59Å; G165-G210 WeakPolarHBondContact O-CA 3.39Å; P206-G210 PolarHBondContact O-N 2.98Å; Y208-G210 VanDerWaalsContact C-N 3.27Å; Y208-G210 PolarHBondContact O-N 3.17Å; G210-L212 PolarHBondContact O-N 2.72Å; G210-L213 PolarHBondContact O-N 3.23Å; G210-W214 WeakPolarHBondContact O-CB 3.39Å; G210-W214 PolarHBondContact O-N 3.32Å
211W97.1Very high97.9Very high32 Ų3220.9 Ų20.912%0.12111%0.114CC..Hα-helixtrans-58.9-46.1174.5-178.8-108000112.9F98 H123 Y127 S207 Y208 W214 S215F98-W211 HydrophobicContact CE1-CE3 4.38Å; F98-W211 AromaticContact CE1-CZ3 3.66Å; F98-W211 HydrophobicContact CE1-CZ3 3.66Å; F98-W211 HydrophobicContact CE2-CE3 4.14Å; F98-W211 HydrophobicContact CE2-CZ3 4.17Å; F98-W211 AromaticContact CZ-CE3 3.63Å; F98-W211 HydrophobicContact CZ-CE3 3.63Å; F98-W211 AromaticContact CZ-CZ3 3.36Å; F98-W211 HydrophobicContact CZ-CZ3 3.36Å; H123-W211 AromaticContact CE1-CH2 3.88Å; H123-W211 AromaticContact NE2-CH2 3.95Å; Y127-W211 HydrophobicContact CD2-CH2 4.4Å; Y127-W211 HydrophobicContact CE2-CH2 4.04Å; S207-W211 WeakPolarHBondContact O-CB 3.44Å; S207-W211 PolarHBondContact O-N 2.7Å; Y208-W211 PolarHBondContact O-N 3.05Å; W211-W214 HydrophobicContact CE3-CE3 4.12Å; W211-W214 HydrophobicContact CE3-CZ3 4.5Å; W211-W214 HydrophobicContact CH2-CZ3 4.16Å; W211-W214 AromaticContact CZ3-CE3 3.93Å; W211-W214 HydrophobicContact CZ3-CE3 3.93Å; W211-W214 AromaticContact CZ3-CZ3 3.86Å; W211-W214 HydrophobicContact CZ3-CZ3 3.86Å; W211-W214 PolarHBondContact O-N 2.86Å; W211-S215 VanDerWaalsContact O-CB 3.31Å; W211-S215 WeakPolarHBondContact O-CB 3.18Å; W211-S215 PolarHBondContact O-N 2.81Å; W211-S215 PolarHBondContact O-OG 3.29Å; W211-S215 VanDerWaalsContact O-OG 3.13Å
212L98.2Very high97.9Very high23 Ų2317.7 Ų17.712%0.129%0.092CC..Hα-helixtrans-62.6-47.5-179-179.164.9000111.4Y208 T209 G210 W214 S215 V216 L239 I269Y208-L212 PolarHBondContact O-N 3.37Å; T209-L212 PolarHBondContact O-N 3.45Å; G210-L212 PolarHBondContact O-N 2.72Å; L212-W214 VanDerWaalsContact C-N 3.34Å; L212-S215 PolarHBondContact O-OG 2.83Å; L212-V216 HydrophobicContact CD1-CG2 4.1Å; L212-V216 WeakPolarHBondContact O-CB 3.23Å; L212-V216 VanDerWaalsContact O-CG2 3.25Å; L212-V216 WeakPolarHBondContact O-CG2 3.41Å; L212-V216 PolarHBondContact O-N 3.25Å; L212-V216 VanDerWaalsContact O-N 3.09Å; L212-L239 HydrophobicContact CB-CD1 3.95Å; L212-I269 HydrophobicContact CB-CD1 4.39Å; L212-I269 HydrophobicContact CD2-CD1 4.03Å
213L98.5Very high97.9Very high52 Ų5212.4 Ų12.427%0.2727%0.066SC..Hα-helixtrans-63.7-42.3177.3-70.6173.7000111.5L161 I164 T209 G210 G217L161-L213 HydrophobicContact CD2-CD2 4.1Å; I164-L213 HydrophobicContact CG2-CD1 3.9Å; T209-L213 HydrophobicContact CG2-CD1 4.15Å; T209-L213 WeakPolarHBondContact O-CG 3.48Å; T209-L213 PolarHBondContact O-N 2.95Å; G210-L213 PolarHBondContact O-N 3.23Å; L213-G217 VanDerWaalsContact O-CA 3.32Å; L213-G217 WeakPolarHBondContact O-CA 3.31Å; L213-G217 PolarHBondContact O-N 3.33Å
214W98.5Very high97.9Very high8 Ų812 Ų123%0.036%0.063CC..Hα-helixtrans-64-53.4178.7-177.692.6000111.3L95 F98 G210 W211 L212 V216 G217 T218L95-W214 HydrophobicContact CD1-CH2 3.79Å; L95-W214 HydrophobicContact CD1-CZ2 4.23Å; F98-W214 HydrophobicContact CB-CH2 4.29Å; F98-W214 HydrophobicContact CB-CZ2 3.37Å; F98-W214 AromaticContact CD1-CH2 3.97Å; F98-W214 HydrophobicContact CD1-CH2 3.97Å; F98-W214 AromaticContact CD1-CZ2 3.86Å; F98-W214 HydrophobicContact CD1-CZ2 3.86Å; F98-W214 HydrophobicContact CD1-CZ3 4.48Å; F98-W214 AromaticContact CD2-CD1 3.76Å; F98-W214 AromaticContact CD2-CD2 3.69Å; F98-W214 HydrophobicContact CD2-CD2 3.69Å; F98-W214 AromaticContact CD2-CE2 3.37Å; F98-W214 HydrophobicContact CD2-CE3 4.32Å; F98-W214 AromaticContact CD2-CG 3.97Å; F98-W214 HydrophobicContact CD2-CG 3.97Å; F98-W214 HydrophobicContact CD2-CH2 4.43Å; F98-W214 AromaticContact CD2-CZ2 3.81Å; F98-W214 HydrophobicContact CD2-CZ2 3.81Å; F98-W214 AromaticContact CD2-NE1 3.4Å; F98-W214 HydrophobicContact CE2-CD2 4Å; F98-W214 HydrophobicContact CE2-CE3 4.32Å; F98-W214 HydrophobicContact CE2-CG 4.24Å; F98-W214 HydrophobicContact CG-CD2 4.16Å; F98-W214 AromaticContact CG-CE2 3.48Å; F98-W214 VanDerWaalsContact CG-CE2 3.48Å; F98-W214 AromaticContact CG-CH2 3.96Å; F98-W214 HydrophobicContact CG-CH2 3.96Å; F98-W214 AromaticContact CG-CZ2 3.38Å; F98-W214 HydrophobicContact CG-CZ2 3.38Å; F98-W214 AromaticContact CG-NE1 3.74Å; G210-W214 WeakPolarHBondContact O-CB 3.39Å; G210-W214 PolarHBondContact O-N 3.32Å; W211-W214 HydrophobicContact CE3-CE3 4.12Å; W211-W214 HydrophobicContact CE3-CZ3 4.5Å; W211-W214 HydrophobicContact CH2-CZ3 4.16Å; W211-W214 AromaticContact CZ3-CE3 3.93Å; W211-W214 HydrophobicContact CZ3-CE3 3.93Å; W211-W214 AromaticContact CZ3-CZ3 3.86Å; W211-W214 HydrophobicContact CZ3-CZ3 3.86Å; W211-W214 PolarHBondContact O-N 2.86Å; L212-W214 VanDerWaalsContact C-N 3.34Å; W214-V216 PolarHBondContact O-N 3.43Å; W214-G217 PolarHBondContact O-N 3.5Å; W214-T218 HydrophobicContact CD2-CG2 4.25Å; W214-T218 HydrophobicContact CE3-CG2 4.35Å; W214-T218 HydrophobicContact CH2-CG2 4.14Å; W214-T218 HydrophobicContact CZ2-CG2 4.03Å; W214-T218 HydrophobicContact CZ3-CG2 4.3Å; W214-T218 VanDerWaalsContact O-CG2 3.3Å; W214-T218 WeakPolarHBondContact O-CG2 3.49Å; W214-T218 PolarHBondContact O-N 3.42Å
215S97.7Very high97.9Very high3 Ų315.2 Ų15.22%0.0219%0.085CC..Hα-helixtrans-64.4-46.4-174.870.80000111.6W211 L212 T218 Y231 S235W211-S215 VanDerWaalsContact O-CB 3.31Å; W211-S215 WeakPolarHBondContact O-CB 3.18Å; W211-S215 PolarHBondContact O-N 2.81Å; W211-S215 PolarHBondContact O-OG 3.29Å; W211-S215 VanDerWaalsContact O-OG 3.13Å; L212-S215 PolarHBondContact O-OG 2.83Å; S215-T218 PolarHBondContact O-N 3.3Å; S215-T218 PolarHBondContact O-OG1 2.82Å; S215-Y231 WeakPolarHBondContact O-CD1 3.01Å; S215-S235 PolarHBondContact OG-OG 2.88Å
216V98.5Very high97.9Very high23 Ų2319.9 Ų19.914%0.13911%0.109CC..Hα-helixtrans-66.4-41.8175.5177.40000110.8L212 W214 T218 Q219 V220 T228 A232L212-V216 HydrophobicContact CD1-CG2 4.1Å; L212-V216 WeakPolarHBondContact O-CB 3.23Å; L212-V216 VanDerWaalsContact O-CG2 3.25Å; L212-V216 WeakPolarHBondContact O-CG2 3.41Å; L212-V216 PolarHBondContact O-N 3.25Å; L212-V216 VanDerWaalsContact O-N 3.09Å; W214-V216 PolarHBondContact O-N 3.43Å; V216-T218 PolarHBondContact O-N 2.98Å; V216-Q219 PolarHBondContact O-N 3.42Å; V216-V220 HydrophobicContact CG1-CG2 4.32Å; V216-V220 PolarHBondContact O-N 2.96Å; V216-T228 HydrophobicContact CG1-CG2 4.15Å; V216-A232 HydrophobicContact CG1-CB 4.43Å; V216-A232 HydrophobicContact CG2-CB 3.82Å
217G98.7Very high97.9Very high0 Ų020 Ų200%011%0.11CC..Hα-helixtrans-56.7-36.6177.400000112.8G158 L213 W214 Q219 V220 L221G158-G217 WeakPolarHBondContact CA-O 3.49Å; L213-G217 VanDerWaalsContact O-CA 3.32Å; L213-G217 WeakPolarHBondContact O-CA 3.31Å; L213-G217 PolarHBondContact O-N 3.33Å; W214-G217 PolarHBondContact O-N 3.5Å; G217-Q219 VanDerWaalsContact C-N 3.26Å; G217-Q219 PolarHBondContact O-N 3.1Å; G217-V220 PolarHBondContact O-N 3.29Å; G217-L221 WeakPolarHBondContact O-CB 3.39Å; G217-L221 PolarHBondContact O-N 3.23Å
218T98.4Very high98Very high3 Ų321 Ų212%0.01812%0.115CC..Hα-helixtrans-61.1-35.1175.568.80000112.9Y91 V162 W214 S215 V216 L221 L222Y91-T218 HydrophobicContact CE2-CG2 4.46Å; V162-T218 HydrophobicContact CG2-CG2 4.05Å; W214-T218 HydrophobicContact CD2-CG2 4.25Å; W214-T218 HydrophobicContact CE3-CG2 4.35Å; W214-T218 HydrophobicContact CH2-CG2 4.14Å; W214-T218 HydrophobicContact CZ2-CG2 4.03Å; W214-T218 HydrophobicContact CZ3-CG2 4.3Å; W214-T218 VanDerWaalsContact O-CG2 3.3Å; W214-T218 WeakPolarHBondContact O-CG2 3.49Å; W214-T218 PolarHBondContact O-N 3.42Å; S215-T218 PolarHBondContact O-N 3.3Å; S215-T218 PolarHBondContact O-OG1 2.82Å; V216-T218 PolarHBondContact O-N 2.98Å; T218-L221 WeakPolarHBondContact O-CB 3.42Å; T218-L222 WeakPolarHBondContact O-CG 3.41Å; T218-L222 PolarHBondContact O-N 3.35Å; T218-L222 VanDerWaalsContact O-N 3.11Å
219Q98.5Very high98Very high0 Ų024.3 Ų24.30%014%0.138CC..Hα-helixtrans-79.2-37.8-179.3-58.2-50.9-5300111.9S134 V216 G217 L221 L222 C223 N224 C227 T228 Y231S134-Q219 PolarHBondContact OG-NE2 3.08Å; S134-Q219 PolarHBondContact OG-OE1 2.74Å; V216-Q219 PolarHBondContact O-N 3.42Å; G217-Q219 VanDerWaalsContact C-N 3.26Å; G217-Q219 PolarHBondContact O-N 3.1Å; Q219-L221 VanDerWaalsContact C-N 3.29Å; Q219-L221 PolarHBondContact O-N 2.89Å; Q219-L222 CarbonylContact O-C 3.58Å; Q219-L222 PolarHBondContact O-N 3.31Å; Q219-C223 PolarHBondContact O-N 3Å; Q219-C223 VanDerWaalsContact O-N 3.11Å; Q219-N224 HydrophobicContact CB-CB 4.45Å; Q219-N224 PolarHBondContact O-N 2.83Å; Q219-N224 PolarHBondContact OE1-ND2 3.39Å; Q219-C227 HydrophobicContact CG-CB 4.2Å; Q219-C227 VanDerWaalsContact OE1-CB 3.3Å; Q219-T228 WeakPolarHBondContact CB-OG1 3.03Å; Q219-Y231 HydrophobicContact CG-CD1 3.62Å; Q219-Y231 HydrophobicContact CG-CD2 3.83Å; Q219-Y231 HydrophobicContact CG-CE1 3.91Å; Q219-Y231 HydrophobicContact CG-CE2 4.09Å; Q219-Y231 HydrophobicContact CG-CG 3.58Å
220V98.5Very high98Very high23 Ų2327.3 Ų27.314%0.13915%0.152CC..Hα-helixtrans-61.6-42169.8-179.80000110I154 V157 L161 V216 G217 L222 C223 T228I154-V220 HydrophobicContact CG2-CG1 3.93Å; I154-V220 WeakPolarHBondContact CG2-O 3.46Å; V157-V220 HydrophobicContact CG1-CG1 4.33Å; L161-V220 HydrophobicContact CD1-CG2 4.28Å; V216-V220 HydrophobicContact CG1-CG2 4.32Å; V216-V220 PolarHBondContact O-N 2.96Å; G217-V220 PolarHBondContact O-N 3.29Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.41Å; V220-C223 WeakPolarHBondContact O-CA 3.44Å; V220-C223 PolarHBondContact O-N 2.98Å; V220-T228 HydrophobicContact CG2-CG2 3.68Å; V220-T228 PolarHBondContact N-OG1 2.99Å
221L97.9Very high98Very high0 Ų028.6 Ų28.60%016%0.158CC..Hα-helixtrans-58.9-44.8177.9-176.4164.8000111.2C87 L90 V94 T155 L159 V162 G217 T218 Q219 C223C87-L221 HydrophobicContact CB-CD2 4.31Å; C87-L221 WeakPolarHBondContact CB-O 3.21Å; C87-L221 WeakPolarHBondContact O-CD2 3.48Å; L90-L221 HydrophobicContact CB-CD1 4.22Å; L90-L221 HydrophobicContact CB-CD2 4.07Å; V94-L221 HydrophobicContact CG2-CD1 4.16Å; T155-L221 HydrophobicContact CG2-CD2 4.44Å; T155-L221 HydrophobicContact CG2-CG 4.24Å; T155-L221 PolarHBondContact OG1-O 2.94Å; L159-L221 HydrophobicContact CB-CD1 4.27Å; L159-L221 HydrophobicContact CD1-CD1 4.2Å; V162-L221 HydrophobicContact CG2-CD1 4.49Å; G217-L221 WeakPolarHBondContact O-CB 3.39Å; G217-L221 PolarHBondContact O-N 3.23Å; T218-L221 WeakPolarHBondContact O-CB 3.42Å; Q219-L221 VanDerWaalsContact C-N 3.29Å; Q219-L221 PolarHBondContact O-N 2.89Å; L221-C223 PolarHBondContact O-N 3.36Å
222L97.1Very high98.1Very high3 Ų328.8 Ų28.82%0.01617%0.166CC..THydrogen-bonded Turntrans-73.2-3.6174.7-72.3-179.9000114.3Y91 Y138 K149 T218 Q219 V220 N224Y91-L222 HydrophobicContact CD2-CD1 3.49Å; Y91-L222 VanDerWaalsContact CD2-CD1 3.49Å; Y91-L222 HydrophobicContact CD2-CD2 4Å; Y91-L222 HydrophobicContact CD2-CG 3.61Å; Y91-L222 HydrophobicContact CE2-CD1 3.59Å; Y91-L222 HydrophobicContact CE2-CG 4.22Å; Y91-L222 HydrophobicContact CG-CD1 3.99Å; Y91-L222 HydrophobicContact CG-CD2 3.83Å; Y91-L222 HydrophobicContact CG-CG 4Å; Y138-L222 HydrophobicContact CD2-CB 4.12Å; Y138-L222 HydrophobicContact CD2-CD2 3.95Å; Y138-L222 HydrophobicContact CE2-CD2 4.15Å; Y138-L222 HydrophobicContact CG-CD2 4.48Å; K149-L222 WeakPolarHBondContact CD-O 3.46Å; K149-L222 PolarHBondContact NZ-O 3.33Å; T218-L222 WeakPolarHBondContact O-CG 3.41Å; T218-L222 PolarHBondContact O-N 3.35Å; T218-L222 VanDerWaalsContact O-N 3.11Å; Q219-L222 CarbonylContact O-C 3.58Å; Q219-L222 PolarHBondContact O-N 3.31Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 3.41Å; L222-N224 PolarHBondContact O-N 3.48Å; L222-N224 PolarHBondContact O-OD1 3.07Å
223C96.7Very high98Very high12 Ų1231 Ų318%0.08118%0.18CC..THydrogen-bonded Turntrans5540.7-173.8-55.30000111.8K149 Q219 V220 L221 P225K149-C223 HydrophobicContact CD-CB 4.18Å; K149-C223 PolarHBondContact NZ-O 3.23Å; Q219-C223 PolarHBondContact O-N 3Å; Q219-C223 VanDerWaalsContact O-N 3.11Å; V220-C223 WeakPolarHBondContact O-CA 3.44Å; V220-C223 PolarHBondContact O-N 2.98Å; L221-C223 PolarHBondContact O-N 3.36Å; C223-P225 WeakPolarHBondContact O-CD 3.45Å
224N97.7Very high97.9Very high0 Ų033.5 Ų33.50%019%0.193CC..  trans-93.994.7178.8-77.2-6.5000109.8S134 E137 Y138 K149 Q219 L222 I226 C227 T228S134-N224 PolarHBondContact O-ND2 3.4Å; E137-N224 HydrophobicContact CG-CB 4.37Å; E137-N224 WeakPolarHBondContact OE1-CA 3.2Å; E137-N224 WeakPolarHBondContact OE1-CB 3.42Å; Y138-N224 WeakPolarHBondContact CA-OD1 3.47Å; K149-N224 PolarHBondContact NZ-OD1 3.42Å; Q219-N224 HydrophobicContact CB-CB 4.45Å; Q219-N224 PolarHBondContact O-N 2.83Å; Q219-N224 PolarHBondContact OE1-ND2 3.39Å; L222-N224 PolarHBondContact O-N 3.48Å; L222-N224 PolarHBondContact O-OD1 3.07Å; N224-I226 PolarHBondContact O-N 2.93Å; N224-C227 HydrophobicContact CB-CB 4.1Å; N224-T228 WeakPolarHBondContact O-CB 3.29Å; N224-T228 PolarHBondContact O-N 2.68Å; N224-T228 PolarHBondContact O-OG1 2.83Å
225P97.2Very high97.8Very high76 Ų7633.9 Ų33.949%0.49420%0.197SC..Hα-helixtrans-63.1-40.6-175.726.3-35.2000113.4E137 C223 V229E137-P225 WeakPolarHBondContact OE1-CD 3.46Å; C223-P225 WeakPolarHBondContact O-CD 3.45Å; P225-V229 PolarHBondContact O-N 3.14Å
226I97.9Very high97.8Very high106 Ų10637.7 Ų37.754%0.54421%0.21SC..Hα-helixtrans-73.7-52.8-175.4-59.3172.9000109.4E137 N224 T228 V229 L230E137-I226 PolarHBondContact OE1-N 3.34Å; N224-I226 PolarHBondContact O-N 2.93Å; I226-T228 PolarHBondContact O-N 3.22Å; I226-V229 PolarHBondContact O-N 3Å; I226-V229 VanDerWaalsContact O-N 3.11Å; I226-L230 HydrophobicContact CG2-CD1 3.95Å; I226-L230 HydrophobicContact CG2-CG 4.35Å; I226-L230 WeakPolarHBondContact O-CG 3.11Å; I226-L230 PolarHBondContact O-N 3.02Å
227C98.2Very high97.7Very high4 Ų442.8 Ų42.83%0.02723%0.231CC..Hα-helixtrans-64.3-29178.3-79.50000112.3S134 E137 Q219 N224 V229 L230 Y231S134-C227 VanDerWaalsContact CA-SG 3.6Å; E137-C227 PolarHBondContact OE1-N 3Å; E137-C227 WeakPolarHBondContact OE2-CA 3.49Å; E137-C227 WeakPolarHBondContact OE2-CB 2.99Å; E137-C227 PolarHBondContact OE2-N 3.26Å; E137-C227 PolarHBondContact OE2-SG 2.88Å; Q219-C227 HydrophobicContact CG-CB 4.2Å; Q219-C227 VanDerWaalsContact OE1-CB 3.3Å; N224-C227 HydrophobicContact CB-CB 4.1Å; C227-V229 VanDerWaalsContact C-N 3.33Å; C227-V229 PolarHBondContact O-N 3.11Å; C227-L230 PolarHBondContact O-N 2.95Å; C227-Y231 HydrophobicContact CB-CD2 4.13Å; C227-Y231 HydrophobicContact CB-CE2 4.21Å; C227-Y231 WeakPolarHBondContact O-CB 3.42Å; C227-Y231 WeakPolarHBondContact O-CD2 3.29Å; C227-Y231 PolarHBondContact O-N 3.39Å
228T98.5Very high97.6Very high31 Ų3148.2 Ų48.219%0.1926%0.255CS..Hα-helixtrans-57.6-47.9171.7-66.90000111V216 Q219 V220 N224 I226 A232V216-T228 HydrophobicContact CG1-CG2 4.15Å; Q219-T228 WeakPolarHBondContact CB-OG1 3.03Å; V220-T228 HydrophobicContact CG2-CG2 3.68Å; V220-T228 PolarHBondContact N-OG1 2.99Å; N224-T228 WeakPolarHBondContact O-CB 3.29Å; N224-T228 PolarHBondContact O-N 2.68Å; N224-T228 PolarHBondContact O-OG1 2.83Å; I226-T228 PolarHBondContact O-N 3.22Å; T228-A232 VanDerWaalsContact O-CB 3.31Å; T228-A232 WeakPolarHBondContact O-CB 3.44Å; T228-A232 PolarHBondContact O-N 3.07Å; T228-A232 VanDerWaalsContact O-N 3.08Å
229V98.5Very high97.4Very high92 Ų9248.2 Ų48.256%0.55825%0.254SS*.Hα-helixtrans-67.1-45.5178.3177.20000110.9P225 I226 C227 A232 V233P225-V229 PolarHBondContact O-N 3.14Å; I226-V229 PolarHBondContact O-N 3Å; I226-V229 VanDerWaalsContact O-N 3.11Å; C227-V229 VanDerWaalsContact C-N 3.33Å; C227-V229 PolarHBondContact O-N 3.11Å; V229-A232 PolarHBondContact O-N 3.09Å; V229-V233 HydrophobicContact CG1-CG2 4.34Å; V229-V233 WeakPolarHBondContact O-CG2 3.38Å; V229-V233 PolarHBondContact O-N 3.18Å
230L98Very high97.4Very high82 Ų8249.2 Ų49.243%0.42926%0.263SS..Hα-helixtrans-63-46.6-179.4-67177.8000112I226 C227 A232 V233 I234I226-L230 HydrophobicContact CG2-CD1 3.95Å; I226-L230 HydrophobicContact CG2-CG 4.35Å; I226-L230 WeakPolarHBondContact O-CG 3.11Å; I226-L230 PolarHBondContact O-N 3.02Å; C227-L230 PolarHBondContact O-N 2.95Å; L230-A232 VanDerWaalsContact C-N 3.31Å; L230-A232 PolarHBondContact O-N 3.33Å; L230-V233 PolarHBondContact O-N 3.42Å; L230-I234 HydrophobicContact CB-CD1 4.33Å; L230-I234 VanDerWaalsContact O-CB 3.25Å; L230-I234 WeakPolarHBondContact O-CB 3.34Å; L230-I234 VanDerWaalsContact O-CG1 3.23Å; L230-I234 WeakPolarHBondContact O-CG1 3.2Å; L230-I234 PolarHBondContact O-N 3.27Å
231Y98Very high97.2Very high28 Ų2854.9 Ų54.911%0.1129%0.288CS..Hα-helixtrans-60.7-42.3176.8-87.1-126.7000111A130 A131 S215 Q219 C227 S235A130-Y231 HydrophobicContact CB-CE2 3.76Å; A130-Y231 PolarHBondContact O-OH 2.6Å; A131-Y231 WeakPolarHBondContact CA-OH 3.06Å; A131-Y231 PolarHBondContact N-OH 3.33Å; S215-Y231 WeakPolarHBondContact O-CD1 3.01Å; Q219-Y231 HydrophobicContact CG-CD1 3.62Å; Q219-Y231 HydrophobicContact CG-CD2 3.83Å; Q219-Y231 HydrophobicContact CG-CE1 3.91Å; Q219-Y231 HydrophobicContact CG-CE2 4.09Å; Q219-Y231 HydrophobicContact CG-CG 3.58Å; C227-Y231 HydrophobicContact CB-CD2 4.13Å; C227-Y231 HydrophobicContact CB-CE2 4.21Å; C227-Y231 WeakPolarHBondContact O-CB 3.42Å; C227-Y231 WeakPolarHBondContact O-CD2 3.29Å; C227-Y231 PolarHBondContact O-N 3.39Å; Y231-S235 WeakPolarHBondContact O-CB 3.41Å; Y231-S235 PolarHBondContact O-N 3.38Å; Y231-S235 PolarHBondContact O-OG 3.15Å
232A98.1Very high97.1Very high35 Ų3557.2 Ų57.229%0.28930%0.297SS..Hα-helixtrans-62.3-51.4178.100000111.4V216 T228 V229 L230 W236V216-A232 HydrophobicContact CG1-CB 4.43Å; V216-A232 HydrophobicContact CG2-CB 3.82Å; T228-A232 VanDerWaalsContact O-CB 3.31Å; T228-A232 WeakPolarHBondContact O-CB 3.44Å; T228-A232 PolarHBondContact O-N 3.07Å; T228-A232 VanDerWaalsContact O-N 3.08Å; V229-A232 PolarHBondContact O-N 3.09Å; L230-A232 VanDerWaalsContact C-N 3.31Å; L230-A232 PolarHBondContact O-N 3.33Å; A232-W236 WeakPolarHBondContact O-CB 3.27Å; A232-W236 PolarHBondContact O-N 3.13Å
233V97.9Very high97.1Very high70 Ų7057.1 Ų57.142%0.42430%0.296SS..Hα-helixtrans-67.9-46.4-177173.80000111.9V229 L230 K237V229-V233 HydrophobicContact CG1-CG2 4.34Å; V229-V233 WeakPolarHBondContact O-CG2 3.38Å; V229-V233 PolarHBondContact O-N 3.18Å; L230-V233 PolarHBondContact O-N 3.42Å; V233-K237 HydrophobicContact CG1-CD 4.43Å; V233-K237 WeakPolarHBondContact O-CG 3.39Å; V233-K237 PolarHBondContact O-N 2.6Å
234I96.4Very high97Very high105 Ų10566.4 Ų66.454%0.53833%0.329SS..Hα-helixtrans-69.2-47.9-176.6-65.1169.8000110.3L230 W236 K237 F238L230-I234 HydrophobicContact CB-CD1 4.33Å; L230-I234 VanDerWaalsContact O-CB 3.25Å; L230-I234 WeakPolarHBondContact O-CB 3.34Å; L230-I234 VanDerWaalsContact O-CG1 3.23Å; L230-I234 WeakPolarHBondContact O-CG1 3.2Å; L230-I234 PolarHBondContact O-N 3.27Å; I234-W236 VanDerWaalsContact C-N 3.3Å; I234-W236 PolarHBondContact O-N 3.29Å; I234-K237 PolarHBondContact O-N 3.44Å; I234-F238 WeakPolarHBondContact O-CB 3.45Å; I234-F238 PolarHBondContact O-N 2.85Å
235S95.7Very high96.9Very high16 Ų1669.4 Ų69.411%0.11235%0.348CS..Hα-helixtrans-61.7-41.9177.5-57.50000110.8S215 Y231 F238 L239S215-S235 PolarHBondContact OG-OG 2.88Å; Y231-S235 WeakPolarHBondContact O-CB 3.41Å; Y231-S235 PolarHBondContact O-N 3.38Å; Y231-S235 PolarHBondContact O-OG 3.15Å; S235-F238 PolarHBondContact O-N 3.2Å; S235-L239 WeakPolarHBondContact O-CB 3.16Å; S235-L239 WeakPolarHBondContact O-CG 3.23Å; S235-L239 PolarHBondContact O-N 3.38Å
236W97.7Very high96.8Very high82 Ų8267.8 Ų67.831%0.31133%0.334SS..Hα-helixtrans-59.8-48.3177-179.988.5000112.1A232 I234 L239 A240 I269 P270 F271 V272A232-W236 WeakPolarHBondContact O-CB 3.27Å; A232-W236 PolarHBondContact O-N 3.13Å; I234-W236 VanDerWaalsContact C-N 3.3Å; I234-W236 PolarHBondContact O-N 3.29Å; W236-L239 PolarHBondContact O-N 3.11Å; W236-A240 VanDerWaalsContact O-CB 3.3Å; W236-A240 WeakPolarHBondContact O-CB 3.25Å; W236-A240 PolarHBondContact O-N 3.41Å; W236-I269 VanDerWaalsContact CD1-CG2 3.47Å; W236-I269 HydrophobicContact CG-CG2 4.45Å; W236-P270 PolarHBondContact NE1-O 2.75Å; W236-F271 HydrophobicContact CZ2-CB 4.1Å; W236-V272 HydrophobicContact CZ2-CG2 4.05Å
237K97Very high96.7Very high131 Ų13163 Ų6357%0.5731%0.309SS*.Hα-helixtrans-60.4-48.3178.5-77.3-175177.3-177.10111.7V233 I234 L239 A240 E241V233-K237 HydrophobicContact CG1-CD 4.43Å; V233-K237 WeakPolarHBondContact O-CG 3.39Å; V233-K237 PolarHBondContact O-N 2.6Å; I234-K237 PolarHBondContact O-N 3.44Å; K237-L239 VanDerWaalsContact C-N 3.35Å; K237-L239 PolarHBondContact O-N 3.11Å; K237-A240 PolarHBondContact O-N 3.45Å; K237-E241 PolarHBondContact O-N 3.38Å; K237-E241 VanDerWaalsContact O-N 3.11Å
238F95.1Very high96.5Very high113 Ų11368 Ų6850%0.49634%0.335SS..Hα-helixtrans-57.9-47178.3173.7-99.8000111.8I234 S235 R242I234-F238 WeakPolarHBondContact O-CB 3.45Å; I234-F238 PolarHBondContact O-N 2.85Å; S235-F238 PolarHBondContact O-N 3.2Å; F238-R242 VanDerWaalsContact O-CB 3.29Å; F238-R242 WeakPolarHBondContact O-CB 3.27Å; F238-R242 PolarHBondContact O-N 2.86Å
239L95.9Very high96.3Very high3 Ų367.5 Ų67.52%0.01633%0.331CS..Hα-helixtrans-68.7-38.2179.6-67.8175.3000112.2Y208 L212 S235 W236 K237 E241 R242 I243 I269Y208-L239 HydrophobicContact CD1-CD2 3.94Å; Y208-L239 HydrophobicContact CD2-CD2 4.33Å; Y208-L239 HydrophobicContact CG-CD2 3.78Å; Y208-L239 WeakPolarHBondContact O-CD1 3.45Å; L212-L239 HydrophobicContact CB-CD1 3.95Å; S235-L239 WeakPolarHBondContact O-CB 3.16Å; S235-L239 WeakPolarHBondContact O-CG 3.23Å; S235-L239 PolarHBondContact O-N 3.38Å; W236-L239 PolarHBondContact O-N 3.11Å; K237-L239 VanDerWaalsContact C-N 3.35Å; K237-L239 PolarHBondContact O-N 3.11Å; L239-E241 PolarHBondContact O-N 2.95Å; L239-R242 PolarHBondContact O-N 2.98Å; L239-I243 VanDerWaalsContact O-CB 3.31Å; L239-I243 WeakPolarHBondContact O-CB 3.26Å; L239-I243 WeakPolarHBondContact O-CD1 3.21Å; L239-I243 WeakPolarHBondContact O-CG1 3.41Å; L239-I243 PolarHBondContact O-N 3.38Å; L239-I269 HydrophobicContact CD1-CD1 3.91Å
240A97.2Very high96.1Very high21 Ų2164.1 Ų64.117%0.17431%0.31CS..Hα-helixtrans-61.6-44.5177.900000112.1W236 K237 R244 V272W236-A240 VanDerWaalsContact O-CB 3.3Å; W236-A240 WeakPolarHBondContact O-CB 3.25Å; W236-A240 PolarHBondContact O-N 3.41Å; K237-A240 PolarHBondContact O-N 3.45Å; A240-R244 PolarHBondContact O-N 3.3Å; A240-V272 HydrophobicContact CB-CG2 3.58Å
241E95.8Very high96Very high142 Ų14262.7 Ų62.766%0.66430%0.304SS*.Hα-helixtrans-65-45.3176-177.8176.9-178.900111.7K237 L239 R244 T245K237-E241 PolarHBondContact O-N 3.38Å; K237-E241 VanDerWaalsContact O-N 3.11Å; L239-E241 PolarHBondContact O-N 2.95Å; E241-R244 PolarHBondContact O-N 3.34Å; E241-T245 PolarHBondContact O-N 2.95Å; E241-T245 PolarHBondContact O-OG1 2.79Å
242R94.7Very high95.8Very high50 Ų5067.2 Ų67.219%0.18933%0.33CS..Hα-helixtrans-62.1-46.4179.1-175.4174.3174112.22.2112.2H182 V184 Y208 F238 L239 R244 T245 E246H182-R242 PolarHBondContact O-NH2 3.38Å; V184-R242 HydrophobicContact CG2-CG 4.06Å; Y208-R242 HydrophobicContact CE2-CG 4.42Å; Y208-R242 PolarHBondContact OH-NE 3.38Å; Y208-R242 PolarHBondContact OH-NH2 2.94Å; F238-R242 VanDerWaalsContact O-CB 3.29Å; F238-R242 WeakPolarHBondContact O-CB 3.27Å; F238-R242 PolarHBondContact O-N 2.86Å; L239-R242 PolarHBondContact O-N 2.98Å; R242-R244 VanDerWaalsContact C-N 3.34Å; R242-R244 PolarHBondContact O-N 2.6Å; R242-T245 PolarHBondContact O-N 3.31Å; R242-E246 WeakPolarHBondContact O-CB 3.18Å; R242-E246 PolarHBondContact O-N 3.47Å
243I96.5Very high95.6Very high1 Ų167 Ų671%0.00532%0.322CS..Hα-helixtrans-56.3-49.1176-74.8168.2000109.8H205 Y208 L239 T245 E246 E247 I269 V272H205-I243 HydrophobicContact CB-CD1 4.4Å; Y208-I243 HydrophobicContact CD2-CD1 3.97Å; Y208-I243 HydrophobicContact CD2-CG1 3.55Å; Y208-I243 HydrophobicContact CE2-CG1 3.88Å; L239-I243 VanDerWaalsContact O-CB 3.31Å; L239-I243 WeakPolarHBondContact O-CB 3.26Å; L239-I243 WeakPolarHBondContact O-CD1 3.21Å; L239-I243 WeakPolarHBondContact O-CG1 3.41Å; L239-I243 PolarHBondContact O-N 3.38Å; I243-T245 VanDerWaalsContact C-N 3.27Å; I243-T245 PolarHBondContact O-N 2.78Å; I243-E246 PolarHBondContact O-N 3.11Å; I243-E247 HydrophobicContact CG2-CG 3.83Å; I243-E247 WeakPolarHBondContact O-CB 3.46Å; I243-E247 VanDerWaalsContact O-CG 3.23Å; I243-E247 WeakPolarHBondContact O-CG 3.45Å; I243-E247 PolarHBondContact O-N 3.5Å; I243-I269 HydrophobicContact CD1-CB 4.11Å; I243-I269 HydrophobicContact CD1-CG1 3.48Å; I243-I269 VanDerWaalsContact CD1-CG1 3.48Å; I243-V272 HydrophobicContact CB-CG1 4.28Å; I243-V272 HydrophobicContact CD1-CG1 4.19Å; I243-V272 HydrophobicContact CG2-CG1 3.85Å
244R95.6Very high95.4Very high207 Ų20764.9 Ų64.978%0.78131%0.307SS*.Hα-helixtrans-55.1-43.4-179.8-178.6179.9175.6152.6-0.8112.6A240 E241 R242 L248A240-R244 PolarHBondContact O-N 3.3Å; E241-R244 PolarHBondContact O-N 3.34Å; R242-R244 VanDerWaalsContact C-N 3.34Å; R242-R244 PolarHBondContact O-N 2.6Å; R244-L248 PolarHBondContact O-N 3.03Å
245T95Very high95.3Very high62 Ų6261.3 Ų61.338%0.3830%0.296SS..Hα-helixtrans-68.2-46.4179.5-57.80000111.4E241 R242 I243 L248 L249E241-T245 PolarHBondContact O-N 2.95Å; E241-T245 PolarHBondContact O-OG1 2.79Å; R242-T245 PolarHBondContact O-N 3.31Å; I243-T245 VanDerWaalsContact C-N 3.27Å; I243-T245 PolarHBondContact O-N 2.78Å; T245-L248 PolarHBondContact O-N 2.96Å; T245-L249 PolarHBondContact O-N 3.06Å
246E95Very high95.4Very high43 Ų4365.3 Ų65.320%0.20132%0.32CS..Hα-helixtrans-66.4-42.2-179.4-175.8170.4179.900112.5V184 Y208 R242 I243 L248 L249 L250V184-E246 HydrophobicContact CG1-CB 4.29Å; V184-E246 HydrophobicContact CG2-CB 4.48Å; Y208-E246 WeakPolarHBondContact CE2-OE2 3.12Å; Y208-E246 VanDerWaalsContact CZ-OE2 3.28Å; Y208-E246 PolarHBondContact OH-OE2 3.39Å; R242-E246 WeakPolarHBondContact O-CB 3.18Å; R242-E246 PolarHBondContact O-N 3.47Å; I243-E246 PolarHBondContact O-N 3.11Å; E246-L248 VanDerWaalsContact C-N 3.28Å; E246-L248 PolarHBondContact O-N 2.96Å; E246-L249 CarbonylContact O-C 3.6Å; E246-L249 WeakPolarHBondContact O-CB 3.19Å; E246-L249 PolarHBondContact O-N 3.39Å; E246-L249 VanDerWaalsContact O-N 3.1Å; E246-L250 HydrophobicContact CG-CD1 4.11Å; E246-L250 HydrophobicContact CG-CG 4.42Å; E246-L250 WeakPolarHBondContact O-CG 3.36Å; E246-L250 PolarHBondContact O-N 3.48Å
247E95.7Very high95.3Very high6 Ų668.6 Ų68.63%0.02834%0.337CS..Hα-helixtrans-65.2-32.7178.1-63.7-152.5160.300112.2R204 H205 I243 L250 V251 Y258 R262R204-E247 IonicContact CZ-OE1 3.91Å; R204-E247 VanDerWaalsContact CZ-OE1 3.25Å; R204-E247 IonicContact CZ-OE2 3.92Å; R204-E247 IonicContact NE-OE1 2.71Å; R204-E247 PolarHBondContact NE-OE1 3.3Å; R204-E247 VanDerWaalsContact NH2-CD 3.28Å; R204-E247 IonicContact NH2-OE1 3.07Å; R204-E247 PolarHBondContact NH2-OE1 3.36Å; R204-E247 IonicContact NH2-OE2 3.25Å; R204-E247 PolarHBondContact NH2-OE2 2.88Å; H205-E247 IonicContact CD2-OE1 3.94Å; H205-E247 IonicContact NE2-OE1 2.71Å; H205-E247 PolarHBondContact NE2-OE1 3.36Å; I243-E247 HydrophobicContact CG2-CG 3.83Å; I243-E247 WeakPolarHBondContact O-CB 3.46Å; I243-E247 VanDerWaalsContact O-CG 3.23Å; I243-E247 WeakPolarHBondContact O-CG 3.45Å; I243-E247 PolarHBondContact O-N 3.5Å; E247-L250 PolarHBondContact O-N 2.74Å; E247-V251 WeakPolarHBondContact O-CG2 3.42Å; E247-V251 PolarHBondContact O-N 3.3Å; E247-Y258 HydrophobicContact CB-CE1 4Å; E247-Y258 HydrophobicContact CG-CE1 4.28Å; E247-Y258 WeakPolarHBondContact CG-OH 3.37Å; E247-Y258 PolarHBondContact OE1-OH 3.46Å; E247-R262 IonicContact OE2-CZ 2.79Å; E247-R262 VanDerWaalsContact OE2-CZ 3.25Å; E247-R262 IonicContact OE2-NE 2.92Å; E247-R262 PolarHBondContact OE2-NE 2.83Å; E247-R262 IonicContact OE2-NH2 3.52Å; E247-R262 PolarHBondContact OE2-NH2 2.97Å
248L95.2Very high95.3Very high109 Ų10962.5 Ų62.557%0.57131%0.31SS*.Hα-helixtrans-62.8-43.4172-177.5137.8000111.1R244 T245 E246 V251 L252R244-L248 PolarHBondContact O-N 3.03Å; T245-L248 PolarHBondContact O-N 2.96Å; E246-L248 VanDerWaalsContact C-N 3.28Å; E246-L248 PolarHBondContact O-N 2.96Å; L248-V251 PolarHBondContact O-N 3.49Å; L248-L252 HydrophobicContact CD2-CD1 3.85Å; L248-L252 WeakPolarHBondContact O-CG 3.44Å; L248-L252 PolarHBondContact O-N 3.38Å
249L94.2Very high95.4Very high19 Ų1960 Ų6010%0.09931%0.305CS..Hα-helixtrans-66-38.3175.1-65.7167.3000112V184 F186 T245 E246 V251 L252 F253V184-L249 HydrophobicContact CG1-CD1 3.39Å; F186-L249 HydrophobicContact CD1-CD1 3.74Å; F186-L249 HydrophobicContact CD1-CD2 4.15Å; F186-L249 HydrophobicContact CE1-CD1 3.94Å; F186-L249 HydrophobicContact CG-CD1 4.32Å; T245-L249 PolarHBondContact O-N 3.06Å; E246-L249 CarbonylContact O-C 3.6Å; E246-L249 WeakPolarHBondContact O-CB 3.19Å; E246-L249 PolarHBondContact O-N 3.39Å; E246-L249 VanDerWaalsContact O-N 3.1Å; L249-V251 PolarHBondContact O-N 3Å; L249-L252 HydrophobicContact CD2-CD1 4.37Å; L249-L252 CarbonylContact O-C 3.57Å; L249-L252 WeakPolarHBondContact O-CB 3.37Å; L249-L252 PolarHBondContact O-N 3.45Å; L249-L252 VanDerWaalsContact O-N 3.13Å; L249-F253 HydrophobicContact CB-CE2 4.13Å; L249-F253 HydrophobicContact CB-CZ 4.21Å; L249-F253 HydrophobicContact CD2-CZ 4.43Å; L249-F253 WeakPolarHBondContact O-CB 3.34Å; L249-F253 WeakPolarHBondContact O-CD1 3.18Å; L249-F253 WeakPolarHBondContact O-CD2 3.21Å; L249-F253 WeakPolarHBondContact O-CG 3.38Å; L249-F253 PolarHBondContact O-N 2.91Å
250L94.4Very high95.5Very high22 Ų2267.3 Ų67.312%0.11534%0.336CS..Hα-helixtrans-65.7-37176.5-69.1170.4000112.2E246 E247 F253 F254 Y258E246-L250 HydrophobicContact CG-CD1 4.11Å; E246-L250 HydrophobicContact CG-CG 4.42Å; E246-L250 WeakPolarHBondContact O-CG 3.36Å; E246-L250 PolarHBondContact O-N 3.48Å; E247-L250 PolarHBondContact O-N 2.74Å; L250-F253 PolarHBondContact O-N 3.31Å; L250-F254 HydrophobicContact CD2-CD2 4.02Å; L250-F254 HydrophobicContact CD2-CE2 3.78Å; L250-F254 WeakPolarHBondContact O-CB 3.5Å; L250-F254 PolarHBondContact O-N 2.86Å; L250-Y258 HydrophobicContact CB-CD1 3.87Å; L250-Y258 HydrophobicContact CB-CD2 3.76Å; L250-Y258 HydrophobicContact CB-CE1 3.83Å; L250-Y258 HydrophobicContact CB-CE2 3.74Å; L250-Y258 HydrophobicContact CB-CG 3.83Å; L250-Y258 HydrophobicContact CD1-CD2 4.26Å; L250-Y258 HydrophobicContact CD1-CE1 4.44Å; L250-Y258 HydrophobicContact CD1-CE2 3.49Å; L250-Y258 VanDerWaalsContact CD1-CE2 3.49Å; L250-Y258 HydrophobicContact CG-CE2 4.17Å
251V95.3Very high95.5Very high52 Ų5267.2 Ų67.232%0.31533%0.331SS..Hα-helixtrans-62.5-43.4169.71730000110.6E247 L248 L249 F253 G255 Y258 T259E247-V251 WeakPolarHBondContact O-CG2 3.42Å; E247-V251 PolarHBondContact O-N 3.3Å; L248-V251 PolarHBondContact O-N 3.49Å; L249-V251 PolarHBondContact O-N 3Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 2.86Å; V251-G255 WeakPolarHBondContact O-CA 3.16Å; V251-G255 PolarHBondContact O-N 3.49Å; V251-Y258 HydrophobicContact CG2-CD1 3.66Å; V251-Y258 HydrophobicContact CG2-CE1 4.23Å; V251-T259 HydrophobicContact CG1-CG2 4.41Å; V251-T259 HydrophobicContact CG2-CG2 4.11Å
252L93.9Very high95.5Very high123 Ų12365.3 Ų65.364%0.64432%0.318SS*.Hα-helixtrans-63.9-36.9177.1-68.6171.4000112.3L248 L249L248-L252 HydrophobicContact CD2-CD1 3.85Å; L248-L252 WeakPolarHBondContact O-CG 3.44Å; L248-L252 PolarHBondContact O-N 3.38Å; L249-L252 HydrophobicContact CD2-CD1 4.37Å; L249-L252 CarbonylContact O-C 3.57Å; L249-L252 WeakPolarHBondContact O-CB 3.37Å; L249-L252 PolarHBondContact O-N 3.45Å; L249-L252 VanDerWaalsContact O-N 3.13Å
253F93Very high95.6Very high30 Ų3067 Ų6713%0.13234%0.342CS..Hα-helixtrans-79.6-38.1-177.1-64.1-16.6000113.9S185 R188 L249 L250 V251S185-F253 VanDerWaalsContact O-CE2 3.26Å; S185-F253 WeakPolarHBondContact O-CE2 3.36Å; S185-F253 WeakPolarHBondContact O-CZ 3.35Å; R188-F253 HydrophobicContact CB-CD1 3.79Å; R188-F253 HydrophobicContact CB-CD2 4.39Å; R188-F253 HydrophobicContact CB-CE1 4Å; R188-F253 HydrophobicContact CB-CG 4.01Å; R188-F253 HydrophobicContact CB-CZ 4.39Å; R188-F253 HydrophobicContact CG-CB 4.47Å; R188-F253 HydrophobicContact CG-CG 4.33Å; R188-F253 PolarHBondContact NH1-O 3.26Å; L249-F253 HydrophobicContact CB-CE2 4.13Å; L249-F253 HydrophobicContact CB-CZ 4.21Å; L249-F253 HydrophobicContact CD2-CZ 4.43Å; L249-F253 WeakPolarHBondContact O-CB 3.34Å; L249-F253 WeakPolarHBondContact O-CD1 3.18Å; L249-F253 WeakPolarHBondContact O-CD2 3.21Å; L249-F253 WeakPolarHBondContact O-CG 3.38Å; L249-F253 PolarHBondContact O-N 2.91Å; L250-F253 PolarHBondContact O-N 3.31Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 2.86Å
254F94.4Very high95.6Very high26 Ų2672.7 Ų72.711%0.11438%0.377CS..Hα-helixtrans-120.4-7.5-169.5-61.2-68.9000114.2H192 L194 L250 T256 K257H192-F254 AromaticContact CD2-CZ 3.69Å; H192-F254 WeakPolarHBondContact O-CE1 3.3Å; L194-F254 HydrophobicContact CB-CD1 3.83Å; L194-F254 HydrophobicContact CB-CD2 4.13Å; L194-F254 HydrophobicContact CB-CE1 3.89Å; L194-F254 HydrophobicContact CB-CE2 4.18Å; L194-F254 HydrophobicContact CB-CG 3.96Å; L194-F254 HydrophobicContact CB-CZ 4.05Å; L194-F254 HydrophobicContact CD1-CD2 4.29Å; L194-F254 HydrophobicContact CD1-CE2 4.48Å; L194-F254 HydrophobicContact CD2-CB 4.4Å; L194-F254 HydrophobicContact CD2-CG 4.49Å; L250-F254 HydrophobicContact CD2-CD2 4.02Å; L250-F254 HydrophobicContact CD2-CE2 3.78Å; L250-F254 WeakPolarHBondContact O-CB 3.5Å; L250-F254 PolarHBondContact O-N 2.86Å; F254-T256 PolarHBondContact O-N 3.26Å; F254-K257 HydrophobicContact CB-CB 4.47Å; F254-K257 PolarHBondContact O-N 2.92Å
255G94.7Very high95.8Very high30 Ų3063.4 Ų63.431%0.30934%0.343SS..THydrogen-bonded Turntrans53.9-127.3176.700000112.7V251 K257 Y258 T259V251-G255 WeakPolarHBondContact O-CA 3.16Å; V251-G255 PolarHBondContact O-N 3.49Å; G255-K257 PolarHBondContact O-N 3.41Å; G255-Y258 PolarHBondContact O-N 2.92Å; G255-Y258 VanDerWaalsContact O-N 3.14Å; G255-T259 PolarHBondContact O-N 2.87Å
256T96.5Very high95.9Very high100 Ų10064.2 Ų64.261%0.61335%0.35SS*.Hα-helixtrans-64-22.9-175.256.60000114.1F254 T259 K260F254-T256 PolarHBondContact O-N 3.26Å; T256-T259 WeakPolarHBondContact CA-OG1 3.11Å; T256-T259 PolarHBondContact O-OG1 3.33Å; T256-K260 WeakPolarHBondContact O-CB 3.41Å; T256-K260 VanDerWaalsContact O-CG 3.31Å; T256-K260 WeakPolarHBondContact O-CG 3.25Å; T256-K260 PolarHBondContact O-N 2.98Å; T256-K260 VanDerWaalsContact O-N 3.07Å
257K96.4Very high96Very high151 Ų15162.3 Ų62.366%0.65734%0.341SS*.Hα-helixtrans-63.8-44.8175-66.9-174.9177.2-176.70110.7L194 F254 G255 Y261L194-K257 HydrophobicContact CD2-CB 4.03Å; F254-K257 HydrophobicContact CB-CB 4.47Å; F254-K257 PolarHBondContact O-N 2.92Å; G255-K257 PolarHBondContact O-N 3.41Å; K257-Y261 PolarHBondContact O-N 2.91Å
258Y96.8Very high96Very high2 Ų263.1 Ų63.11%0.00835%0.351CS..Hα-helixtrans-71.7-39.8178.9-173.1-102.6000112.1L194 E247 L250 V251 G255 K260 Y261 R262L194-Y258 HydrophobicContact CD1-CD2 3.68Å; L194-Y258 HydrophobicContact CD1-CE2 4.27Å; L194-Y258 HydrophobicContact CD2-CD2 4.3Å; E247-Y258 HydrophobicContact CB-CE1 4Å; E247-Y258 HydrophobicContact CG-CE1 4.28Å; E247-Y258 WeakPolarHBondContact CG-OH 3.37Å; E247-Y258 PolarHBondContact OE1-OH 3.46Å; L250-Y258 HydrophobicContact CB-CD1 3.87Å; L250-Y258 HydrophobicContact CB-CD2 3.76Å; L250-Y258 HydrophobicContact CB-CE1 3.83Å; L250-Y258 HydrophobicContact CB-CE2 3.74Å; L250-Y258 HydrophobicContact CB-CG 3.83Å; L250-Y258 HydrophobicContact CD1-CD2 4.26Å; L250-Y258 HydrophobicContact CD1-CE1 4.44Å; L250-Y258 HydrophobicContact CD1-CE2 3.49Å; L250-Y258 VanDerWaalsContact CD1-CE2 3.49Å; L250-Y258 HydrophobicContact CG-CE2 4.17Å; V251-Y258 HydrophobicContact CG2-CD1 3.66Å; V251-Y258 HydrophobicContact CG2-CE1 4.23Å; G255-Y258 PolarHBondContact O-N 2.92Å; G255-Y258 VanDerWaalsContact O-N 3.14Å; Y258-K260 VanDerWaalsContact C-N 3.33Å; Y258-K260 PolarHBondContact O-N 3.42Å; Y258-Y261 AromaticContact CD2-CD1 3.95Å; Y258-Y261 HydrophobicContact CD2-CD1 3.95Å; Y258-Y261 AromaticContact CE2-CD1 3.85Å; Y258-Y261 HydrophobicContact CE2-CD1 3.85Å; Y258-Y261 HydrophobicContact CE2-CE1 4.13Å; Y258-Y261 PolarHBondContact O-N 3.25Å; Y258-R262 HydrophobicContact CE1-CB 4.35Å; Y258-R262 VanDerWaalsContact O-CB 3.27Å; Y258-R262 WeakPolarHBondContact O-CB 3.47Å; Y258-R262 PolarHBondContact O-N 2.74Å
259T96.9Very high96.1Very high62 Ų6258.2 Ų58.238%0.3833%0.326SS..Hα-helixtrans-65.1-36.7178.961.70000112.5V251 G255 T256 R262 A263V251-T259 HydrophobicContact CG1-CG2 4.41Å; V251-T259 HydrophobicContact CG2-CG2 4.11Å; G255-T259 PolarHBondContact O-N 2.87Å; T256-T259 WeakPolarHBondContact CA-OG1 3.11Å; T256-T259 PolarHBondContact O-OG1 3.33Å; T259-R262 PolarHBondContact O-N 3.22Å; T259-A263 PolarHBondContact O-N 3.05Å
260K97.6Very high96.1Very high156 Ų15660.8 Ų60.868%0.67834%0.343SS*.Hα-helixtrans-63.5-45172.5-75.5-180179.1-174.50112.1T256 Y258 A263T256-K260 WeakPolarHBondContact O-CB 3.41Å; T256-K260 VanDerWaalsContact O-CG 3.31Å; T256-K260 WeakPolarHBondContact O-CG 3.25Å; T256-K260 PolarHBondContact O-N 2.98Å; T256-K260 VanDerWaalsContact O-N 3.07Å; Y258-K260 VanDerWaalsContact C-N 3.33Å; Y258-K260 PolarHBondContact O-N 3.42Å; K260-A263 PolarHBondContact O-N 3.23Å
261Y97.5Very high96.1Very high19 Ų1969 Ų698%0.07538%0.379CS..Hα-helixtrans-61.9-45.4175.2169.4-119.3000112L194 T196 Y200 R204 K257 Y258 A263 V264 V265L194-Y261 HydrophobicContact CD1-CD1 4.4Å; T196-Y261 HydrophobicContact CG2-CD1 4.17Å; T196-Y261 HydrophobicContact CG2-CD2 3.46Å; T196-Y261 VanDerWaalsContact CG2-CD2 3.46Å; T196-Y261 HydrophobicContact CG2-CE1 4.35Å; T196-Y261 HydrophobicContact CG2-CE2 3.68Å; T196-Y261 HydrophobicContact CG2-CG 3.71Å; Y200-Y261 WeakPolarHBondContact O-CE2 3.46Å; Y200-Y261 PolarHBondContact O-OH 2.63Å; R204-Y261 WeakPolarHBondContact CA-OH 3.47Å; R204-Y261 HydrophobicContact CB-CE1 4.03Å; R204-Y261 HydrophobicContact CG-CD1 4.31Å; R204-Y261 HydrophobicContact CG-CE1 3.62Å; R204-Y261 HydrophobicContact CG-CE2 4.48Å; K257-Y261 PolarHBondContact O-N 2.91Å; Y258-Y261 AromaticContact CD2-CD1 3.95Å; Y258-Y261 HydrophobicContact CD2-CD1 3.95Å; Y258-Y261 AromaticContact CE2-CD1 3.85Å; Y258-Y261 HydrophobicContact CE2-CD1 3.85Å; Y258-Y261 HydrophobicContact CE2-CE1 4.13Å; Y258-Y261 PolarHBondContact O-N 3.25Å; Y261-A263 PolarHBondContact O-N 2.9Å; Y261-V264 PolarHBondContact O-N 3.42Å; Y261-V265 HydrophobicContact CD2-CB 4.13Å; Y261-V265 HydrophobicContact CD2-CG2 3.62Å; Y261-V265 HydrophobicContact CE2-CB 3.8Å; Y261-V265 HydrophobicContact CE2-CG1 4.06Å; Y261-V265 HydrophobicContact CE2-CG2 3.45Å; Y261-V265 VanDerWaalsContact CE2-CG2 3.45Å; Y261-V265 PolarHBondContact O-N 2.96Å
262R96.8Very high96Very high102 Ų10267.7 Ų67.739%0.38537%0.37SS..Hα-helixtrans-57.4-34.4176-179.3170.1-170.3-153.63.3113.4R204 E247 Y258 T259 V264 R273R204-R262 PolarHBondContact NH1-O 3.47Å; E247-R262 IonicContact OE2-CZ 2.79Å; E247-R262 VanDerWaalsContact OE2-CZ 3.25Å; E247-R262 IonicContact OE2-NE 2.92Å; E247-R262 PolarHBondContact OE2-NE 2.83Å; E247-R262 IonicContact OE2-NH2 3.52Å; E247-R262 PolarHBondContact OE2-NH2 2.97Å; Y258-R262 HydrophobicContact CE1-CB 4.35Å; Y258-R262 VanDerWaalsContact O-CB 3.27Å; Y258-R262 WeakPolarHBondContact O-CB 3.47Å; Y258-R262 PolarHBondContact O-N 2.74Å; T259-R262 PolarHBondContact O-N 3.22Å; R262-V264 VanDerWaalsContact C-N 3.27Å; R262-V264 PolarHBondContact O-N 3.39Å; R262-R273 PolarHBondContact NH2-O 3.2Å
263A96.9Very high95.6Very high84 Ų8472.9 Ų72.969%0.69438%0.381SS*.Hα-helixtrans-69.2-23-178.300000113.9T259 K260 Y261T259-A263 PolarHBondContact O-N 3.05Å; K260-A263 PolarHBondContact O-N 3.23Å; Y261-A263 PolarHBondContact O-N 2.9Å
264V96.9Very high95.7Very high121 Ų12175 Ų7573%0.73339%0.394SS*.Hα-helixtrans-119.4-19.1-172.2-60.50000114.2Y261 R262Y261-V264 PolarHBondContact O-N 3.42Å; R262-V264 VanDerWaalsContact C-N 3.27Å; R262-V264 PolarHBondContact O-N 3.39Å
265V97.9Very high95.8Very high13 Ų1377.6 Ų77.68%0.07941%0.408CS..SBendtrans-110.3126.9178.2-175.70000109.8Y200 R204 Y261Y200-V265 WeakPolarHBondContact O-CG1 3.32Å; R204-V265 VanDerWaalsContact CD-O 3.29Å; R204-V265 WeakPolarHBondContact CD-O 3.46Å; R204-V265 HydrophobicContact CG-CB 3.81Å; R204-V265 HydrophobicContact CG-CG1 3.64Å; R204-V265 WeakPolarHBondContact CG-O 3.26Å; R204-V265 PolarHBondContact NH1-O 3.39Å; Y261-V265 HydrophobicContact CD2-CB 4.13Å; Y261-V265 HydrophobicContact CD2-CG2 3.62Å; Y261-V265 HydrophobicContact CE2-CB 3.8Å; Y261-V265 HydrophobicContact CE2-CG1 4.06Å; Y261-V265 HydrophobicContact CE2-CG2 3.45Å; Y261-V265 VanDerWaalsContact CE2-CG2 3.45Å; Y261-V265 PolarHBondContact O-N 2.96Å
266P97.6Very high95.8Very high79 Ų7980.2 Ų80.251%0.51341%0.414SS..  trans-69158.5177.730-36.1000111.9I202 C203 R204 G268I202-P266 WeakPolarHBondContact O-CD 3.32Å; I202-P266 WeakPolarHBondContact O-CG 3.37Å; C203-P266 CarbonylContact C-O 3.03Å; C203-P266 VanDerWaalsContact CA-O 3.27Å; C203-P266 WeakPolarHBondContact CA-O 3.24Å; R204-P266 WeakPolarHBondContact CG-O 3.23Å; R204-P266 PolarHBondContact N-O 3.38Å; P266-G268 PolarHBondContact O-N 2.9Å
267S97.2Very high95.8Very high2 Ų279.1 Ų79.11%0.01440%0.402CS..  trans-59-34.1176.768.50000113R204 H205 I269 V272R204-S267 PolarHBondContact N-O 3.34Å; H205-S267 PolarHBondContact N-O 3.29Å; S267-I269 PolarHBondContact OG-N 2.94Å; S267-I269 VanDerWaalsContact OG-N 3.12Å; S267-I269 PolarHBondContact OG-O 2.84Å; S267-I269 VanDerWaalsContact OG-O 3.14Å; S267-V272 WeakPolarHBondContact CB-O 3.13Å; S267-V272 PolarHBondContact OG-O 3.28Å
268G96.6Very high95.8Very high24 Ų2474.6 Ų74.625%0.24739%0.386CS..SBendtrans94.2-9.5-171.600000113.8T209 P266T209-G268 WeakPolarHBondContact CG2-O 3.48Å; T209-G268 WeakPolarHBondContact OG1-CA 3.49Å; T209-G268 PolarHBondContact OG1-O 2.95Å; P266-G268 PolarHBondContact O-N 2.9Å
269I97.2Very high95.7Very high6 Ų679.4 Ų79.43%0.03141%0.412CS..SBendtrans-103.3126.8173.4-57.5-57.7000108.4L212 W236 L239 I243 S267 F271 V272L212-I269 HydrophobicContact CB-CD1 4.39Å; L212-I269 HydrophobicContact CD2-CD1 4.03Å; W236-I269 VanDerWaalsContact CD1-CG2 3.47Å; W236-I269 HydrophobicContact CG-CG2 4.45Å; L239-I269 HydrophobicContact CD1-CD1 3.91Å; I243-I269 HydrophobicContact CD1-CB 4.11Å; I243-I269 HydrophobicContact CD1-CG1 3.48Å; I243-I269 VanDerWaalsContact CD1-CG1 3.48Å; S267-I269 PolarHBondContact OG-N 2.94Å; S267-I269 VanDerWaalsContact OG-N 3.12Å; S267-I269 PolarHBondContact OG-O 2.84Å; S267-I269 VanDerWaalsContact OG-O 3.14Å; I269-F271 PolarHBondContact O-N 2.97Å; I269-V272 HydrophobicContact CB-CB 4.09Å; I269-V272 HydrophobicContact CB-CG2 4.01Å; I269-V272 HydrophobicContact CG2-CB 4.26Å; I269-V272 HydrophobicContact CG2-CG2 3.63Å; I269-V272 PolarHBondContact O-N 3.4Å
270P94.4Very high95.6Very high72 Ų7280.6 Ų80.647%0.46841%0.414SS..THydrogen-bonded Turntrans-52.2138.8-179.2-27.434.8000111.8W236 V272W236-P270 PolarHBondContact NE1-O 2.75Å; P270-V272 PolarHBondContact O-N 3.42Å
271F93.9Very high95.5Very high196 Ų19674.8 Ų74.886%0.8639%0.393SS*.THydrogen-bonded Turntrans61.48.7177.6-41.5-71000116.5W236 I269W236-F271 HydrophobicContact CZ2-CB 4.1Å; I269-F271 PolarHBondContact O-N 2.97Å
272V93.4Very high95.3Very high24 Ų2479.5 Ų79.515%0.14542%0.42CS..  trans-105.3120.9172.6-178.50000108.9W236 A240 I243 S267 I269 P270W236-V272 HydrophobicContact CZ2-CG2 4.05Å; A240-V272 HydrophobicContact CB-CG2 3.58Å; I243-V272 HydrophobicContact CB-CG1 4.28Å; I243-V272 HydrophobicContact CD1-CG1 4.19Å; I243-V272 HydrophobicContact CG2-CG1 3.85Å; S267-V272 WeakPolarHBondContact CB-O 3.13Å; S267-V272 PolarHBondContact OG-O 3.28Å; I269-V272 HydrophobicContact CB-CB 4.09Å; I269-V272 HydrophobicContact CB-CG2 4.01Å; I269-V272 HydrophobicContact CG2-CB 4.26Å; I269-V272 HydrophobicContact CG2-CG2 3.63Å; I269-V272 PolarHBondContact O-N 3.4Å; P270-V272 PolarHBondContact O-N 3.42Å
273R84.5Confident95.1Very high231 Ų23177.5 Ų77.587%0.87242%0.423SS*.  trans-84.90-173.6-81.2-168.1-177.4174.71.9115R204 R262R204-R273 PolarHBondContact NH1-OXT 2.92Å; R204-R273 VanDerWaalsContact NH1-OXT 3.11Å; R204-R273 PolarHBondContact NH2-O 3.34Å; R204-R273 PolarHBondContact NH2-OXT 3.48Å; R262-R273 PolarHBondContact NH2-O 3.2Å

Retrieved 273 of 273 residues in 1873.8 ms (Link to these results)

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