A0A3Q0KMQ5_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMQ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 327 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M32.5Very low62.6Low223 Ų22396.9 Ų96.9100%1.09950%0.503SS*.  0133.70-92167.5103.700108.7
2N47.9Very low64.7Low59 Ų5993 Ų9332%0.31648%0.477SS..  trans83.6-3.1149.4-650.6000124T4 V5 Y6N2-T4 PolarHBondContact O-N 3.29Å; N2-V5 HydrophobicContact CB-CB 4.34Å; N2-V5 PolarHBondContact O-N 3.29Å; N2-Y6 HydrophobicContact CB-CD2 3.4Å; N2-Y6 HydrophobicContact CB-CE2 3.29Å; N2-Y6 HydrophobicContact CB-CG 4.32Å; N2-Y6 VanDerWaalsContact O-CB 3.32Å; N2-Y6 WeakPolarHBondContact O-CB 3.19Å; N2-Y6 WeakPolarHBondContact O-CD2 3.22Å; N2-Y6 PolarHBondContact O-N 3.28Å
3E46.2Very low66.8Low169 Ų16992.1 Ų92.179%0.7947%0.472SS*.Hα-helixtrans-59.8-47.2177.7-78.1-171.7175.300113.1V5 Y6 V7E3-V5 PolarHBondContact O-N 2.95Å; E3-Y6 PolarHBondContact O-N 2.89Å; E3-V7 WeakPolarHBondContact O-CG2 3.38Å; E3-V7 PolarHBondContact O-N 3.24Å
4T52Low68.7Low111 Ų11191.9 Ų91.968%0.68147%0.471SS*.Hα-helixtrans-66.2-36.2175.754.60000112.7N2 T8N2-T4 PolarHBondContact O-N 3.29Å; T4-T8 WeakPolarHBondContact O-CB 3.16Å; T4-T8 WeakPolarHBondContact O-CG2 3.25Å; T4-T8 PolarHBondContact O-N 3.08Å; T4-T8 PolarHBondContact O-OG1 3.11Å
5V56.2Low70.3Confident74 Ų7485.7 Ų85.745%0.44844%0.44SS..Hα-helixtrans-67.4-42.9176.7-178.90000110.8N2 E3 T8 L9N2-V5 HydrophobicContact CB-CB 4.34Å; N2-V5 PolarHBondContact O-N 3.29Å; E3-V5 PolarHBondContact O-N 2.95Å; V5-T8 PolarHBondContact O-N 2.73Å; V5-T8 PolarHBondContact O-OG1 3.13Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; V5-L9 PolarHBondContact O-N 3.41Å
6Y54.5Low71.9Confident158 Ų15882.1 Ų82.162%0.6242%0.421SS*.Hα-helixtrans-66.2-40.5177.7-80.2-59.6000112N2 E3 T8 P10N2-Y6 HydrophobicContact CB-CD2 3.4Å; N2-Y6 HydrophobicContact CB-CE2 3.29Å; N2-Y6 HydrophobicContact CB-CG 4.32Å; N2-Y6 VanDerWaalsContact O-CB 3.32Å; N2-Y6 WeakPolarHBondContact O-CB 3.19Å; N2-Y6 WeakPolarHBondContact O-CD2 3.22Å; N2-Y6 PolarHBondContact O-N 3.28Å; E3-Y6 PolarHBondContact O-N 2.89Å; Y6-T8 VanDerWaalsContact C-N 3.33Å; Y6-P10 WeakPolarHBondContact O-CD 3.24Å
7V60.5Low73.3Confident77 Ų7782.8 Ų82.847%0.46743%0.425SS..Hα-helixtrans-67.5-36.3176.6174.50000111.1E3 I11 P271E3-V7 WeakPolarHBondContact O-CG2 3.38Å; E3-V7 PolarHBondContact O-N 3.24Å; V7-I11 HydrophobicContact CG1-CD1 4.26Å; V7-I11 WeakPolarHBondContact O-CD1 3.37Å; V7-I11 WeakPolarHBondContact O-CG1 3.41Å; V7-P271 HydrophobicContact CG1-CG 3.87Å
8T78.2Confident74.6Confident12 Ų1279.4 Ų79.47%0.07441%0.407CS..Hα-helixtrans-76.5-27.3-178.7570000113.6T4 V5 Y6 I11 R12 G269T4-T8 WeakPolarHBondContact O-CB 3.16Å; T4-T8 WeakPolarHBondContact O-CG2 3.25Å; T4-T8 PolarHBondContact O-N 3.08Å; T4-T8 PolarHBondContact O-OG1 3.11Å; V5-T8 PolarHBondContact O-N 2.73Å; V5-T8 PolarHBondContact O-OG1 3.13Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; Y6-T8 VanDerWaalsContact C-N 3.33Å; T8-I11 PolarHBondContact O-N 3.07Å; T8-R12 VanDerWaalsContact O-CG 3.24Å; T8-R12 WeakPolarHBondContact O-CG 3.21Å; T8-R12 PolarHBondContact O-N 3Å; T8-R12 PolarHBondContact OG1-NH2 2.95Å; T8-G269 WeakPolarHBondContact CG2-O 3.47Å
9L83.7Confident75.7Confident82 Ų8275.3 Ų75.343%0.42939%0.386SS..Hα-helixtrans-63.3-50.2-176.9-179.767.7000113.7V5 I11 R12 I13V5-L9 PolarHBondContact O-N 3.41Å; L9-I11 VanDerWaalsContact C-N 3.27Å; L9-I11 PolarHBondContact O-N 2.76Å; L9-R12 PolarHBondContact O-N 2.9Å; L9-I13 HydrophobicContact CD1-CD1 4.39Å; L9-I13 HydrophobicContact CG-CD1 4.13Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 3.2Å
10P88.2Confident76.8Confident71 Ų7175.3 Ų75.346%0.46139%0.386SS..Hα-helixtrans-57-41174.3-25.433.9000112.6Y6 I13 I14Y6-P10 WeakPolarHBondContact O-CD 3.24Å; P10-I13 PolarHBondContact O-N 3.19Å; P10-I14 WeakPolarHBondContact O-CG1 3.49Å; P10-I14 PolarHBondContact O-N 3.47Å
11I88.4Confident77.8Confident30 Ų3075.1 Ų75.115%0.15439%0.385CS..Hα-helixtrans-63.7-44.4179-58.2175.3000110.2V7 T8 L9 I13 I14 V15 P271 Q274 I278V7-I11 HydrophobicContact CG1-CD1 4.26Å; V7-I11 WeakPolarHBondContact O-CD1 3.37Å; V7-I11 WeakPolarHBondContact O-CG1 3.41Å; T8-I11 PolarHBondContact O-N 3.07Å; L9-I11 VanDerWaalsContact C-N 3.27Å; L9-I11 PolarHBondContact O-N 2.76Å; I11-I13 VanDerWaalsContact C-N 3.34Å; I11-I13 PolarHBondContact O-N 3.36Å; I11-I14 PolarHBondContact O-N 2.97Å; I11-V15 WeakPolarHBondContact O-CG2 3.49Å; I11-V15 PolarHBondContact O-N 2.9Å; I11-P271 HydrophobicContact CD1-CB 3.96Å; I11-P271 HydrophobicContact CD1-CG 4.23Å; I11-Q274 HydrophobicContact CG2-CB 3.51Å; I11-Q274 HydrophobicContact CG2-CG 4.22Å; I11-Q274 VanDerWaalsContact CG2-OE1 3.23Å; I11-I278 HydrophobicContact CG2-CD1 3.69Å
12R88.4Confident80.9Confident50 Ų5064.5 Ų64.519%0.18933%0.333CS..Hα-helixtrans-60.4-42.5174.1-67.8179.7-152.1-173.85.6112T8 L9 I14 V15 I16 Y65T8-R12 VanDerWaalsContact O-CG 3.24Å; T8-R12 WeakPolarHBondContact O-CG 3.21Å; T8-R12 PolarHBondContact O-N 3Å; T8-R12 PolarHBondContact OG1-NH2 2.95Å; L9-R12 PolarHBondContact O-N 2.9Å; R12-I14 VanDerWaalsContact C-N 3.32Å; R12-I14 PolarHBondContact O-N 3.48Å; R12-V15 PolarHBondContact O-N 2.95Å; R12-I16 WeakPolarHBondContact O-CD1 3.2Å; R12-I16 WeakPolarHBondContact O-CG1 3.04Å; R12-I16 PolarHBondContact O-N 2.88Å; R12-Y65 HydrophobicContact CB-CD1 4.11Å; R12-Y65 HydrophobicContact CG-CD1 3.68Å; R12-Y65 HydrophobicContact CG-CE1 3.93Å
13I91.7Very high83.3Confident81 Ų8162.7 Ų62.742%0.41532%0.323SS..Hα-helixtrans-60.2-43.9177.6-68.7167.2000110.5L9 P10 I11 I16 I17L9-I13 HydrophobicContact CD1-CD1 4.39Å; L9-I13 HydrophobicContact CG-CD1 4.13Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 3.2Å; P10-I13 PolarHBondContact O-N 3.19Å; I11-I13 VanDerWaalsContact C-N 3.34Å; I11-I13 PolarHBondContact O-N 3.36Å; I13-I16 PolarHBondContact O-N 2.88Å; I13-I17 HydrophobicContact CG2-CD1 3.74Å; I13-I17 HydrophobicContact CG2-CG1 4.41Å; I13-I17 WeakPolarHBondContact O-CG1 3.12Å; I13-I17 PolarHBondContact O-N 3.2Å
14I93.3Very high85.8Confident89 Ų8959.1 Ų59.146%0.45631%0.309SS..Hα-helixtrans-59-50.9176.3-68.4165.3000110.3P10 I11 R12 I16 I17 E18 I278P10-I14 WeakPolarHBondContact O-CG1 3.49Å; P10-I14 PolarHBondContact O-N 3.47Å; I11-I14 PolarHBondContact O-N 2.97Å; R12-I14 VanDerWaalsContact C-N 3.32Å; R12-I14 PolarHBondContact O-N 3.48Å; I14-I16 VanDerWaalsContact C-N 3.3Å; I14-I16 PolarHBondContact O-N 3.18Å; I14-I17 PolarHBondContact O-N 3.2Å; I14-E18 VanDerWaalsContact O-CB 3.27Å; I14-E18 WeakPolarHBondContact O-CB 3.42Å; I14-E18 PolarHBondContact O-N 3.43Å; I14-I278 HydrophobicContact CG2-CD1 4.21Å
15V93Very high87.9Confident0 Ų058.1 Ų58.10%030%0.295CS..Hα-helixtrans-60-39.4179.3178.20000111.9I11 R12 G19 Y65 T277 I278 L281I11-V15 WeakPolarHBondContact O-CG2 3.49Å; I11-V15 PolarHBondContact O-N 2.9Å; R12-V15 PolarHBondContact O-N 2.95Å; V15-G19 PolarHBondContact O-N 3.01Å; V15-Y65 HydrophobicContact CB-CD2 4.16Å; V15-Y65 HydrophobicContact CB-CE2 4.31Å; V15-Y65 HydrophobicContact CB-CG 4.47Å; V15-Y65 HydrophobicContact CG1-CD2 3.34Å; V15-Y65 HydrophobicContact CG1-CE2 3.48Å; V15-Y65 VanDerWaalsContact CG1-CE2 3.48Å; V15-Y65 HydrophobicContact CG1-CG 4.09Å; V15-T277 HydrophobicContact CG1-CG2 4.46Å; V15-I278 HydrophobicContact CG2-CD1 3.99Å; V15-I278 HydrophobicContact CG2-CG1 3.4Å; V15-L281 HydrophobicContact CG1-CD2 3.83Å; V15-L281 WeakPolarHBondContact O-CD2 3.29Å
16I95.1Very high89.9Confident27 Ų2754.6 Ų54.614%0.13827%0.274CS..Hα-helixtrans-64.1-50.1177.2-69.1164.4000110.6R12 I13 I14 E18 G19 I20 I66R12-I16 WeakPolarHBondContact O-CD1 3.2Å; R12-I16 WeakPolarHBondContact O-CG1 3.04Å; R12-I16 PolarHBondContact O-N 2.88Å; I13-I16 PolarHBondContact O-N 2.88Å; I14-I16 VanDerWaalsContact C-N 3.3Å; I14-I16 PolarHBondContact O-N 3.18Å; I16-E18 VanDerWaalsContact C-N 3.33Å; I16-E18 PolarHBondContact O-N 2.71Å; I16-G19 PolarHBondContact O-N 2.95Å; I16-I20 HydrophobicContact CG2-CD1 3.77Å; I16-I20 HydrophobicContact CG2-CG1 4.49Å; I16-I20 VanDerWaalsContact O-CG1 3.27Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 3.26Å; I16-I66 HydrophobicContact CD1-CG1 4.16Å; I16-I66 HydrophobicContact CG1-CG1 4.15Å; I16-I66 HydrophobicContact CG2-CD1 4.14Å; I16-I66 HydrophobicContact CG2-CG1 3.79Å
17I96.2Very high91.9Very high94 Ų9451.5 Ų51.548%0.48227%0.266SS..Hα-helixtrans-60.2-47.6-179.6-70169.2000110I13 I14 I20 I21I13-I17 HydrophobicContact CG2-CD1 3.74Å; I13-I17 HydrophobicContact CG2-CG1 4.41Å; I13-I17 WeakPolarHBondContact O-CG1 3.12Å; I13-I17 PolarHBondContact O-N 3.2Å; I14-I17 PolarHBondContact O-N 3.2Å; I17-I20 PolarHBondContact O-N 3.26Å; I17-I21 HydrophobicContact CG2-CD1 3.72Å; I17-I21 HydrophobicContact CG2-CG1 4.45Å; I17-I21 VanDerWaalsContact O-CG1 3.28Å; I17-I21 WeakPolarHBondContact O-CG1 3.45Å; I17-I21 PolarHBondContact O-N 3.02Å
18E96.1Very high93.6Very high23 Ų2350.9 Ų50.911%0.10726%0.262CS..Hα-helixtrans-62.3-44.5178.9-173172.8-160.100112I14 I16 I20 I21 G22 L281 F282I14-E18 VanDerWaalsContact O-CB 3.27Å; I14-E18 WeakPolarHBondContact O-CB 3.42Å; I14-E18 PolarHBondContact O-N 3.43Å; I16-E18 VanDerWaalsContact C-N 3.33Å; I16-E18 PolarHBondContact O-N 2.71Å; E18-I20 VanDerWaalsContact C-N 3.34Å; E18-I20 PolarHBondContact O-N 3.07Å; E18-I21 PolarHBondContact O-N 3.1Å; E18-G22 PolarHBondContact O-N 3.32Å; E18-L281 HydrophobicContact CB-CD2 3.95Å; E18-L281 HydrophobicContact CB-CG 4.48Å; E18-L281 HydrophobicContact CG-CB 4.48Å; E18-L281 HydrophobicContact CG-CD2 3.89Å; E18-L281 HydrophobicContact CG-CG 3.9Å; E18-F282 WeakPolarHBondContact OE1-CA 3.47Å; E18-F282 WeakPolarHBondContact OE1-CB 3.49Å; E18-F282 PolarHBondContact OE1-N 3.2Å
19G97Very high94.4Very high0 Ų050.3 Ų50.30%026%0.259CS..Hα-helixtrans-61.8-40.1176.100000112.4V15 I16 T23V15-G19 PolarHBondContact O-N 3.01Å; I16-G19 PolarHBondContact O-N 2.95Å; G19-T23 VanDerWaalsContact O-CB 3.28Å; G19-T23 WeakPolarHBondContact O-CB 3.41Å; G19-T23 PolarHBondContact O-N 3.39Å; G19-T23 PolarHBondContact O-OG1 3.46Å
20I97.9Very high95Very high75 Ų7547.6 Ų47.639%0.38525%0.245SC..Hα-helixtrans-65.1-47174.8-69.4167.5000110.7I16 I17 E18 T23 I24 A62I16-I20 HydrophobicContact CG2-CD1 3.77Å; I16-I20 HydrophobicContact CG2-CG1 4.49Å; I16-I20 VanDerWaalsContact O-CG1 3.27Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 3.26Å; I17-I20 PolarHBondContact O-N 3.26Å; E18-I20 VanDerWaalsContact C-N 3.34Å; E18-I20 PolarHBondContact O-N 3.07Å; I20-T23 WeakPolarHBondContact O-CB 3.31Å; I20-T23 PolarHBondContact O-N 3.33Å; I20-I24 HydrophobicContact CG2-CD1 3.96Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 3.39Å; I20-A62 HydrophobicContact CG1-CB 4.21Å
21I97.5Very high95.3Very high73 Ų7348 Ų4837%0.37425%0.246SC..Hα-helixtrans-60.1-48.8178.1-70169.1000110.4I17 E18 T23 I24 F25I17-I21 HydrophobicContact CG2-CD1 3.72Å; I17-I21 HydrophobicContact CG2-CG1 4.45Å; I17-I21 VanDerWaalsContact O-CG1 3.28Å; I17-I21 WeakPolarHBondContact O-CG1 3.45Å; I17-I21 PolarHBondContact O-N 3.02Å; E18-I21 PolarHBondContact O-N 3.1Å; I21-T23 VanDerWaalsContact C-N 3.31Å; I21-T23 PolarHBondContact O-N 2.88Å; I21-I24 PolarHBondContact O-N 3.42Å; I21-F25 HydrophobicContact CG2-CD2 3.83Å; I21-F25 HydrophobicContact CG2-CE1 4.36Å; I21-F25 HydrophobicContact CG2-CE2 3.43Å; I21-F25 VanDerWaalsContact CG2-CE2 3.43Å; I21-F25 HydrophobicContact CG2-CG 4.46Å; I21-F25 HydrophobicContact CG2-CZ 3.73Å; I21-F25 WeakPolarHBondContact O-CG 3.49Å; I21-F25 PolarHBondContact O-N 3.47Å
22G97.8Very high95.6Very high0 Ų046.6 Ų46.60%024%0.239CC..Hα-helixtrans-60.7-39177.300000112.9E18 F25 N26 S285E18-G22 PolarHBondContact O-N 3.32Å; G22-F25 PolarHBondContact O-N 3.27Å; G22-N26 WeakPolarHBondContact O-CB 3.16Å; G22-N26 PolarHBondContact O-N 3.17Å; G22-N26 PolarHBondContact O-ND2 3.32Å; G22-S285 VanDerWaalsContact CA-OG 3.25Å; G22-S285 WeakPolarHBondContact CA-OG 3.29Å
23T98.1Very high95.9Very high20 Ų2044.4 Ų44.412%0.12323%0.231CC..Hα-helixtrans-60-47.7173.8-61.10000110.7G19 I20 I21 N26 M27 F55 F59G19-T23 VanDerWaalsContact O-CB 3.28Å; G19-T23 WeakPolarHBondContact O-CB 3.41Å; G19-T23 PolarHBondContact O-N 3.39Å; G19-T23 PolarHBondContact O-OG1 3.46Å; I20-T23 WeakPolarHBondContact O-CB 3.31Å; I20-T23 PolarHBondContact O-N 3.33Å; I21-T23 VanDerWaalsContact C-N 3.31Å; I21-T23 PolarHBondContact O-N 2.88Å; T23-N26 PolarHBondContact O-N 3.08Å; T23-M27 WeakPolarHBondContact O-CB 3.38Å; T23-M27 VanDerWaalsContact O-CG 3.24Å; T23-M27 WeakPolarHBondContact O-CG 3.21Å; T23-M27 PolarHBondContact O-N 3.1Å; T23-F55 HydrophobicContact CG2-CD2 3.92Å; T23-F55 HydrophobicContact CG2-CE2 3.44Å; T23-F55 VanDerWaalsContact CG2-CE2 3.44Å; T23-F55 HydrophobicContact CG2-CZ 4.34Å; T23-F59 HydrophobicContact CG2-CB 4.29Å; T23-F59 HydrophobicContact CG2-CD2 4.07Å; T23-F59 WeakPolarHBondContact OG1-CA 3.32Å; T23-F59 PolarHBondContact OG1-N 2.92Å
24I97.5Very high96Very high95 Ų9544.9 Ų44.949%0.48723%0.23SC..Hα-helixtrans-63-47.4179.1-67.1165.7000110.9I20 I21 N26 M27 V28I20-I24 HydrophobicContact CG2-CD1 3.96Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 3.39Å; I21-I24 PolarHBondContact O-N 3.42Å; I24-N26 PolarHBondContact O-N 3.08Å; I24-M27 PolarHBondContact O-N 2.71Å; I24-V28 WeakPolarHBondContact O-CG2 3.3Å; I24-V28 PolarHBondContact O-N 3.03Å
25F97.5Very high95.9Very high89 Ų8947.7 Ų47.739%0.3924%0.239SC..Hα-helixtrans-63.1-42.3-180-69.8-14.1000112.5I21 G22 V28 A29 P288I21-F25 HydrophobicContact CG2-CD2 3.83Å; I21-F25 HydrophobicContact CG2-CE1 4.36Å; I21-F25 HydrophobicContact CG2-CE2 3.43Å; I21-F25 VanDerWaalsContact CG2-CE2 3.43Å; I21-F25 HydrophobicContact CG2-CG 4.46Å; I21-F25 HydrophobicContact CG2-CZ 3.73Å; I21-F25 WeakPolarHBondContact O-CG 3.49Å; I21-F25 PolarHBondContact O-N 3.47Å; G22-F25 PolarHBondContact O-N 3.27Å; F25-V28 PolarHBondContact O-N 3.05Å; F25-A29 PolarHBondContact O-N 3.38Å; F25-P288 HydrophobicContact CB-CB 4.5Å; F25-P288 HydrophobicContact CB-CG 3.78Å
26N97.6Very high95.9Very high0 Ų048.3 Ų48.30%024%0.242CC..Hα-helixtrans-69.1-35.4176.5-78.8-69.8000112.4G22 T23 I24 V28 A29 I30 D54 F55 C284 P288G22-N26 WeakPolarHBondContact O-CB 3.16Å; G22-N26 PolarHBondContact O-N 3.17Å; G22-N26 PolarHBondContact O-ND2 3.32Å; T23-N26 PolarHBondContact O-N 3.08Å; I24-N26 PolarHBondContact O-N 3.08Å; N26-V28 VanDerWaalsContact C-N 3.35Å; N26-V28 PolarHBondContact O-N 3.38Å; N26-A29 PolarHBondContact O-N 3.02Å; N26-I30 WeakPolarHBondContact O-CD1 3.29Å; N26-I30 VanDerWaalsContact O-CG1 3.24Å; N26-I30 WeakPolarHBondContact O-CG1 3.36Å; N26-I30 PolarHBondContact O-N 3.5Å; N26-D54 WeakPolarHBondContact OD1-CB 3.4Å; N26-F55 HydrophobicContact CB-CB 3.71Å; N26-F55 HydrophobicContact CB-CD2 4.46Å; N26-C284 PolarHBondContact ND2-O 3.39Å; N26-P288 WeakPolarHBondContact OD1-CD 3.49Å; N26-P288 WeakPolarHBondContact OD1-CG 3.35Å
27M97.1Very high95.5Very high93 Ų9352.9 Ų52.946%0.45827%0.272SS..Hα-helixtrans-59.7-44.7171.9-77.3-63.6-79.900112.1T23 I24 A29 I30 V31 F55T23-M27 WeakPolarHBondContact O-CB 3.38Å; T23-M27 VanDerWaalsContact O-CG 3.24Å; T23-M27 WeakPolarHBondContact O-CG 3.21Å; T23-M27 PolarHBondContact O-N 3.1Å; I24-M27 PolarHBondContact O-N 2.71Å; M27-A29 VanDerWaalsContact C-N 3.34Å; M27-A29 PolarHBondContact O-N 3.48Å; M27-I30 PolarHBondContact O-N 2.91Å; M27-I30 HydrophobicContact SD-CD1 4.36Å; M27-V31 WeakPolarHBondContact O-CG2 3.38Å; M27-V31 PolarHBondContact O-N 3.22Å; M27-F55 HydrophobicContact CG-CD2 3.62Å; M27-F55 HydrophobicContact CG-CE2 3.33Å; M27-F55 HydrophobicContact CG-CZ 4.38Å; M27-F55 HydrophobicContact SD-CD2 3.69Å; M27-F55 HydrophobicContact SD-CE2 3.26Å; M27-F55 WeakPolarHBondContact SD-CE2 3.42Å; M27-F55 HydrophobicContact SD-CZ 3.81Å
28V95.4Very high94.9Very high64 Ų6448.9 Ų48.939%0.38825%0.251SS..Hα-helixtrans-61.3-44.5175172.70000110.7I24 F25 N26 I30 V31 I32I24-V28 WeakPolarHBondContact O-CG2 3.3Å; I24-V28 PolarHBondContact O-N 3.03Å; F25-V28 PolarHBondContact O-N 3.05Å; N26-V28 VanDerWaalsContact C-N 3.35Å; N26-V28 PolarHBondContact O-N 3.38Å; V28-I30 PolarHBondContact O-N 2.96Å; V28-V31 PolarHBondContact O-N 3.37Å; V28-I32 HydrophobicContact CG1-CD1 3.7Å; V28-I32 WeakPolarHBondContact O-CD1 3.3Å; V28-I32 VanDerWaalsContact O-CG1 3.28Å; V28-I32 WeakPolarHBondContact O-CG1 3.47Å; V28-I32 PolarHBondContact O-N 3.07Å; V28-I32 VanDerWaalsContact O-N 3.07Å
29A95.3Very high94.4Very high0 Ų050.5 Ų50.50%027%0.274CS..Hα-helixtrans-61.9-43177.300000112.8F25 N26 M27 V31 I32 I33 P288 I292F25-A29 PolarHBondContact O-N 3.38Å; N26-A29 PolarHBondContact O-N 3.02Å; M27-A29 VanDerWaalsContact C-N 3.34Å; M27-A29 PolarHBondContact O-N 3.48Å; A29-V31 PolarHBondContact O-N 3Å; A29-I32 PolarHBondContact O-N 3.2Å; A29-I33 HydrophobicContact CB-CD1 4.12Å; A29-I33 WeakPolarHBondContact O-CB 3.4Å; A29-I33 WeakPolarHBondContact O-CD1 3.4Å; A29-I33 WeakPolarHBondContact O-CG1 3.43Å; A29-I33 PolarHBondContact O-N 2.98Å; A29-P288 HydrophobicContact CB-CB 3.48Å; A29-P288 VanDerWaalsContact CB-CB 3.48Å; A29-I292 HydrophobicContact CB-CD1 4.02Å
30I96Very high93.9Very high26 Ų2651.7 Ų51.713%0.13328%0.282CS..Hα-helixtrans-56.2-51.4174.4-71.1161.2000109.7N26 M27 V28 I32 I33 F34 L52 F55N26-I30 WeakPolarHBondContact O-CD1 3.29Å; N26-I30 VanDerWaalsContact O-CG1 3.24Å; N26-I30 WeakPolarHBondContact O-CG1 3.36Å; N26-I30 PolarHBondContact O-N 3.5Å; M27-I30 PolarHBondContact O-N 2.91Å; M27-I30 HydrophobicContact SD-CD1 4.36Å; V28-I30 PolarHBondContact O-N 2.96Å; I30-I32 VanDerWaalsContact C-N 3.28Å; I30-I32 PolarHBondContact O-N 3.45Å; I30-I33 PolarHBondContact O-N 3.43Å; I30-F34 HydrophobicContact CB-CD2 4.49Å; I30-F34 HydrophobicContact CG2-CD2 3.8Å; I30-F34 HydrophobicContact CG2-CE2 3.85Å; I30-F34 VanDerWaalsContact O-CB 3.29Å; I30-F34 WeakPolarHBondContact O-CB 3.45Å; I30-F34 WeakPolarHBondContact O-CD2 3.42Å; I30-F34 PolarHBondContact O-N 3.47Å; I30-L52 HydrophobicContact CD1-CD2 3.81Å; I30-L52 HydrophobicContact CD1-CG 4.5Å; I30-L52 HydrophobicContact CG1-CD2 4.25Å; I30-F55 HydrophobicContact CD1-CB 3.9Å; I30-F55 HydrophobicContact CD1-CD2 4.46Å; I30-F55 HydrophobicContact CD1-CG 4.09Å
31V94.7Very high93.5Very high79 Ų7956.3 Ų56.348%0.47930%0.3SS..Hα-helixtrans-56.5-42.9179171.80000111.6M27 V28 A29 K35M27-V31 WeakPolarHBondContact O-CG2 3.38Å; M27-V31 PolarHBondContact O-N 3.22Å; V28-V31 PolarHBondContact O-N 3.37Å; A29-V31 PolarHBondContact O-N 3Å; V31-K35 WeakPolarHBondContact O-CG 3.23Å
32I94.8Very high93.2Very high1 Ų153.4 Ų53.41%0.00528%0.284CS..Hα-helixtrans-70.9-52.6-178.6-64.5164.6000111.3V28 A29 I30 F34 K35 V36 I292 L298 Y301 L302 L305V28-I32 HydrophobicContact CG1-CD1 3.7Å; V28-I32 WeakPolarHBondContact O-CD1 3.3Å; V28-I32 VanDerWaalsContact O-CG1 3.28Å; V28-I32 WeakPolarHBondContact O-CG1 3.47Å; V28-I32 PolarHBondContact O-N 3.07Å; V28-I32 VanDerWaalsContact O-N 3.07Å; A29-I32 PolarHBondContact O-N 3.2Å; I30-I32 VanDerWaalsContact C-N 3.28Å; I30-I32 PolarHBondContact O-N 3.45Å; I32-F34 VanDerWaalsContact C-N 3.27Å; I32-F34 PolarHBondContact O-N 2.86Å; I32-K35 PolarHBondContact O-N 2.97Å; I32-V36 HydrophobicContact CG2-CG2 4.48Å; I32-V36 WeakPolarHBondContact O-CG2 3.09Å; I32-V36 PolarHBondContact O-N 3.5Å; I32-V36 VanDerWaalsContact O-N 3.14Å; I32-I292 HydrophobicContact CD1-CD1 3.72Å; I32-I292 HydrophobicContact CD1-CG1 4.27Å; I32-L298 HydrophobicContact CG2-CB 4.15Å; I32-L298 HydrophobicContact CG2-CD2 3.64Å; I32-L298 HydrophobicContact CG2-CG 4.47Å; I32-Y301 HydrophobicContact CB-CD1 4.33Å; I32-Y301 HydrophobicContact CG1-CD1 4.23Å; I32-Y301 HydrophobicContact CG2-CD1 3.92Å; I32-L302 HydrophobicContact CD1-CB 4Å; I32-L302 HydrophobicContact CD1-CD1 4.03Å; I32-L302 HydrophobicContact CD1-CG 4.42Å; I32-L305 HydrophobicContact CG1-CD1 4.4Å
33I93.7Very high93Very high4 Ų453.6 Ų53.62%0.02129%0.286CS..Hα-helixtrans-68-29.5-173-62.6162.3000111A29 I30 K35 V36 L44 L47 R48 S51 L291 L298A29-I33 HydrophobicContact CB-CD1 4.12Å; A29-I33 WeakPolarHBondContact O-CB 3.4Å; A29-I33 WeakPolarHBondContact O-CD1 3.4Å; A29-I33 WeakPolarHBondContact O-CG1 3.43Å; A29-I33 PolarHBondContact O-N 2.98Å; I30-I33 PolarHBondContact O-N 3.43Å; I33-K35 VanDerWaalsContact C-N 3.27Å; I33-K35 PolarHBondContact O-N 3.46Å; I33-V36 VanDerWaalsContact O-O 3.08Å; I33-L44 HydrophobicContact CG2-CD1 4.12Å; I33-L47 HydrophobicContact CG2-CB 4.45Å; I33-R48 HydrophobicContact CG2-CG 3.52Å; I33-R48 PolarHBondContact O-NE 3Å; I33-R48 PolarHBondContact O-NH2 3.41Å; I33-S51 VanDerWaalsContact CD1-OG 3.26Å; I33-S51 WeakPolarHBondContact CD1-OG 3.39Å; I33-L291 HydrophobicContact CD1-CD2 3.43Å; I33-L291 VanDerWaalsContact CD1-CD2 3.43Å; I33-L291 HydrophobicContact CD1-CG 4.37Å; I33-L291 HydrophobicContact CG1-CD2 4.4Å; I33-L298 HydrophobicContact CG1-CD1 4.22Å; I33-L298 HydrophobicContact CG1-CD2 4.02Å
34F93.7Very high92.7Very high90 Ų9053.7 Ų53.740%0.39529%0.285SS..Hα-helixtrans-72.8-22174.5-82.1-108.6000113I30 I32 R48 L52I30-F34 HydrophobicContact CB-CD2 4.49Å; I30-F34 HydrophobicContact CG2-CD2 3.8Å; I30-F34 HydrophobicContact CG2-CE2 3.85Å; I30-F34 VanDerWaalsContact O-CB 3.29Å; I30-F34 WeakPolarHBondContact O-CB 3.45Å; I30-F34 WeakPolarHBondContact O-CD2 3.42Å; I30-F34 PolarHBondContact O-N 3.47Å; I32-F34 VanDerWaalsContact C-N 3.27Å; I32-F34 PolarHBondContact O-N 2.86Å; F34-R48 HydrophobicContact CD2-CB 4.44Å; F34-R48 HydrophobicContact CD2-CG 3.86Å; F34-R48 HydrophobicContact CE2-CB 3.71Å; F34-R48 HydrophobicContact CE2-CG 3.62Å; F34-R48 HydrophobicContact CZ-CB 3.93Å; F34-R48 HydrophobicContact CZ-CG 4.04Å; F34-R48 PolarHBondContact O-NH2 3.32Å; F34-L52 HydrophobicContact CZ-CD1 4.14Å
35K93Very high92.6Very high149 Ų14951.8 Ų51.865%0.64827%0.273SS*.Hα-helixtrans-95.6-10.2178.8-64.2-66.4-177.9-177.40114.2V31 I32 I33 Y301V31-K35 WeakPolarHBondContact O-CG 3.23Å; I32-K35 PolarHBondContact O-N 2.97Å; I33-K35 VanDerWaalsContact C-N 3.27Å; I33-K35 PolarHBondContact O-N 3.46Å; K35-Y301 HydrophobicContact CB-CE1 3.85Å; K35-Y301 HydrophobicContact CB-CE2 4.41Å; K35-Y301 WeakPolarHBondContact CB-OH 3.45Å; K35-Y301 HydrophobicContact CG-CE1 4.43Å
36V91.3Very high92.5Very high13 Ų1347.6 Ų47.68%0.07926%0.255CS..  trans-115.1145.5-176.9178.50000110.7I32 I33 I38 T297 L298 Y301I32-V36 HydrophobicContact CG2-CG2 4.48Å; I32-V36 WeakPolarHBondContact O-CG2 3.09Å; I32-V36 PolarHBondContact O-N 3.5Å; I32-V36 VanDerWaalsContact O-N 3.14Å; I33-V36 VanDerWaalsContact O-O 3.08Å; V36-I38 HydrophobicContact CB-CD1 4.44Å; V36-I38 HydrophobicContact CG1-CD1 3.51Å; V36-I38 HydrophobicContact CG1-CG1 3.74Å; V36-T297 HydrophobicContact CG1-CG2 3.43Å; V36-T297 VanDerWaalsContact CG1-CG2 3.43Å; V36-L298 HydrophobicContact CB-CD2 4.1Å; V36-L298 HydrophobicContact CG1-CD2 4.17Å; V36-L298 HydrophobicContact CG2-CD2 4.37Å; V36-Y301 HydrophobicContact CG2-CD1 4.05Å; V36-Y301 HydrophobicContact CG2-CD2 3.98Å; V36-Y301 HydrophobicContact CG2-CG 3.68Å
37T86.8Confident92.4Very high122 Ų12247.8 Ų47.875%0.74826%0.256SS*.  trans-105.3117.1170.554.10000110.1
38I84.9Confident92.4Very high10 Ų1046.4 Ų46.45%0.05125%0.246CC..  trans-133.8132176.4-68.9146000108.9V36 T230 L234 T295 T297 L298V36-I38 HydrophobicContact CB-CD1 4.44Å; V36-I38 HydrophobicContact CG1-CD1 3.51Å; V36-I38 HydrophobicContact CG1-CG1 3.74Å; I38-T230 HydrophobicContact CG2-CG2 4.02Å; I38-L234 HydrophobicContact CG2-CD1 3.86Å; I38-L234 HydrophobicContact CG2-CD2 4.01Å; I38-L234 HydrophobicContact CG2-CG 4.3Å; I38-T295 HydrophobicContact CD1-CG2 3.92Å; I38-T297 HydrophobicContact CD1-CG2 4.34Å; I38-T297 HydrophobicContact CG1-CG2 4.09Å; I38-L298 HydrophobicContact CD1-CD1 4.18Å; I38-L298 HydrophobicContact CD1-CD2 3.37Å; I38-L298 HydrophobicContact CD1-CG 3.47Å; I38-L298 VanDerWaalsContact CD1-CG 3.47Å
39G84.3Confident92.5Very high57 Ų5744.4 Ų44.459%0.58823%0.234SC*.SBendtrans69.8-151.2176.200000113.6
40S86.8Confident92.6Very high25 Ų2544.5 Ų44.518%0.17523%0.234CC..  trans-80.9167.5178.879.50000112.1F42 T43 L44S40-F42 PolarHBondContact O-N 2.99Å; S40-F42 PolarHBondContact OG-N 3.19Å; S40-T43 PolarHBondContact O-N 3.11Å; S40-T43 PolarHBondContact OG-N 3.35Å; S40-T43 PolarHBondContact OG-OG1 2.99Å; S40-L44 WeakPolarHBondContact O-CB 3.47Å; S40-L44 PolarHBondContact O-N 3.09Å
41K90Very high92.6Very high172 Ų17243.3 Ų43.375%0.74823%0.228SC*.Hα-helixtrans-56.6-40.1172.3-68.2-172.8179.3-176.10112F45K41-F45 WeakPolarHBondContact O-CB 3.34Å; K41-F45 PolarHBondContact O-N 3.47Å
42F91.8Very high92.7Very high13 Ų1342.9 Ų42.96%0.05722%0.223CC..Hα-helixtrans-70.3-44.8179.8-175.4-117.2000111.4S40 L44 F45 L46 D113 F131 F132 Y135S40-F42 PolarHBondContact O-N 2.99Å; S40-F42 PolarHBondContact OG-N 3.19Å; F42-L44 VanDerWaalsContact C-N 3.32Å; F42-L44 PolarHBondContact O-N 3.16Å; F42-F45 HydrophobicContact CD2-CD1 4.37Å; F42-F45 HydrophobicContact CE2-CD1 4.41Å; F42-F45 WeakPolarHBondContact O-CB 3.48Å; F42-F45 PolarHBondContact O-N 3.22Å; F42-L46 HydrophobicContact CD1-CD1 3.91Å; F42-L46 HydrophobicContact CD1-CG 4.48Å; F42-L46 HydrophobicContact CE1-CD1 3.52Å; F42-L46 HydrophobicContact CE1-CG 4.19Å; F42-L46 HydrophobicContact CE2-CD1 4.47Å; F42-L46 HydrophobicContact CE2-CD2 4.27Å; F42-L46 HydrophobicContact CE2-CG 4.28Å; F42-L46 HydrophobicContact CZ-CD1 3.82Å; F42-L46 HydrophobicContact CZ-CD2 4.05Å; F42-L46 HydrophobicContact CZ-CG 4.07Å; F42-L46 WeakPolarHBondContact O-CG 3.43Å; F42-L46 PolarHBondContact O-N 2.99Å; F42-D113 HydrophobicContact CD1-CB 4.18Å; F42-D113 WeakPolarHBondContact CD1-OD1 3.26Å; F42-D113 HydrophobicContact CE1-CB 4.04Å; F42-F131 HydrophobicContact CD1-CB 4.14Å; F42-F131 HydrophobicContact CD2-CB 4.26Å; F42-F131 HydrophobicContact CE1-CB 4.1Å; F42-F131 HydrophobicContact CE2-CB 4.25Å; F42-F131 HydrophobicContact CG-CB 4.22Å; F42-F131 HydrophobicContact CZ-CB 4.17Å; F42-F132 HydrophobicContact CB-CE2 4.29Å; F42-F132 HydrophobicContact CB-CZ 4.42Å; F42-F132 HydrophobicContact CD2-CD1 4.09Å; F42-F132 HydrophobicContact CD2-CD2 4.19Å; F42-F132 AromaticContact CD2-CE1 3.98Å; F42-F132 HydrophobicContact CD2-CE1 3.98Å; F42-F132 HydrophobicContact CD2-CE2 4.06Å; F42-F132 HydrophobicContact CD2-CG 4.19Å; F42-F132 AromaticContact CD2-CZ 3.95Å; F42-F132 HydrophobicContact CD2-CZ 3.95Å; F42-F132 HydrophobicContact CE2-CD1 4.36Å; F42-Y135 HydrophobicContact CE2-CD2 4.48Å; F42-Y135 HydrophobicContact CE2-CG 4.22Å; F42-Y135 HydrophobicContact CZ-CD2 4.33Å; F42-Y135 HydrophobicContact CZ-CG 4.4Å
43T91.8Very high92.9Very high4 Ų444 Ų443%0.02523%0.229CC..Hα-helixtrans-55.6-47.7173-53.60000111.7S40 F45 L46 L47 D113 R114 L234S40-T43 PolarHBondContact O-N 3.11Å; S40-T43 PolarHBondContact OG-N 3.35Å; S40-T43 PolarHBondContact OG-OG1 2.99Å; T43-F45 VanDerWaalsContact C-N 3.32Å; T43-F45 PolarHBondContact O-N 2.94Å; T43-L46 PolarHBondContact O-N 3.34Å; T43-L47 HydrophobicContact CG2-CD1 4.06Å; T43-L47 HydrophobicContact CG2-CG 4.39Å; T43-L47 VanDerWaalsContact O-CG 3.32Å; T43-L47 WeakPolarHBondContact O-CG 3.32Å; T43-L47 PolarHBondContact O-N 3.32Å; T43-D113 WeakPolarHBondContact CA-OD2 3.36Å; T43-D113 WeakPolarHBondContact CB-OD2 3.48Å; T43-D113 PolarHBondContact OG1-OD2 3.41Å; T43-R114 PolarHBondContact OG1-NH2 3.45Å; T43-L234 HydrophobicContact CG2-CD1 4.35Å
44L92.8Very high93.1Very high22 Ų2243.8 Ų43.812%0.11523%0.228CC..Hα-helixtrans-64.2-39.4179.9-176.660.5000111.7I33 S40 F42 R48I33-L44 HydrophobicContact CG2-CD1 4.12Å; S40-L44 WeakPolarHBondContact O-CB 3.47Å; S40-L44 PolarHBondContact O-N 3.09Å; F42-L44 VanDerWaalsContact C-N 3.32Å; F42-L44 PolarHBondContact O-N 3.16Å; L44-R48 HydrophobicContact CD1-CG 4.47Å; L44-R48 WeakPolarHBondContact O-CB 3.44Å; L44-R48 WeakPolarHBondContact O-CG 3.48Å; L44-R48 PolarHBondContact O-N 3.21Å
45F95.3Very high93.3Very high55 Ų5541.6 Ų41.624%0.24122%0.218CC..Hα-helixtrans-59-51.6172.5166.9-99.5000111.2K41 F42 T43 L47 R48 T49 F132 Y135 F136K41-F45 WeakPolarHBondContact O-CB 3.34Å; K41-F45 PolarHBondContact O-N 3.47Å; F42-F45 HydrophobicContact CD2-CD1 4.37Å; F42-F45 HydrophobicContact CE2-CD1 4.41Å; F42-F45 WeakPolarHBondContact O-CB 3.48Å; F42-F45 PolarHBondContact O-N 3.22Å; T43-F45 VanDerWaalsContact C-N 3.32Å; T43-F45 PolarHBondContact O-N 2.94Å; F45-L47 PolarHBondContact O-N 3.47Å; F45-R48 PolarHBondContact O-N 3.03Å; F45-T49 WeakPolarHBondContact O-CB 3.28Å; F45-T49 PolarHBondContact O-N 3.43Å; F45-T49 PolarHBondContact O-OG1 2.93Å; F45-F132 HydrophobicContact CB-CE1 3.92Å; F45-F132 HydrophobicContact CB-CZ 4.02Å; F45-F132 HydrophobicContact CD1-CD1 4.24Å; F45-F132 AromaticContact CD1-CE1 3.57Å; F45-F132 HydrophobicContact CD1-CE1 3.57Å; F45-F132 HydrophobicContact CD1-CZ 4.4Å; F45-F132 AromaticContact CD2-CE1 4Å; F45-F132 HydrophobicContact CD2-CE1 4Å; F45-F132 HydrophobicContact CE1-CD1 4.3Å; F45-F132 HydrophobicContact CE1-CE1 4.02Å; F45-F132 HydrophobicContact CE2-CE1 4.41Å; F45-F132 AromaticContact CG-CE1 3.55Å; F45-F132 HydrophobicContact CG-CE1 3.55Å; F45-F132 HydrophobicContact CG-CZ 4.17Å; F45-F132 HydrophobicContact CZ-CE1 4.42Å; F45-Y135 AromaticContact CE1-CD1 3.69Å; F45-Y135 HydrophobicContact CE1-CD1 3.69Å; F45-Y135 AromaticContact CE1-CE1 3.39Å; F45-Y135 HydrophobicContact CE1-CE1 3.39Å; F45-Y135 HydrophobicContact CE1-CE2 4.37Å; F45-Y135 HydrophobicContact CE1-CG 4.31Å; F45-Y135 AromaticContact CE1-CZ 3.74Å; F45-Y135 HydrophobicContact CZ-CD1 4.17Å; F45-Y135 AromaticContact CZ-CE1 3.64Å; F45-Y135 HydrophobicContact CZ-CE1 3.64Å; F45-F136 HydrophobicContact CE2-CZ 4.5Å; F45-F136 HydrophobicContact CZ-CE1 4.37Å; F45-F136 AromaticContact CZ-CZ 3.92Å; F45-F136 HydrophobicContact CZ-CZ 3.92Å
46L96.2Very high93.6Very high0 Ų035.8 Ų35.80%020%0.197CC..Hα-helixtrans-60.2-42.5-179.9-68175.5000113F42 T43 T49 Q50 N106 C109 I110 D113 Y135F42-L46 HydrophobicContact CD1-CD1 3.91Å; F42-L46 HydrophobicContact CD1-CG 4.48Å; F42-L46 HydrophobicContact CE1-CD1 3.52Å; F42-L46 HydrophobicContact CE1-CG 4.19Å; F42-L46 HydrophobicContact CE2-CD1 4.47Å; F42-L46 HydrophobicContact CE2-CD2 4.27Å; F42-L46 HydrophobicContact CE2-CG 4.28Å; F42-L46 HydrophobicContact CZ-CD1 3.82Å; F42-L46 HydrophobicContact CZ-CD2 4.05Å; F42-L46 HydrophobicContact CZ-CG 4.07Å; F42-L46 WeakPolarHBondContact O-CG 3.43Å; F42-L46 PolarHBondContact O-N 2.99Å; T43-L46 PolarHBondContact O-N 3.34Å; L46-T49 PolarHBondContact O-N 2.85Å; L46-Q50 WeakPolarHBondContact O-CB 3.35Å; L46-Q50 PolarHBondContact O-N 3.14Å; L46-N106 PolarHBondContact O-ND2 3.26Å; L46-C109 HydrophobicContact CD1-CB 4.4Å; L46-C109 HydrophobicContact CD2-CB 3.87Å; L46-I110 HydrophobicContact CB-CD1 4.36Å; L46-I110 HydrophobicContact CB-CG1 3.63Å; L46-I110 HydrophobicContact CD1-CG1 4.14Å; L46-I110 HydrophobicContact CG-CG1 4.41Å; L46-D113 HydrophobicContact CD1-CB 3.71Å; L46-Y135 HydrophobicContact CD2-CD2 3.55Å; L46-Y135 HydrophobicContact CD2-CE2 3.28Å; L46-Y135 HydrophobicContact CD2-CG 4.48Å
47L95.2Very high93.9Very high5 Ų535.2 Ų35.23%0.02619%0.193CC..Hα-helixtrans-66-37.7177.8-68.7177.3000112.2I33 T43 F45 S51 I110 L234 L291I33-L47 HydrophobicContact CG2-CB 4.45Å; T43-L47 HydrophobicContact CG2-CD1 4.06Å; T43-L47 HydrophobicContact CG2-CG 4.39Å; T43-L47 VanDerWaalsContact O-CG 3.32Å; T43-L47 WeakPolarHBondContact O-CG 3.32Å; T43-L47 PolarHBondContact O-N 3.32Å; F45-L47 PolarHBondContact O-N 3.47Å; L47-S51 PolarHBondContact O-N 2.85Å; L47-S51 PolarHBondContact O-OG 3.33Å; L47-I110 HydrophobicContact CD2-CD1 4.32Å; L47-L234 HydrophobicContact CD1-CD2 4.13Å; L47-L291 HydrophobicContact CD1-CD1 4.47Å; L47-L291 HydrophobicContact CD2-CD1 3.96Å; L47-L291 HydrophobicContact CD2-CD2 4.27Å
48R96.2Very high94.4Very high63 Ų6329.4 Ų29.424%0.23816%0.157CC..Hα-helixtrans-67.1-44.9174.6-73.9172.7-179.8-175.9-3.5111.2I33 F34 L44 F45 Q50 S51 L52I33-R48 HydrophobicContact CG2-CG 3.52Å; I33-R48 PolarHBondContact O-NE 3Å; I33-R48 PolarHBondContact O-NH2 3.41Å; F34-R48 HydrophobicContact CD2-CB 4.44Å; F34-R48 HydrophobicContact CD2-CG 3.86Å; F34-R48 HydrophobicContact CE2-CB 3.71Å; F34-R48 HydrophobicContact CE2-CG 3.62Å; F34-R48 HydrophobicContact CZ-CB 3.93Å; F34-R48 HydrophobicContact CZ-CG 4.04Å; F34-R48 PolarHBondContact O-NH2 3.32Å; L44-R48 HydrophobicContact CD1-CG 4.47Å; L44-R48 WeakPolarHBondContact O-CB 3.44Å; L44-R48 WeakPolarHBondContact O-CG 3.48Å; L44-R48 PolarHBondContact O-N 3.21Å; F45-R48 PolarHBondContact O-N 3.03Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 2.9Å; R48-S51 PolarHBondContact O-N 3.47Å; R48-L52 WeakPolarHBondContact O-CG 3.36Å; R48-L52 PolarHBondContact O-N 3.15Å
49T97Very high95.1Very high23 Ų2333.7 Ų33.714%0.14118%0.176CC..Hα-helixtrans-61.2-41.4176.7-58.50000110.9F45 L46 S51 L52 L53 Y135F45-T49 WeakPolarHBondContact O-CB 3.28Å; F45-T49 PolarHBondContact O-N 3.43Å; F45-T49 PolarHBondContact O-OG1 2.93Å; L46-T49 PolarHBondContact O-N 2.85Å; T49-S51 PolarHBondContact O-N 3.04Å; T49-L52 PolarHBondContact O-N 2.93Å; T49-L52 VanDerWaalsContact O-N 3.16Å; T49-L53 HydrophobicContact CG2-CD1 3.64Å; T49-L53 HydrophobicContact CG2-CG 4.05Å; T49-L53 WeakPolarHBondContact O-CB 3.26Å; T49-L53 VanDerWaalsContact O-CG 3.24Å; T49-L53 WeakPolarHBondContact O-CG 3.28Å; T49-L53 PolarHBondContact O-N 3.33Å; T49-Y135 WeakPolarHBondContact CG2-OH 3.24Å
50Q97.5Very high95.6Very high1 Ų131.2 Ų31.21%0.00515%0.15CC..Hα-helixtrans-55.1-52.4175.8-172.161.234.800111.8L46 R48 L52 L53 D54 S103 N106 I110 M241L46-Q50 WeakPolarHBondContact O-CB 3.35Å; L46-Q50 PolarHBondContact O-N 3.14Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 2.9Å; Q50-L52 VanDerWaalsContact C-N 3.29Å; Q50-L52 PolarHBondContact O-N 2.82Å; Q50-L53 PolarHBondContact O-N 3Å; Q50-D54 PolarHBondContact NE2-OD1 2.99Å; Q50-D54 PolarHBondContact NE2-OD2 3.34Å; Q50-D54 WeakPolarHBondContact O-CB 3.41Å; Q50-D54 PolarHBondContact O-N 3.46Å; Q50-S103 PolarHBondContact NE2-OG 2.94Å; Q50-S103 PolarHBondContact OE1-O 3.18Å; Q50-N106 WeakPolarHBondContact CA-ND2 3.1Å; Q50-N106 WeakPolarHBondContact CB-ND2 3.43Å; Q50-N106 PolarHBondContact N-ND2 3.4Å; Q50-N106 PolarHBondContact OE1-ND2 3.16Å; Q50-I110 HydrophobicContact CB-CD1 4Å; Q50-I110 HydrophobicContact CG-CD1 4.22Å; Q50-M241 HydrophobicContact CG-CE 3.93Å
51S96.8Very high96.1Very high2 Ų230 Ų301%0.01414%0.141CC..Hα-helixtrans-65.6-31.2179.6-58.20000113.1I33 L47 R48 T49 F55I33-S51 VanDerWaalsContact CD1-OG 3.26Å; I33-S51 WeakPolarHBondContact CD1-OG 3.39Å; L47-S51 PolarHBondContact O-N 2.85Å; L47-S51 PolarHBondContact O-OG 3.33Å; R48-S51 PolarHBondContact O-N 3.47Å; T49-S51 PolarHBondContact O-N 3.04Å; S51-F55 WeakPolarHBondContact O-CB 3.39Å; S51-F55 PolarHBondContact O-N 3.37Å
52L97.8Very high96.3Very high70 Ų7022 Ų2237%0.36611%0.107SC..Hα-helixtrans-70.3-39.8174.2-73.8170.7000112.3I30 F34 R48 T49 Q50 S56I30-L52 HydrophobicContact CD1-CD2 3.81Å; I30-L52 HydrophobicContact CD1-CG 4.5Å; I30-L52 HydrophobicContact CG1-CD2 4.25Å; F34-L52 HydrophobicContact CZ-CD1 4.14Å; R48-L52 WeakPolarHBondContact O-CG 3.36Å; R48-L52 PolarHBondContact O-N 3.15Å; T49-L52 PolarHBondContact O-N 2.93Å; T49-L52 VanDerWaalsContact O-N 3.16Å; Q50-L52 VanDerWaalsContact C-N 3.29Å; Q50-L52 PolarHBondContact O-N 2.82Å; L52-S56 WeakPolarHBondContact O-CB 3.2Å; L52-S56 PolarHBondContact O-N 2.67Å; L52-S56 PolarHBondContact O-OG 2.87Å
53L98.3Very high96.5Very high23 Ų2323.9 Ų23.912%0.1212%0.117CC..Hα-helixtrans-70.1-46.3178.4-68.3171.6000110.9T49 Q50 F55 S56 A57 F99 M102 N106T49-L53 HydrophobicContact CG2-CD1 3.64Å; T49-L53 HydrophobicContact CG2-CG 4.05Å; T49-L53 WeakPolarHBondContact O-CB 3.26Å; T49-L53 VanDerWaalsContact O-CG 3.24Å; T49-L53 WeakPolarHBondContact O-CG 3.28Å; T49-L53 PolarHBondContact O-N 3.33Å; Q50-L53 PolarHBondContact O-N 3Å; L53-F55 PolarHBondContact O-N 3.4Å; L53-S56 PolarHBondContact O-N 2.83Å; L53-S56 VanDerWaalsContact O-N 3.13Å; L53-A57 WeakPolarHBondContact O-CB 3.32Å; L53-A57 PolarHBondContact O-N 3.21Å; L53-F99 HydrophobicContact CD2-CD1 4.12Å; L53-M102 HydrophobicContact CD1-CB 3.91Å; L53-M102 WeakPolarHBondContact CD1-O 3.49Å; L53-M102 HydrophobicContact CD2-CB 3.63Å; L53-M102 HydrophobicContact CD2-CG 4.49Å; L53-M102 HydrophobicContact CG-CB 4.36Å; L53-N106 HydrophobicContact CD1-CB 3.83Å
54D98Very high96.5Very high1 Ų123.8 Ų23.81%0.00512%0.116CC..Hα-helixtrans-62.7-41.6175.2-72.1-25.9000111.4N26 Q50 S56 A57 C58 S103 C284 N287N26-D54 WeakPolarHBondContact OD1-CB 3.4Å; Q50-D54 PolarHBondContact NE2-OD1 2.99Å; Q50-D54 PolarHBondContact NE2-OD2 3.34Å; Q50-D54 WeakPolarHBondContact O-CB 3.41Å; Q50-D54 PolarHBondContact O-N 3.46Å; D54-S56 VanDerWaalsContact C-N 3.35Å; D54-S56 PolarHBondContact O-N 3.38Å; D54-A57 PolarHBondContact O-N 3.36Å; D54-C58 WeakPolarHBondContact O-CB 3.28Å; D54-C58 PolarHBondContact O-N 3.49Å; D54-C58 PolarHBondContact O-SG 2.92Å; D54-S103 PolarHBondContact OD1-OG 3.34Å; D54-C284 HydrophobicContact CB-CB 4.14Å; D54-C284 PolarHBondContact OD1-SG 2.89Å; D54-C284 VanDerWaalsContact OD1-SG 3.33Å; D54-N287 WeakPolarHBondContact OD2-CB 3.33Å; D54-N287 PolarHBondContact OD2-ND2 2.79Å
55F98.3Very high96.5Very high43 Ų4322.8 Ų22.819%0.18911%0.111CC..Hα-helixtrans-54.8-50.4169.9169.2-98.8000111.6T23 N26 M27 I30 S51 L53 A57 C58 F59T23-F55 HydrophobicContact CG2-CD2 3.92Å; T23-F55 HydrophobicContact CG2-CE2 3.44Å; T23-F55 VanDerWaalsContact CG2-CE2 3.44Å; T23-F55 HydrophobicContact CG2-CZ 4.34Å; N26-F55 HydrophobicContact CB-CB 3.71Å; N26-F55 HydrophobicContact CB-CD2 4.46Å; M27-F55 HydrophobicContact CG-CD2 3.62Å; M27-F55 HydrophobicContact CG-CE2 3.33Å; M27-F55 HydrophobicContact CG-CZ 4.38Å; M27-F55 HydrophobicContact SD-CD2 3.69Å; M27-F55 HydrophobicContact SD-CE2 3.26Å; M27-F55 WeakPolarHBondContact SD-CE2 3.42Å; M27-F55 HydrophobicContact SD-CZ 3.81Å; I30-F55 HydrophobicContact CD1-CB 3.9Å; I30-F55 HydrophobicContact CD1-CD2 4.46Å; I30-F55 HydrophobicContact CD1-CG 4.09Å; S51-F55 WeakPolarHBondContact O-CB 3.39Å; S51-F55 PolarHBondContact O-N 3.37Å; L53-F55 PolarHBondContact O-N 3.4Å; F55-A57 PolarHBondContact O-N 3Å; F55-C58 PolarHBondContact O-N 3.41Å; F55-F59 HydrophobicContact CE1-CB 4.45Å; F55-F59 HydrophobicContact CZ-CB 4.34Å; F55-F59 HydrophobicContact CZ-CG 4.38Å; F55-F59 WeakPolarHBondContact O-CB 3.45Å; F55-F59 PolarHBondContact O-N 2.87Å
56S98.1Very high96.4Very high28 Ų2823.4 Ų23.420%0.19612%0.116CC..Hα-helixtrans-68.5-36-174.7-56.90000111.6L52 L53 D54 S60 F99L52-S56 WeakPolarHBondContact O-CB 3.2Å; L52-S56 PolarHBondContact O-N 2.67Å; L52-S56 PolarHBondContact O-OG 2.87Å; L53-S56 PolarHBondContact O-N 2.83Å; L53-S56 VanDerWaalsContact O-N 3.13Å; D54-S56 VanDerWaalsContact C-N 3.35Å; D54-S56 PolarHBondContact O-N 3.38Å; S56-S60 WeakPolarHBondContact O-CB 3.32Å; S56-S60 PolarHBondContact O-N 2.93Å; S56-S60 PolarHBondContact O-OG 3.13Å; S56-F99 VanDerWaalsContact CB-CD1 3.41Å; S56-F99 VanDerWaalsContact CB-CG 3.4Å
57A98Very high96.1Very high0 Ų026.2 Ų26.20%013%0.13CC..Hα-helixtrans-62.5-52.1171.900000110.9L53 D54 F55 F59 S60 A61 F96 F99L53-A57 WeakPolarHBondContact O-CB 3.32Å; L53-A57 PolarHBondContact O-N 3.21Å; D54-A57 PolarHBondContact O-N 3.36Å; F55-A57 PolarHBondContact O-N 3Å; A57-F59 PolarHBondContact O-N 3.49Å; A57-S60 PolarHBondContact O-N 3.26Å; A57-S60 PolarHBondContact O-OG 3.29Å; A57-A61 WeakPolarHBondContact O-CB 3.49Å; A57-A61 PolarHBondContact O-N 3.03Å; A57-F96 HydrophobicContact CB-CD2 4.18Å; A57-F96 HydrophobicContact CB-CE2 4.34Å; A57-F99 HydrophobicContact CB-CB 3.81Å
58C98.2Very high95.7Very high0 Ų027.2 Ų27.20%014%0.135CC..Hα-helixtrans-61.7-43.8179.4-67.30000112.8D54 F55 A62 L281D54-C58 WeakPolarHBondContact O-CB 3.28Å; D54-C58 PolarHBondContact O-N 3.49Å; D54-C58 PolarHBondContact O-SG 2.92Å; F55-C58 PolarHBondContact O-N 3.41Å; C58-A62 WeakPolarHBondContact O-CB 3.43Å; C58-A62 PolarHBondContact O-N 3.25Å; C58-L281 HydrophobicContact CB-CD1 4.12Å
59F97.9Very high95.2Very high100 Ų10027 Ų2744%0.43914%0.144SC..Hα-helixtrans-66-48.1179.7-179.5-105.3000111.4T23 F55 A57 A61 A62 I63T23-F59 HydrophobicContact CG2-CB 4.29Å; T23-F59 HydrophobicContact CG2-CD2 4.07Å; T23-F59 WeakPolarHBondContact OG1-CA 3.32Å; T23-F59 PolarHBondContact OG1-N 2.92Å; F55-F59 HydrophobicContact CE1-CB 4.45Å; F55-F59 HydrophobicContact CZ-CB 4.34Å; F55-F59 HydrophobicContact CZ-CG 4.38Å; F55-F59 WeakPolarHBondContact O-CB 3.45Å; F55-F59 PolarHBondContact O-N 2.87Å; A57-F59 PolarHBondContact O-N 3.49Å; F59-A61 VanDerWaalsContact C-N 3.35Å; F59-A61 PolarHBondContact O-N 2.93Å; F59-A62 PolarHBondContact O-N 3Å; F59-I63 HydrophobicContact CD1-CG1 4.34Å; F59-I63 HydrophobicContact CD2-CG1 4.14Å; F59-I63 HydrophobicContact CE1-CG1 3.97Å; F59-I63 HydrophobicContact CE2-CD1 3.95Å; F59-I63 HydrophobicContact CE2-CG1 3.75Å; F59-I63 HydrophobicContact CG-CG1 4.42Å; F59-I63 HydrophobicContact CZ-CD1 4.09Å; F59-I63 HydrophobicContact CZ-CG1 3.66Å; F59-I63 WeakPolarHBondContact O-CG1 3.46Å; F59-I63 PolarHBondContact O-N 3.07Å
60S96.3Very high94.7Very high6 Ų628.7 Ų28.74%0.04215%0.154CC..Hα-helixtrans-62.2-41.5178.958.70000112S56 A57 Y64 F96S56-S60 WeakPolarHBondContact O-CB 3.32Å; S56-S60 PolarHBondContact O-N 2.93Å; S56-S60 PolarHBondContact O-OG 3.13Å; A57-S60 PolarHBondContact O-N 3.26Å; A57-S60 PolarHBondContact O-OG 3.29Å; S60-Y64 WeakPolarHBondContact O-CB 3.41Å; S60-Y64 PolarHBondContact O-N 2.93Å; S60-F96 VanDerWaalsContact OG-CA 3.3Å; S60-F96 WeakPolarHBondContact OG-CA 3.48Å; S60-F96 PolarHBondContact OG-N 3.46Å
61A95.6Very high93.6Very high0 Ų036.1 Ų36.10%019%0.193CC..Hα-helixtrans-60.9-49.4174.100000111.8A57 F59 I63 Y64 Y65 F96 L281A57-A61 WeakPolarHBondContact O-CB 3.49Å; A57-A61 PolarHBondContact O-N 3.03Å; F59-A61 VanDerWaalsContact C-N 3.35Å; F59-A61 PolarHBondContact O-N 2.93Å; A61-I63 PolarHBondContact O-N 3.3Å; A61-Y64 PolarHBondContact O-N 3.41Å; A61-Y65 VanDerWaalsContact O-CD2 3.31Å; A61-Y65 WeakPolarHBondContact O-CD2 3.48Å; A61-Y65 PolarHBondContact O-N 3.16Å; A61-F96 HydrophobicContact CB-CD2 3.81Å; A61-F96 HydrophobicContact CB-CE2 4.36Å; A61-F96 HydrophobicContact CB-CG 4.38Å; A61-L281 HydrophobicContact CB-CD1 4.13Å; A61-L281 HydrophobicContact CB-CD2 4.4Å
62A96Very high92.7Very high3 Ų341.1 Ų41.13%0.02522%0.219CC..Hα-helixtrans-58.6-50.5179.600000111.7I20 C58 F59 Y64 Y65 I66I20-A62 HydrophobicContact CG1-CB 4.21Å; C58-A62 WeakPolarHBondContact O-CB 3.43Å; C58-A62 PolarHBondContact O-N 3.25Å; F59-A62 PolarHBondContact O-N 3Å; A62-Y64 PolarHBondContact O-N 3.01Å; A62-Y65 PolarHBondContact O-N 3.47Å; A62-I66 WeakPolarHBondContact O-CB 3.26Å; A62-I66 WeakPolarHBondContact O-CD1 3.47Å; A62-I66 WeakPolarHBondContact O-CG1 3.29Å; A62-I66 PolarHBondContact O-N 3.42Å
63I94.9Very high91.4Very high53 Ų5340.3 Ų40.327%0.27221%0.211SC..Hα-helixtrans-65.6-40.8-179.8-60.4-58.9000111.1F59 A61 Y65 I66 I67 W90F59-I63 HydrophobicContact CD1-CG1 4.34Å; F59-I63 HydrophobicContact CD2-CG1 4.14Å; F59-I63 HydrophobicContact CE1-CG1 3.97Å; F59-I63 HydrophobicContact CE2-CD1 3.95Å; F59-I63 HydrophobicContact CE2-CG1 3.75Å; F59-I63 HydrophobicContact CG-CG1 4.42Å; F59-I63 HydrophobicContact CZ-CD1 4.09Å; F59-I63 HydrophobicContact CZ-CG1 3.66Å; F59-I63 WeakPolarHBondContact O-CG1 3.46Å; F59-I63 PolarHBondContact O-N 3.07Å; A61-I63 PolarHBondContact O-N 3.3Å; I63-Y65 PolarHBondContact O-N 3.5Å; I63-I66 PolarHBondContact O-N 3.06Å; I63-I67 HydrophobicContact CG2-CD1 3.75Å; I63-I67 HydrophobicContact CG2-CG1 4.25Å; I63-I67 WeakPolarHBondContact O-CB 3.49Å; I63-I67 VanDerWaalsContact O-CG1 3.32Å; I63-I67 WeakPolarHBondContact O-CG1 3.48Å; I63-I67 PolarHBondContact O-N 2.82Å; I63-W90 HydrophobicContact CB-CH2 3.96Å; I63-W90 HydrophobicContact CB-CZ2 4.47Å; I63-W90 HydrophobicContact CG2-CH2 3.57Å; I63-W90 HydrophobicContact CG2-CZ2 3.88Å
64Y92.9Very high90.1Very high1 Ų144.4 Ų44.40%0.00423%0.233CC..Hα-helixtrans-55.6-52.5176178.5-95.1000111.7S60 A61 A62 I67 Q68 Y73 W90 R92 N93 Y268S60-Y64 WeakPolarHBondContact O-CB 3.41Å; S60-Y64 PolarHBondContact O-N 2.93Å; A61-Y64 PolarHBondContact O-N 3.41Å; A62-Y64 PolarHBondContact O-N 3.01Å; Y64-I67 PolarHBondContact O-N 3.26Å; Y64-Q68 VanDerWaalsContact O-CB 3.31Å; Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 3.21Å; Y64-Y73 AromaticContact CE2-CE2 3.97Å; Y64-Y73 HydrophobicContact CE2-CE2 3.97Å; Y64-Y73 PolarHBondContact OH-OH 3Å; Y64-W90 VanDerWaalsContact CA-CZ2 3.48Å; Y64-W90 HydrophobicContact CD2-CD2 4.43Å; Y64-W90 AromaticContact CD2-CE2 3.87Å; Y64-W90 HydrophobicContact CD2-CZ2 4.29Å; Y64-W90 AromaticContact CD2-NE1 3.61Å; Y64-W90 WeakPolarHBondContact CE2-O 3.11Å; Y64-R92 WeakPolarHBondContact OH-CA 3.43Å; Y64-N93 WeakPolarHBondContact CB-OD1 3.41Å; Y64-N93 HydrophobicContact CD1-CB 3.76Å; Y64-N93 HydrophobicContact CD2-CB 4.29Å; Y64-N93 HydrophobicContact CE1-CB 3.74Å; Y64-N93 HydrophobicContact CE2-CB 4.28Å; Y64-N93 HydrophobicContact CG-CB 4.04Å; Y64-N93 VanDerWaalsContact CZ-N 3.31Å; Y64-Y268 PolarHBondContact OH-OH 3.4Å
65Y91.9Very high89Confident1 Ų151.1 Ų51.10%0.00426%0.263CS..Hα-helixtrans-73.8-29.2-177.5-80-75.6000113.7R12 V15 A61 A62 I63 Q68 S69 T277R12-Y65 HydrophobicContact CB-CD1 4.11Å; R12-Y65 HydrophobicContact CG-CD1 3.68Å; R12-Y65 HydrophobicContact CG-CE1 3.93Å; V15-Y65 HydrophobicContact CB-CD2 4.16Å; V15-Y65 HydrophobicContact CB-CE2 4.31Å; V15-Y65 HydrophobicContact CB-CG 4.47Å; V15-Y65 HydrophobicContact CG1-CD2 3.34Å; V15-Y65 HydrophobicContact CG1-CE2 3.48Å; V15-Y65 VanDerWaalsContact CG1-CE2 3.48Å; V15-Y65 HydrophobicContact CG1-CG 4.09Å; A61-Y65 VanDerWaalsContact O-CD2 3.31Å; A61-Y65 WeakPolarHBondContact O-CD2 3.48Å; A61-Y65 PolarHBondContact O-N 3.16Å; A62-Y65 PolarHBondContact O-N 3.47Å; I63-Y65 PolarHBondContact O-N 3.5Å; Y65-Q68 VanDerWaalsContact CD1-OE1 3.28Å; Y65-S69 WeakPolarHBondContact O-CB 3.35Å; Y65-S69 PolarHBondContact O-N 2.84Å; Y65-S69 VanDerWaalsContact O-N 3.08Å; Y65-S69 PolarHBondContact O-OG 3.49Å; Y65-T277 HydrophobicContact CE2-CG2 4.39Å
66I92.4Very high87.9Confident68 Ų6853.7 Ų53.735%0.34927%0.271SS..Hα-helixtrans-61.8-52.4169.2-72.2165000109.3I16 A62 I63 Q68 S69 T70I16-I66 HydrophobicContact CD1-CG1 4.16Å; I16-I66 HydrophobicContact CG1-CG1 4.15Å; I16-I66 HydrophobicContact CG2-CD1 4.14Å; I16-I66 HydrophobicContact CG2-CG1 3.79Å; A62-I66 WeakPolarHBondContact O-CB 3.26Å; A62-I66 WeakPolarHBondContact O-CD1 3.47Å; A62-I66 WeakPolarHBondContact O-CG1 3.29Å; A62-I66 PolarHBondContact O-N 3.42Å; I63-I66 PolarHBondContact O-N 3.06Å; I66-Q68 VanDerWaalsContact C-N 3.34Å; I66-Q68 PolarHBondContact O-N 3.37Å; I66-S69 WeakPolarHBondContact O-CB 3.37Å; I66-S69 PolarHBondContact O-N 3.43Å; I66-S69 VanDerWaalsContact O-N 3.1Å; I66-T70 WeakPolarHBondContact O-CG2 3.35Å
67I89.9Confident87.2Confident59 Ų5955.9 Ų55.930%0.30328%0.284SS..Hα-helixtrans-63.1-41.8-179.9-67.7178.4000110.8I63 Y64 S69 T70 Y73 W90I63-I67 HydrophobicContact CG2-CD1 3.75Å; I63-I67 HydrophobicContact CG2-CG1 4.25Å; I63-I67 WeakPolarHBondContact O-CB 3.49Å; I63-I67 VanDerWaalsContact O-CG1 3.32Å; I63-I67 WeakPolarHBondContact O-CG1 3.48Å; I63-I67 PolarHBondContact O-N 2.82Å; Y64-I67 PolarHBondContact O-N 3.26Å; I67-S69 PolarHBondContact O-N 3.47Å; I67-T70 WeakPolarHBondContact O-CB 3.44Å; I67-T70 PolarHBondContact O-N 2.83Å; I67-T70 PolarHBondContact O-OG1 3.23Å; I67-Y73 HydrophobicContact CG2-CD2 4.4Å; I67-W90 HydrophobicContact CD1-CZ2 3.85Å
68Q87Confident86.5Confident26 Ų2659 Ų5912%0.12132%0.316CS..Hα-helixtrans-61.4-25.8176.7-164.2-178.233.500113.1Y64 Y65 I66 T70 Y73Y64-Q68 VanDerWaalsContact O-CB 3.31Å; Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 3.21Å; Y65-Q68 VanDerWaalsContact CD1-OE1 3.28Å; I66-Q68 VanDerWaalsContact C-N 3.34Å; I66-Q68 PolarHBondContact O-N 3.37Å; Q68-T70 VanDerWaalsContact C-N 3.26Å; Q68-Y73 HydrophobicContact CB-CD2 3.86Å; Q68-Y73 HydrophobicContact CB-CE2 4.15Å; Q68-Y73 HydrophobicContact CB-CG 4.41Å; Q68-Y73 HydrophobicContact CG-CD1 4.48Å; Q68-Y73 HydrophobicContact CG-CD2 3.93Å; Q68-Y73 HydrophobicContact CG-CE2 3.97Å; Q68-Y73 HydrophobicContact CG-CG 4.21Å
69S86.4Confident86Confident60 Ų6064.1 Ų64.142%0.4234%0.343SS..THydrogen-bonded Turntrans-80.3-4.5174-57.70000113.3Y65 I66 I67Y65-S69 WeakPolarHBondContact O-CB 3.35Å; Y65-S69 PolarHBondContact O-N 2.84Å; Y65-S69 VanDerWaalsContact O-N 3.08Å; Y65-S69 PolarHBondContact O-OG 3.49Å; I66-S69 WeakPolarHBondContact O-CB 3.37Å; I66-S69 PolarHBondContact O-N 3.43Å; I66-S69 VanDerWaalsContact O-N 3.1Å; I67-S69 PolarHBondContact O-N 3.47Å
70T85.7Confident85.6Confident58 Ų5866.7 Ų66.736%0.35635%0.351SS..SBendtrans-102.8158177.773.30000112.4I66 I67 Q68 I72 Y73I66-T70 WeakPolarHBondContact O-CG2 3.35Å; I67-T70 WeakPolarHBondContact O-CB 3.44Å; I67-T70 PolarHBondContact O-N 2.83Å; I67-T70 PolarHBondContact O-OG1 3.23Å; Q68-T70 VanDerWaalsContact C-N 3.26Å; T70-I72 PolarHBondContact O-N 3.05Å; T70-I72 PolarHBondContact OG1-N 3.35Å; T70-Y73 PolarHBondContact O-N 2.93Å
71N76.1Confident85.4Confident157 Ų15772.4 Ų72.484%0.8438%0.38SS*.THydrogen-bonded Turntrans-67.91171.4-64.8-30.4000113.9
72I76.4Confident85.1Confident107 Ų10775.9 Ų75.955%0.54940%0.397SS..THydrogen-bonded Turntrans-96-12.9-177.8-52.7174000111T70 N74 K75T70-I72 PolarHBondContact O-N 3.05Å; T70-I72 PolarHBondContact OG1-N 3.35Å; I72-N74 VanDerWaalsContact C-N 3.26Å; I72-N74 PolarHBondContact O-N 3.47Å; I72-K75 HydrophobicContact CG1-CD 4.47Å; I72-K75 HydrophobicContact CG2-CB 4.1Å; I72-K75 HydrophobicContact CG2-CD 4.39Å; I72-K75 WeakPolarHBondContact O-CB 3.2Å; I72-K75 PolarHBondContact O-N 3.42Å
73Y72Confident84.9Confident53 Ų5376.1 Ų76.121%0.20840%0.398CS..THydrogen-bonded Turntrans-49.3-41.1-174.5174.8-106.5000115Y64 I67 Q68 T70Y64-Y73 AromaticContact CE2-CE2 3.97Å; Y64-Y73 HydrophobicContact CE2-CE2 3.97Å; Y64-Y73 PolarHBondContact OH-OH 3Å; I67-Y73 HydrophobicContact CG2-CD2 4.4Å; Q68-Y73 HydrophobicContact CB-CD2 3.86Å; Q68-Y73 HydrophobicContact CB-CE2 4.15Å; Q68-Y73 HydrophobicContact CB-CG 4.41Å; Q68-Y73 HydrophobicContact CG-CD1 4.48Å; Q68-Y73 HydrophobicContact CG-CD2 3.93Å; Q68-Y73 HydrophobicContact CG-CE2 3.97Å; Q68-Y73 HydrophobicContact CG-CG 4.21Å; T70-Y73 PolarHBondContact O-N 2.93Å
74N70.4Confident84.7Confident108 Ų10875.8 Ų75.858%0.57840%0.397SS*.THydrogen-bonded Turntrans-102.513.2178.3-72-24.8000113.3I72 Y76I72-N74 VanDerWaalsContact C-N 3.26Å; I72-N74 PolarHBondContact O-N 3.47Å; N74-Y76 WeakPolarHBondContact O-CE2 3.43Å
75K74.6Confident84.7Confident143 Ų14380.3 Ų80.362%0.62242%0.42SS*.  trans-85.7126.1177.6-71.6-170179.6-174.70109.9I72I72-K75 HydrophobicContact CG1-CD 4.47Å; I72-K75 HydrophobicContact CG2-CB 4.1Å; I72-K75 HydrophobicContact CG2-CD 4.39Å; I72-K75 WeakPolarHBondContact O-CB 3.2Å; I72-K75 PolarHBondContact O-N 3.42Å
76Y75.4Confident84.6Confident96 Ų9683.7 Ų83.738%0.37644%0.438SS..  trans-75149175.7-52.4-69.4000111N74 Y156 S159 Q160N74-Y76 WeakPolarHBondContact O-CE2 3.43Å; Y76-Y156 HydrophobicContact CD1-CE2 4.14Å; Y76-Y156 HydrophobicContact CE1-CE2 4.1Å; Y76-S159 WeakPolarHBondContact CE1-O 3.26Å; Y76-S159 WeakPolarHBondContact CE2-O 3.46Å; Y76-S159 PolarHBondContact OH-O 3.4Å; Y76-Q160 WeakPolarHBondContact OH-CA 3.3Å; Y76-Q160 WeakPolarHBondContact OH-CG 3.27Å
77T84.4Confident84.6Confident75 Ų7580.6 Ų80.646%0.4642%0.422SS..  trans-74.2-20.5174.763.30000111.6L79 I82 D83 I86T77-L79 PolarHBondContact OG1-N 2.98Å; T77-I82 HydrophobicContact CG2-CG2 3.95Å; T77-D83 WeakPolarHBondContact CB-OD1 3.43Å; T77-D83 PolarHBondContact N-OD1 3.28Å; T77-D83 PolarHBondContact OG1-OD1 3.46Å; T77-I86 HydrophobicContact CG2-CD1 3.98Å
78G82.5Confident84.7Confident66 Ų6680.3 Ų80.368%0.6842%0.419SS*.SBendtrans84.8-3.6-174.100000112.9D83G78-D83 PolarHBondContact N-OD2 3.24Å
79L87.9Confident85Confident106 Ų10682.7 Ų82.756%0.55543%0.433SS*.  trans-104.3105.4175.6-68.5174.2000109.1T77 I81 I82 D83T77-L79 PolarHBondContact OG1-N 2.98Å; L79-I81 VanDerWaalsContact C-N 3.27Å; L79-I81 PolarHBondContact O-N 3.38Å; L79-I81 VanDerWaalsContact O-N 3.09Å; L79-I82 HydrophobicContact CB-CB 4.16Å; L79-I82 HydrophobicContact CB-CD1 4.02Å; L79-I82 HydrophobicContact CB-CG1 4.04Å; L79-I82 HydrophobicContact CD1-CD1 3.55Å; L79-I82 HydrophobicContact CD1-CG1 4.42Å; L79-I82 HydrophobicContact CG-CD1 4.43Å; L79-I82 PolarHBondContact O-N 2.9Å; L79-D83 PolarHBondContact O-N 3.43Å
80Y88.9Confident85.2Confident155 Ų15582.8 Ų82.861%0.60842%0.424SS*.Hα-helixtrans-47-44.4-174.9-179-106.9000114.3D83 I84 Y156Y80-D83 PolarHBondContact O-N 3.39Å; Y80-I84 HydrophobicContact CD1-CD1 3.68Å; Y80-I84 HydrophobicContact CD2-CD1 4.31Å; Y80-I84 HydrophobicContact CE1-CD1 3.18Å; Y80-I84 HydrophobicContact CE1-CG1 4.4Å; Y80-I84 HydrophobicContact CE2-CD1 3.88Å; Y80-I84 HydrophobicContact CE2-CG1 4.4Å; Y80-I84 HydrophobicContact CG-CD1 4.23Å; Y80-I84 WeakPolarHBondContact O-CG1 3.24Å; Y80-I84 PolarHBondContact O-N 3.38Å; Y80-Y156 HydrophobicContact CD2-CD1 4.14Å; Y80-Y156 AromaticContact CD2-CE1 3.79Å; Y80-Y156 HydrophobicContact CD2-CE1 3.79Å; Y80-Y156 AromaticContact CE2-CD1 3.78Å; Y80-Y156 HydrophobicContact CE2-CD1 3.78Å; Y80-Y156 AromaticContact CE2-CE1 3.88Å; Y80-Y156 HydrophobicContact CE2-CE1 3.88Å
81I91.7Very high85.4Confident126 Ų12681.8 Ų81.865%0.64642%0.415SS*.Hα-helixtrans-64.3-43.1179.7-63.2170.7000111.3L79 I84 L85L79-I81 VanDerWaalsContact C-N 3.27Å; L79-I81 PolarHBondContact O-N 3.38Å; L79-I81 VanDerWaalsContact O-N 3.09Å; I81-I84 PolarHBondContact O-N 2.94Å; I81-L85 HydrophobicContact CG2-CD1 4.32Å; I81-L85 WeakPolarHBondContact O-CG 3.1Å; I81-L85 PolarHBondContact O-N 3.41Å; I81-L85 VanDerWaalsContact O-N 3.08Å
82I90.8Very high86Confident72 Ų7276 Ų7637%0.36938%0.381SS..Hα-helixtrans-68.9-43.1180-59.9-176000109.7T77 L79 I84 L85 I86T77-I82 HydrophobicContact CG2-CG2 3.95Å; L79-I82 HydrophobicContact CB-CB 4.16Å; L79-I82 HydrophobicContact CB-CD1 4.02Å; L79-I82 HydrophobicContact CB-CG1 4.04Å; L79-I82 HydrophobicContact CD1-CD1 3.55Å; L79-I82 HydrophobicContact CD1-CG1 4.42Å; L79-I82 HydrophobicContact CG-CD1 4.43Å; L79-I82 PolarHBondContact O-N 2.9Å; I82-I84 VanDerWaalsContact C-N 3.3Å; I82-I84 PolarHBondContact O-N 2.95Å; I82-L85 PolarHBondContact O-N 3.01Å; I82-L85 VanDerWaalsContact O-N 3.13Å; I82-I86 HydrophobicContact CG2-CD1 3.73Å; I82-I86 HydrophobicContact CG2-CG1 4.22Å; I82-I86 WeakPolarHBondContact O-CG1 3.43Å; I82-I86 PolarHBondContact O-N 2.87Å
83D90.7Very high86.6Confident9 Ų971 Ų715%0.04836%0.355CS..Hα-helixtrans-62.6-36.9178.9-64.3-30000111.6T77 G78 L79 Y80 C87 Y156T77-D83 WeakPolarHBondContact CB-OD1 3.43Å; T77-D83 PolarHBondContact N-OD1 3.28Å; T77-D83 PolarHBondContact OG1-OD1 3.46Å; G78-D83 PolarHBondContact N-OD2 3.24Å; L79-D83 PolarHBondContact O-N 3.43Å; Y80-D83 PolarHBondContact O-N 3.39Å; D83-C87 VanDerWaalsContact O-CB 3.29Å; D83-C87 WeakPolarHBondContact O-CB 3.26Å; D83-C87 PolarHBondContact O-N 3.2Å; D83-Y156 HydrophobicContact CB-CE1 4.15Å; D83-Y156 HydrophobicContact CB-CE2 3.94Å; D83-Y156 WeakPolarHBondContact CB-OH 3.39Å
84I91.4Very high87.6Confident46 Ų4668.4 Ų68.424%0.23635%0.345CS..Hα-helixtrans-63.4-47.2171.1-74.6167.5000111.7Y80 I81 I82 I86 C87 H88 Y156Y80-I84 HydrophobicContact CD1-CD1 3.68Å; Y80-I84 HydrophobicContact CD2-CD1 4.31Å; Y80-I84 HydrophobicContact CE1-CD1 3.18Å; Y80-I84 HydrophobicContact CE1-CG1 4.4Å; Y80-I84 HydrophobicContact CE2-CD1 3.88Å; Y80-I84 HydrophobicContact CE2-CG1 4.4Å; Y80-I84 HydrophobicContact CG-CD1 4.23Å; Y80-I84 WeakPolarHBondContact O-CG1 3.24Å; Y80-I84 PolarHBondContact O-N 3.38Å; I81-I84 PolarHBondContact O-N 2.94Å; I82-I84 VanDerWaalsContact C-N 3.3Å; I82-I84 PolarHBondContact O-N 2.95Å; I84-I86 VanDerWaalsContact C-N 3.34Å; I84-I86 PolarHBondContact O-N 2.86Å; I84-C87 WeakPolarHBondContact O-CB 3.49Å; I84-C87 PolarHBondContact O-N 3.18Å; I84-H88 PolarHBondContact O-N 3.34Å; I84-H88 PolarHBondContact O-ND1 2.89Å; I84-Y156 HydrophobicContact CG1-CD1 3.8Å; I84-Y156 HydrophobicContact CG1-CG 4.11Å
85L91.9Very high88.8Confident95 Ų9564.3 Ų64.350%0.49733%0.325SS..Hα-helixtrans-63.1-43.1-179-72.4173.6000111.1I81 I82 C87 H88 L89I81-L85 HydrophobicContact CG2-CD1 4.32Å; I81-L85 WeakPolarHBondContact O-CG 3.1Å; I81-L85 PolarHBondContact O-N 3.41Å; I81-L85 VanDerWaalsContact O-N 3.08Å; I82-L85 PolarHBondContact O-N 3.01Å; I82-L85 VanDerWaalsContact O-N 3.13Å; L85-C87 VanDerWaalsContact C-N 3.33Å; L85-H88 PolarHBondContact O-N 3.36Å; L85-L89 VanDerWaalsContact O-CB 3.31Å; L85-L89 WeakPolarHBondContact O-CB 3.24Å; L85-L89 PolarHBondContact O-N 3.01Å
86I90.8Very high89.7Confident73 Ų7357.5 Ų57.537%0.37430%0.295SS..Hα-helixtrans-60.5-45.1173.1-67.8172.5000109.8T77 I82 I84 H88 W90 F91T77-I86 HydrophobicContact CG2-CD1 3.98Å; I82-I86 HydrophobicContact CG2-CD1 3.73Å; I82-I86 HydrophobicContact CG2-CG1 4.22Å; I82-I86 WeakPolarHBondContact O-CG1 3.43Å; I82-I86 PolarHBondContact O-N 2.87Å; I84-I86 VanDerWaalsContact C-N 3.34Å; I84-I86 PolarHBondContact O-N 2.86Å; I86-H88 VanDerWaalsContact C-N 3.32Å; I86-H88 PolarHBondContact O-N 3.38Å; I86-W90 HydrophobicContact CB-CB 4.48Å; I86-W90 HydrophobicContact CG2-CB 3.84Å; I86-W90 HydrophobicContact CG2-CG 4.3Å; I86-W90 VanDerWaalsContact O-CA 3.32Å; I86-W90 WeakPolarHBondContact O-CA 3.06Å; I86-W90 WeakPolarHBondContact O-CB 3.04Å; I86-W90 PolarHBondContact O-N 3.28Å; I86-F91 PolarHBondContact O-N 2.9Å
87C91.8Very high90.7Very high2 Ų254.5 Ų54.51%0.01428%0.283CS..Hα-helixtrans-56.9-45.2177.9178.50000112.1D83 I84 L85 F91 R154 Y156 C161D83-C87 VanDerWaalsContact O-CB 3.29Å; D83-C87 WeakPolarHBondContact O-CB 3.26Å; D83-C87 PolarHBondContact O-N 3.2Å; I84-C87 WeakPolarHBondContact O-CB 3.49Å; I84-C87 PolarHBondContact O-N 3.18Å; L85-C87 VanDerWaalsContact C-N 3.33Å; C87-F91 WeakPolarHBondContact O-CB 3.34Å; C87-R154 WeakPolarHBondContact O-CD 3.38Å; C87-Y156 HydrophobicContact CB-CD2 4.22Å; C87-C161 WeakPolarHBondContact CA-SG 3.16Å; C87-C161 HydrophobicContact CB-CB 3.63Å; C87-C161 WeakPolarHBondContact CB-SG 3.39Å; C87-C161 PolarHBondContact O-SG 3.44Å; C87-C161 VanDerWaalsContact O-SG 3.4Å; C87-C161 VanDerWaalsContact SG-CA 3.56Å; C87-C161 WeakPolarHBondContact SG-CB 3.28Å; C87-C161 CovalentContact SG-SG 2.04Å; C87-C161 PolarHBondContact SG-SG 3.27Å
88H92.5Very high91.3Very high53 Ų5352.6 Ų52.625%0.24527%0.27CS..Hα-helixtrans-81.7-36.1-175.8-68.579.9000113.7I84 L85 I86 P151 R154I84-H88 PolarHBondContact O-N 3.34Å; I84-H88 PolarHBondContact O-ND1 2.89Å; L85-H88 PolarHBondContact O-N 3.36Å; I86-H88 VanDerWaalsContact C-N 3.32Å; I86-H88 PolarHBondContact O-N 3.38Å; H88-P151 HydrophobicContact CB-CB 4.25Å; H88-P151 PolarHBondContact CD2-O 3.4Å; H88-R154 PolarHBondContact NE2-O 3.3Å; H88-R154 PolarHBondContact O-NH1 3.42Å
89L92.4Very high92Very high77 Ų7752.1 Ų52.140%0.40325%0.249SC..Hα-helixtrans-100.8-18.4-172.5-61176.4000113.8L85 A94 S95L85-L89 VanDerWaalsContact O-CB 3.31Å; L85-L89 WeakPolarHBondContact O-CB 3.24Å; L85-L89 PolarHBondContact O-N 3.01Å; L89-A94 WeakPolarHBondContact O-CB 3.37Å; L89-S95 WeakPolarHBondContact O-CB 3.44Å; L89-S95 PolarHBondContact O-N 2.86Å; L89-S95 PolarHBondContact O-OG 3.27Å
90W91.1Very high92.4Very high61 Ų6147.1 Ų47.123%0.23122%0.223CC..THydrogen-bonded Turntrans-113.5-39.6-174.2-164-101.6000113.5I63 Y64 I67 I86 R92 N93I63-W90 HydrophobicContact CB-CH2 3.96Å; I63-W90 HydrophobicContact CB-CZ2 4.47Å; I63-W90 HydrophobicContact CG2-CH2 3.57Å; I63-W90 HydrophobicContact CG2-CZ2 3.88Å; Y64-W90 VanDerWaalsContact CA-CZ2 3.48Å; Y64-W90 HydrophobicContact CD2-CD2 4.43Å; Y64-W90 AromaticContact CD2-CE2 3.87Å; Y64-W90 HydrophobicContact CD2-CZ2 4.29Å; Y64-W90 AromaticContact CD2-NE1 3.61Å; Y64-W90 WeakPolarHBondContact CE2-O 3.11Å; I67-W90 HydrophobicContact CD1-CZ2 3.85Å; I86-W90 HydrophobicContact CB-CB 4.48Å; I86-W90 HydrophobicContact CG2-CB 3.84Å; I86-W90 HydrophobicContact CG2-CG 4.3Å; I86-W90 VanDerWaalsContact O-CA 3.32Å; I86-W90 WeakPolarHBondContact O-CA 3.06Å; I86-W90 WeakPolarHBondContact O-CB 3.04Å; I86-W90 PolarHBondContact O-N 3.28Å; W90-R92 PolarHBondContact O-N 3.34Å; W90-N93 PolarHBondContact O-N 3.27Å; W90-N93 VanDerWaalsContact O-N 3.16Å
91F90Very high92.8Very high38 Ų3839.9 Ų39.917%0.16720%0.195CC..G310 helixtrans-54.4131.2-172.8-174.9-115.2000112.7I86 C87 N93 A94 R154 C161 M163I86-F91 PolarHBondContact O-N 2.9Å; C87-F91 WeakPolarHBondContact O-CB 3.34Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.45Å; F91-A94 PolarHBondContact O-N 3.19Å; F91-R154 HydrophobicContact CD1-CG 4.31Å; F91-R154 PolarHBondContact O-NE 3.43Å; F91-R154 PolarHBondContact O-NH2 3.08Å; F91-C161 HydrophobicContact CD2-CB 4.04Å; F91-C161 HydrophobicContact CE2-CB 4.35Å; F91-C161 HydrophobicContact CG-CB 4.21Å; F91-C161 VanDerWaalsContact CG-SG 3.5Å; F91-C161 WeakPolarHBondContact CZ-O 3.41Å; F91-M163 HydrophobicContact CD1-SD 4.27Å; F91-M163 HydrophobicContact CE1-CG 4.11Å; F91-M163 HydrophobicContact CE1-SD 3.77Å
92R88.4Confident93.1Very high34 Ų3434.8 Ų34.813%0.12817%0.169CC..G310 helixtrans54.245.1-177.8-60.6178.765.3178.10.4113.2Y64 W90 A94 Y266 Y268Y64-R92 WeakPolarHBondContact OH-CA 3.43Å; W90-R92 PolarHBondContact O-N 3.34Å; R92-A94 VanDerWaalsContact C-N 3.29Å; R92-A94 PolarHBondContact O-N 2.92Å; R92-Y266 VanDerWaalsContact NH2-CZ 3.28Å; R92-Y266 PolarHBondContact NH2-OH 2.04Å; R92-Y268 HydrophobicContact CB-CD2 4.42Å; R92-Y268 HydrophobicContact CB-CE2 3.79Å; R92-Y268 HydrophobicContact CG-CD1 4.23Å; R92-Y268 HydrophobicContact CG-CD2 4.25Å; R92-Y268 HydrophobicContact CG-CE1 3.93Å; R92-Y268 HydrophobicContact CG-CE2 3.93Å; R92-Y268 HydrophobicContact CG-CG 4.4Å; R92-Y268 VanDerWaalsContact NE-CG 3.29Å; R92-Y268 VanDerWaalsContact NH2-CB 3.25Å
93N90Very high93.4Very high2 Ų231.6 Ų31.61%0.01115%0.152CC..G310 helixtrans59.934174.7-157.425.4000114.1Y64 W90 F91 S95 F96 W97Y64-N93 WeakPolarHBondContact CB-OD1 3.41Å; Y64-N93 HydrophobicContact CD1-CB 3.76Å; Y64-N93 HydrophobicContact CD2-CB 4.29Å; Y64-N93 HydrophobicContact CE1-CB 3.74Å; Y64-N93 HydrophobicContact CE2-CB 4.28Å; Y64-N93 HydrophobicContact CG-CB 4.04Å; Y64-N93 VanDerWaalsContact CZ-N 3.31Å; W90-N93 PolarHBondContact O-N 3.27Å; W90-N93 VanDerWaalsContact O-N 3.16Å; F91-N93 VanDerWaalsContact C-N 3.32Å; F91-N93 PolarHBondContact O-N 3.45Å; N93-S95 VanDerWaalsContact C-N 3.32Å; N93-S95 PolarHBondContact O-N 2.95Å; N93-F96 VanDerWaalsContact CG-CB 3.41Å; N93-F96 VanDerWaalsContact ND2-CB 3.33Å; N93-F96 WeakPolarHBondContact ND2-CB 3.35Å; N93-F96 VanDerWaalsContact ND2-CD1 3.34Å; N93-F96 WeakPolarHBondContact ND2-CD1 3.37Å; N93-F96 WeakPolarHBondContact ND2-CG 3.24Å; N93-F96 WeakPolarHBondContact O-CB 3.25Å; N93-F96 PolarHBondContact O-N 3.42Å; N93-F96 WeakPolarHBondContact OD1-CB 3.41Å; N93-W97 VanDerWaalsContact O-CD1 3.29Å; N93-W97 PolarHBondContact O-N 2.93Å
94A92.5Very high93.7Very high0 Ų031.2 Ų31.20%015%0.151CC..Hα-helixtrans-62.6-36.3-174.700000114L89 F91 R92 F96 W97 L98 Y147 R154L89-A94 WeakPolarHBondContact O-CB 3.37Å; F91-A94 PolarHBondContact O-N 3.19Å; R92-A94 VanDerWaalsContact C-N 3.29Å; R92-A94 PolarHBondContact O-N 2.92Å; A94-F96 VanDerWaalsContact C-N 3.32Å; A94-F96 PolarHBondContact O-N 2.97Å; A94-W97 PolarHBondContact O-N 2.93Å; A94-L98 PolarHBondContact O-N 3.21Å; A94-L98 VanDerWaalsContact O-N 3.07Å; A94-Y147 WeakPolarHBondContact O-CE2 3.2Å; A94-R154 VanDerWaalsContact CB-CZ 3.42Å; A94-R154 VanDerWaalsContact CB-NH2 3.26Å
95S94.3Very high94.1Very high21 Ų2129 Ų2915%0.14714%0.14CC..Hα-helixtrans-62.9-38.7178.1-75.40000111.9L89 N93 W97 L98 F99L89-S95 WeakPolarHBondContact O-CB 3.44Å; L89-S95 PolarHBondContact O-N 2.86Å; L89-S95 PolarHBondContact O-OG 3.27Å; N93-S95 VanDerWaalsContact C-N 3.32Å; N93-S95 PolarHBondContact O-N 2.95Å; S95-W97 PolarHBondContact O-N 2.99Å; S95-L98 WeakPolarHBondContact O-CB 3.35Å; S95-L98 PolarHBondContact O-N 3.29Å; S95-F99 WeakPolarHBondContact O-CD2 3.45Å; S95-F99 PolarHBondContact O-N 2.87Å
96F95.4Very high94.4Very high0 Ų024.5 Ų24.50%012%0.116CC..Hα-helixtrans-59.5-48.7174.4164.6-102.6000111.3A57 S60 A61 N93 A94 L98 F99 C100 T277 I280 L281A57-F96 HydrophobicContact CB-CD2 4.18Å; A57-F96 HydrophobicContact CB-CE2 4.34Å; S60-F96 VanDerWaalsContact OG-CA 3.3Å; S60-F96 WeakPolarHBondContact OG-CA 3.48Å; S60-F96 PolarHBondContact OG-N 3.46Å; A61-F96 HydrophobicContact CB-CD2 3.81Å; A61-F96 HydrophobicContact CB-CE2 4.36Å; A61-F96 HydrophobicContact CB-CG 4.38Å; N93-F96 VanDerWaalsContact CG-CB 3.41Å; N93-F96 VanDerWaalsContact ND2-CB 3.33Å; N93-F96 WeakPolarHBondContact ND2-CB 3.35Å; N93-F96 VanDerWaalsContact ND2-CD1 3.34Å; N93-F96 WeakPolarHBondContact ND2-CD1 3.37Å; N93-F96 WeakPolarHBondContact ND2-CG 3.24Å; N93-F96 WeakPolarHBondContact O-CB 3.25Å; N93-F96 PolarHBondContact O-N 3.42Å; N93-F96 WeakPolarHBondContact OD1-CB 3.41Å; A94-F96 VanDerWaalsContact C-N 3.32Å; A94-F96 PolarHBondContact O-N 2.97Å; F96-L98 VanDerWaalsContact C-N 3.29Å; F96-L98 PolarHBondContact O-N 2.94Å; F96-F99 PolarHBondContact O-N 2.99Å; F96-C100 HydrophobicContact CZ-CB 4.5Å; F96-C100 VanDerWaalsContact O-CB 3.27Å; F96-C100 WeakPolarHBondContact O-CB 3.28Å; F96-C100 PolarHBondContact O-N 3.36Å; F96-T277 HydrophobicContact CD1-CG2 4.47Å; F96-T277 HydrophobicContact CE1-CG2 3.92Å; F96-T277 HydrophobicContact CZ-CG2 4Å; F96-I280 HydrophobicContact CE2-CG2 4.49Å; F96-I280 HydrophobicContact CZ-CB 4.3Å; F96-I280 HydrophobicContact CZ-CG2 3.76Å; F96-L281 HydrophobicContact CE2-CD1 4.29Å
97W94.8Very high94.7Very high34 Ų3421 Ų2113%0.12910%0.098CC..Hα-helixtrans-62.9-34.6-179.9-72.1111.9000112.9N93 A94 S95 C100 I101 W183 E252 I280N93-W97 VanDerWaalsContact O-CD1 3.29Å; N93-W97 PolarHBondContact O-N 2.93Å; A94-W97 PolarHBondContact O-N 2.93Å; S95-W97 PolarHBondContact O-N 2.99Å; W97-C100 HydrophobicContact CE3-CB 4.44Å; W97-I101 WeakPolarHBondContact O-CB 3.46Å; W97-I101 WeakPolarHBondContact O-CD1 3.36Å; W97-I101 WeakPolarHBondContact O-CG1 3.45Å; W97-I101 PolarHBondContact O-N 3.29Å; W97-W183 HydrophobicContact CZ3-CZ2 4.07Å; W97-E252 HydrophobicContact CH2-CG 4.08Å; W97-I280 HydrophobicContact CH2-CD1 3.88Å; W97-I280 HydrophobicContact CZ3-CD1 3.84Å
98L96.9Very high94.9Very high34 Ų3421 Ų2118%0.17810%0.098CC..Hα-helixtrans-55.2-55.9171.4174.456.9000111.3A94 S95 F96 C100 I101 M102 L143 Y147A94-L98 PolarHBondContact O-N 3.21Å; A94-L98 VanDerWaalsContact O-N 3.07Å; S95-L98 WeakPolarHBondContact O-CB 3.35Å; S95-L98 PolarHBondContact O-N 3.29Å; F96-L98 VanDerWaalsContact C-N 3.29Å; F96-L98 PolarHBondContact O-N 2.94Å; L98-C100 VanDerWaalsContact C-N 3.34Å; L98-I101 PolarHBondContact O-N 3.48Å; L98-M102 HydrophobicContact CD1-CG 4.16Å; L98-M102 VanDerWaalsContact O-CG 3.27Å; L98-M102 WeakPolarHBondContact O-CG 3.2Å; L98-M102 PolarHBondContact O-N 3.03Å; L98-L143 HydrophobicContact CD1-CD1 3.32Å; L98-Y147 HydrophobicContact CB-CD2 3.86Å; L98-Y147 HydrophobicContact CB-CE1 4.27Å; L98-Y147 HydrophobicContact CB-CE2 3.45Å; L98-Y147 VanDerWaalsContact CB-CE2 3.45Å; L98-Y147 HydrophobicContact CB-CG 4.43Å; L98-Y147 HydrophobicContact CD1-CD1 3.7Å; L98-Y147 HydrophobicContact CD1-CD2 4.07Å; L98-Y147 HydrophobicContact CD1-CE1 3.89Å; L98-Y147 HydrophobicContact CD1-CE2 4.27Å; L98-Y147 HydrophobicContact CD1-CG 3.78Å; L98-Y147 HydrophobicContact CD2-CE1 4.28Å; L98-Y147 HydrophobicContact CG-CE1 4.37Å; L98-Y147 HydrophobicContact CG-CE2 4.35Å
99F97.9Very high95.2Very high56 Ų5619 Ų1925%0.2469%0.09CC..Hα-helixtrans-71-33-175.3-64.4-59.3000112.4L53 S56 A57 S95 F96 S103L53-F99 HydrophobicContact CD2-CD1 4.12Å; S56-F99 VanDerWaalsContact CB-CD1 3.41Å; S56-F99 VanDerWaalsContact CB-CG 3.4Å; A57-F99 HydrophobicContact CB-CB 3.81Å; S95-F99 WeakPolarHBondContact O-CD2 3.45Å; S95-F99 PolarHBondContact O-N 2.87Å; F96-F99 PolarHBondContact O-N 2.99Å; F99-S103 WeakPolarHBondContact O-CB 3.46Å; F99-S103 PolarHBondContact O-N 3.46Å
100C96.4Very high95.3Very high1 Ų115.6 Ų15.61%0.0077%0.072CC..Hα-helixtrans-58.9-54.4172178.40000111.2F96 W97 L98 M102 S103 V104 I280F96-C100 HydrophobicContact CZ-CB 4.5Å; F96-C100 VanDerWaalsContact O-CB 3.27Å; F96-C100 WeakPolarHBondContact O-CB 3.28Å; F96-C100 PolarHBondContact O-N 3.36Å; W97-C100 HydrophobicContact CE3-CB 4.44Å; L98-C100 VanDerWaalsContact C-N 3.34Å; C100-M102 PolarHBondContact O-N 2.86Å; C100-S103 WeakPolarHBondContact O-CB 3.39Å; C100-S103 PolarHBondContact O-N 2.92Å; C100-V104 PolarHBondContact O-N 3.44Å; C100-I280 WeakPolarHBondContact SG-CG2 3.41Å
101I96.8Very high95.5Very high3 Ų312.7 Ų12.72%0.0156%0.061CC..Hα-helixtrans-56.7-52.6177.4-66.4163.9000109.7W97 L98 S103 V104 Q105 L146 Y147 E187W97-I101 WeakPolarHBondContact O-CB 3.46Å; W97-I101 WeakPolarHBondContact O-CD1 3.36Å; W97-I101 WeakPolarHBondContact O-CG1 3.45Å; W97-I101 PolarHBondContact O-N 3.29Å; L98-I101 PolarHBondContact O-N 3.48Å; I101-S103 PolarHBondContact O-N 3.49Å; I101-V104 PolarHBondContact O-N 3.01Å; I101-Q105 HydrophobicContact CG2-CG 4.24Å; I101-Q105 WeakPolarHBondContact O-CG 3.41Å; I101-Q105 PolarHBondContact O-N 2.92Å; I101-L146 HydrophobicContact CD1-CB 4.15Å; I101-L146 HydrophobicContact CG2-CB 3.89Å; I101-L146 HydrophobicContact CG2-CD1 3.84Å; I101-Y147 HydrophobicContact CD1-CD2 4.33Å; I101-E187 WeakPolarHBondContact CA-OE1 3.39Å
102M97.9Very high95.7Very high20 Ų2014.7 Ų14.710%0.0997%0.073CC..Hα-helixtrans-58.8-36.6179.8-66.3-60103.700112.1L53 L98 C100 N106 M139 L143L53-M102 HydrophobicContact CD1-CB 3.91Å; L53-M102 WeakPolarHBondContact CD1-O 3.49Å; L53-M102 HydrophobicContact CD2-CB 3.63Å; L53-M102 HydrophobicContact CD2-CG 4.49Å; L53-M102 HydrophobicContact CG-CB 4.36Å; L98-M102 HydrophobicContact CD1-CG 4.16Å; L98-M102 VanDerWaalsContact O-CG 3.27Å; L98-M102 WeakPolarHBondContact O-CG 3.2Å; L98-M102 PolarHBondContact O-N 3.03Å; C100-M102 PolarHBondContact O-N 2.86Å; M102-N106 WeakPolarHBondContact O-CB 3.38Å; M102-N106 PolarHBondContact O-N 2.96Å; M102-M139 HydrophobicContact CB-CE 4.07Å; M102-M139 HydrophobicContact CG-CE 4.43Å; M102-M139 WeakPolarHBondContact O-CE 3.03Å; M102-M139 HydrophobicContact SD-CE 3.62Å; M102-L143 HydrophobicContact CE-CB 3.71Å; M102-L143 HydrophobicContact CE-CD1 3.75Å; M102-L143 HydrophobicContact CE-CG 4.36Å; M102-L143 HydrophobicContact SD-CB 4.29Å; M102-L143 HydrophobicContact SD-CD1 4.21Å
103S97.7Very high95.9Very high4 Ų413.3 Ų13.33%0.0287%0.068CC..Hα-helixtrans-63.9-49.8178.6179.20000111.6Q50 D54 F99 C100 I101 Q105 N106 L107Q50-S103 PolarHBondContact NE2-OG 2.94Å; Q50-S103 PolarHBondContact OE1-O 3.18Å; D54-S103 PolarHBondContact OD1-OG 3.34Å; F99-S103 WeakPolarHBondContact O-CB 3.46Å; F99-S103 PolarHBondContact O-N 3.46Å; C100-S103 WeakPolarHBondContact O-CB 3.39Å; C100-S103 PolarHBondContact O-N 2.92Å; I101-S103 PolarHBondContact O-N 3.49Å; S103-Q105 VanDerWaalsContact C-N 3.34Å; S103-Q105 PolarHBondContact O-N 3.21Å; S103-N106 PolarHBondContact O-N 2.98Å; S103-L107 PolarHBondContact O-N 2.93Å
104V97.7Very high95.9Very high2 Ų213.4 Ų13.41%0.0127%0.068CC..Hα-helixtrans-57.6-47.8176.4163.60000111.2C100 I101 N106 L107 V108 E187 P191 Q245 H249C100-V104 PolarHBondContact O-N 3.44Å; I101-V104 PolarHBondContact O-N 3.01Å; V104-N106 VanDerWaalsContact C-N 3.32Å; V104-N106 PolarHBondContact O-N 2.69Å; V104-L107 WeakPolarHBondContact O-CB 3.21Å; V104-L107 PolarHBondContact O-N 2.95Å; V104-L107 VanDerWaalsContact O-N 3.11Å; V104-V108 PolarHBondContact O-N 3.24Å; V104-V108 VanDerWaalsContact O-N 3.1Å; V104-E187 WeakPolarHBondContact CB-OE1 3.42Å; V104-E187 WeakPolarHBondContact CG1-O 3.46Å; V104-E187 WeakPolarHBondContact CG1-OE1 3.29Å; V104-E187 WeakPolarHBondContact CG2-OE1 3.43Å; V104-P191 HydrophobicContact CG1-CB 4.06Å; V104-P191 HydrophobicContact CG1-CG 4.03Å; V104-Q245 HydrophobicContact CG2-CG 4.24Å; V104-H249 VanDerWaalsContact CG2-CE1 3.4Å; V104-H249 WeakPolarHBondContact CG2-CE1 3.41Å
105Q98.1Very high95.9Very high0 Ų014.3 Ų14.30%07%0.074CC..Hα-helixtrans-66.9-35.4-179.1-59.8-53-3100111.9I101 S103 L107 V108 C109 Y138 M139 M142 L186 E187I101-Q105 HydrophobicContact CG2-CG 4.24Å; I101-Q105 WeakPolarHBondContact O-CG 3.41Å; I101-Q105 PolarHBondContact O-N 2.92Å; S103-Q105 VanDerWaalsContact C-N 3.34Å; S103-Q105 PolarHBondContact O-N 3.21Å; Q105-L107 VanDerWaalsContact C-N 3.33Å; Q105-L107 PolarHBondContact O-N 3.43Å; Q105-V108 WeakPolarHBondContact O-CB 3.49Å; Q105-V108 PolarHBondContact O-N 3.37Å; Q105-C109 PolarHBondContact O-N 2.88Å; Q105-C109 VanDerWaalsContact O-N 3.15Å; Q105-C109 PolarHBondContact O-SG 3.35Å; Q105-C109 VanDerWaalsContact O-SG 3.41Å; Q105-Y138 HydrophobicContact CB-CE1 4Å; Q105-Y138 PolarHBondContact OE1-OH 3.41Å; Q105-M139 HydrophobicContact CB-CE 4.22Å; Q105-M139 HydrophobicContact CB-SD 3.86Å; Q105-M142 HydrophobicContact CG-CB 3.89Å; Q105-M142 HydrophobicContact CG-CG 4.01Å; Q105-L186 PolarHBondContact NE2-O 2.92Å; Q105-E187 PolarHBondContact NE2-OE2 2.74Å
106N98.1Very high95.5Very high0 Ų014.3 Ų14.30%07%0.073CC..Hα-helixtrans-66.1-34.6172.6-172.274.2000112L46 Q50 L53 M102 S103 V104 V108 C109 I110 Y135 M139L46-N106 PolarHBondContact O-ND2 3.26Å; Q50-N106 WeakPolarHBondContact CA-ND2 3.1Å; Q50-N106 WeakPolarHBondContact CB-ND2 3.43Å; Q50-N106 PolarHBondContact N-ND2 3.4Å; Q50-N106 PolarHBondContact OE1-ND2 3.16Å; L53-N106 HydrophobicContact CD1-CB 3.83Å; M102-N106 WeakPolarHBondContact O-CB 3.38Å; M102-N106 PolarHBondContact O-N 2.96Å; S103-N106 PolarHBondContact O-N 2.98Å; V104-N106 VanDerWaalsContact C-N 3.32Å; V104-N106 PolarHBondContact O-N 2.69Å; N106-V108 VanDerWaalsContact C-N 3.35Å; N106-C109 WeakPolarHBondContact O-CB 3.41Å; N106-C109 PolarHBondContact O-N 3.44Å; N106-I110 WeakPolarHBondContact O-CG1 3.41Å; N106-I110 PolarHBondContact O-N 3.37Å; N106-Y135 WeakPolarHBondContact OD1-CE2 3.21Å; N106-Y135 PolarHBondContact OD1-OH 3.41Å; N106-M139 HydrophobicContact CB-CE 4.43Å
107L97.1Very high95Very high0 Ų015.2 Ų15.20%08%0.08CC..Hα-helixtrans-67.1-34.2174.4-167.163.5000112.9S103 V104 Q105 I110 S111 M195 M241 Q245S103-L107 PolarHBondContact O-N 2.93Å; V104-L107 WeakPolarHBondContact O-CB 3.21Å; V104-L107 PolarHBondContact O-N 2.95Å; V104-L107 VanDerWaalsContact O-N 3.11Å; Q105-L107 VanDerWaalsContact C-N 3.33Å; Q105-L107 PolarHBondContact O-N 3.43Å; L107-I110 HydrophobicContact CD1-CB 4.37Å; L107-I110 HydrophobicContact CD1-CD1 4.16Å; L107-I110 HydrophobicContact CD1-CG2 4.48Å; L107-I110 PolarHBondContact O-N 3.36Å; L107-S111 PolarHBondContact O-N 3.29Å; L107-S111 PolarHBondContact O-OG 2.89Å; L107-M195 HydrophobicContact CB-SD 4.42Å; L107-M195 HydrophobicContact CD2-SD 3.75Å; L107-M195 HydrophobicContact CG-SD 3.85Å; L107-M241 HydrophobicContact CD1-CB 4.08Å; L107-M241 HydrophobicContact CD1-CE 4.04Å; L107-M241 HydrophobicContact CD2-CB 4.16Å; L107-Q245 HydrophobicContact CD2-CB 4.2Å
108V97.8Very high94.4Very high2 Ų214.7 Ų14.71%0.0128%0.08CC..Hα-helixtrans-59.3-48.3169.2177.80000110.2V104 Q105 N106 I110 S111 L112 P191 V194V104-V108 PolarHBondContact O-N 3.24Å; V104-V108 VanDerWaalsContact O-N 3.1Å; Q105-V108 WeakPolarHBondContact O-CB 3.49Å; Q105-V108 PolarHBondContact O-N 3.37Å; N106-V108 VanDerWaalsContact C-N 3.35Å; V108-I110 VanDerWaalsContact C-N 3.33Å; V108-I110 PolarHBondContact O-N 2.65Å; V108-S111 PolarHBondContact O-N 2.91Å; V108-S111 VanDerWaalsContact O-N 3.13Å; V108-L112 HydrophobicContact CG1-CD1 4.27Å; V108-L112 PolarHBondContact O-N 3.49Å; V108-P191 HydrophobicContact CG2-CB 3.54Å; V108-P191 HydrophobicContact CG2-CG 3.97Å; V108-V194 HydrophobicContact CG1-CB 4.21Å; V108-V194 HydrophobicContact CG1-CG1 3.71Å
109C97.4Very high93.7Very high11 Ų1116.9 Ų16.97%0.0749%0.092CC..Hα-helixtrans-60.4-40.6176.5-62.90000112.6L46 Q105 N106 S111 L112 D113 Y135 Y138L46-C109 HydrophobicContact CD1-CB 4.4Å; L46-C109 HydrophobicContact CD2-CB 3.87Å; Q105-C109 PolarHBondContact O-N 2.88Å; Q105-C109 VanDerWaalsContact O-N 3.15Å; Q105-C109 PolarHBondContact O-SG 3.35Å; Q105-C109 VanDerWaalsContact O-SG 3.41Å; N106-C109 WeakPolarHBondContact O-CB 3.41Å; N106-C109 PolarHBondContact O-N 3.44Å; C109-S111 VanDerWaalsContact C-N 3.29Å; C109-S111 PolarHBondContact O-N 3.46Å; C109-L112 PolarHBondContact O-N 3.41Å; C109-D113 WeakPolarHBondContact O-CB 3.11Å; C109-D113 PolarHBondContact O-N 2.95Å; C109-Y135 HydrophobicContact CB-CD2 3.87Å; C109-Y135 HydrophobicContact CB-CE2 4.01Å; C109-Y135 VanDerWaalsContact SG-CD2 3.59Å; C109-Y138 VanDerWaalsContact SG-CD1 3.5Å
110I95.6Very high92.5Very high4 Ų419.1 Ų19.12%0.02110%0.102CC..Hα-helixtrans-58.5-43.7174.5-72.3168.5000110.9L46 L47 Q50 N106 L107 V108 D113 R114 T238L46-I110 HydrophobicContact CB-CD1 4.36Å; L46-I110 HydrophobicContact CB-CG1 3.63Å; L46-I110 HydrophobicContact CD1-CG1 4.14Å; L46-I110 HydrophobicContact CG-CG1 4.41Å; L47-I110 HydrophobicContact CD2-CD1 4.32Å; Q50-I110 HydrophobicContact CB-CD1 4Å; Q50-I110 HydrophobicContact CG-CD1 4.22Å; N106-I110 WeakPolarHBondContact O-CG1 3.41Å; N106-I110 PolarHBondContact O-N 3.37Å; L107-I110 HydrophobicContact CD1-CB 4.37Å; L107-I110 HydrophobicContact CD1-CD1 4.16Å; L107-I110 HydrophobicContact CD1-CG2 4.48Å; L107-I110 PolarHBondContact O-N 3.36Å; V108-I110 VanDerWaalsContact C-N 3.33Å; V108-I110 PolarHBondContact O-N 2.65Å; I110-D113 WeakPolarHBondContact O-CB 3.26Å; I110-D113 PolarHBondContact O-N 3.27Å; I110-R114 WeakPolarHBondContact O-CG 3.35Å; I110-R114 PolarHBondContact O-N 2.87Å; I110-R114 VanDerWaalsContact O-N 3.08Å; I110-T238 HydrophobicContact CG2-CG2 3.23Å
111S95.3Very high91Very high0 Ų025.5 Ų25.50%014%0.135CC..Hα-helixtrans-68-40.3-179-58.50000112L107 V108 C109 R114 V115 S198 H199L107-S111 PolarHBondContact O-N 3.29Å; L107-S111 PolarHBondContact O-OG 2.89Å; V108-S111 PolarHBondContact O-N 2.91Å; V108-S111 VanDerWaalsContact O-N 3.13Å; C109-S111 VanDerWaalsContact C-N 3.29Å; C109-S111 PolarHBondContact O-N 3.46Å; S111-R114 WeakPolarHBondContact O-CB 3.47Å; S111-R114 PolarHBondContact O-N 3.3Å; S111-V115 PolarHBondContact O-N 3.29Å; S111-S198 WeakPolarHBondContact CB-OG 3.37Å; S111-H199 PolarHBondContact OG-NE2 3Å
112L94.4Very high89.2Confident81 Ų8137.3 Ų37.342%0.42418%0.179SC..Hα-helixtrans-66.6-35172.2-68.4176.2000113V108 C109 R114 V115 S116 V194V108-L112 HydrophobicContact CG1-CD1 4.27Å; V108-L112 PolarHBondContact O-N 3.49Å; C109-L112 PolarHBondContact O-N 3.41Å; L112-R114 VanDerWaalsContact C-N 3.27Å; L112-R114 PolarHBondContact O-N 2.9Å; L112-V115 PolarHBondContact O-N 2.94Å; L112-S116 WeakPolarHBondContact O-CB 3.34Å; L112-S116 PolarHBondContact O-N 3.2Å; L112-S116 PolarHBondContact O-OG 2.99Å; L112-V194 HydrophobicContact CD1-CG1 4.35Å; L112-V194 HydrophobicContact CD2-CG1 3.73Å; L112-V194 HydrophobicContact CG-CG1 3.95Å
113D92.3Very high87.3Confident4 Ų438.1 Ų38.12%0.02119%0.187CC..Hα-helixtrans-63.6-32.9172.8177.248.7000111.3F42 T43 L46 C109 I110 S116 S117F42-D113 HydrophobicContact CD1-CB 4.18Å; F42-D113 WeakPolarHBondContact CD1-OD1 3.26Å; F42-D113 HydrophobicContact CE1-CB 4.04Å; T43-D113 WeakPolarHBondContact CA-OD2 3.36Å; T43-D113 WeakPolarHBondContact CB-OD2 3.48Å; T43-D113 PolarHBondContact OG1-OD2 3.41Å; L46-D113 HydrophobicContact CD1-CB 3.71Å; C109-D113 WeakPolarHBondContact O-CB 3.11Å; C109-D113 PolarHBondContact O-N 2.95Å; I110-D113 WeakPolarHBondContact O-CB 3.26Å; I110-D113 PolarHBondContact O-N 3.27Å; D113-S116 PolarHBondContact O-N 2.95Å; D113-S117 VanDerWaalsContact O-CB 3.23Å; D113-S117 WeakPolarHBondContact O-CB 3.27Å; D113-S117 PolarHBondContact O-N 3.4Å; D113-S117 PolarHBondContact O-OG 3.15Å
114R90.4Very high85.5Confident5 Ų539.3 Ų39.32%0.01919%0.193CC..Hα-helixtrans-63.7-45.2173.2-59.4-55.578.2-156.5-3.7111.8T43 I110 S111 L112 S117 V118 V202 L234 V235 T238T43-R114 PolarHBondContact OG1-NH2 3.45Å; I110-R114 WeakPolarHBondContact O-CG 3.35Å; I110-R114 PolarHBondContact O-N 2.87Å; I110-R114 VanDerWaalsContact O-N 3.08Å; S111-R114 WeakPolarHBondContact O-CB 3.47Å; S111-R114 PolarHBondContact O-N 3.3Å; L112-R114 VanDerWaalsContact C-N 3.27Å; L112-R114 PolarHBondContact O-N 2.9Å; R114-S117 PolarHBondContact O-N 3.38Å; R114-V118 WeakPolarHBondContact O-CG2 3.37Å; R114-V118 PolarHBondContact O-N 3.48Å; R114-V202 HydrophobicContact CB-CG2 4.27Å; R114-L234 VanDerWaalsContact NH1-CD1 3.29Å; R114-V235 HydrophobicContact CB-CG2 4.35Å; R114-V235 HydrophobicContact CG-CG2 4.39Å; R114-T238 HydrophobicContact CG-CG2 4.4Å
115V90.5Very high83.8Confident19 Ų1948.5 Ų48.512%0.11523%0.233CC..Hα-helixtrans-60.8-48.9176175.40000110.1S111 L112 S117 V118 L119 S198 V202S111-V115 PolarHBondContact O-N 3.29Å; L112-V115 PolarHBondContact O-N 2.94Å; V115-S117 VanDerWaalsContact C-N 3.32Å; V115-S117 PolarHBondContact O-N 3.2Å; V115-V118 PolarHBondContact O-N 3.11Å; V115-V118 VanDerWaalsContact O-N 3.13Å; V115-L119 HydrophobicContact CG1-CD1 3.61Å; V115-L119 HydrophobicContact CG1-CG 4.2Å; V115-L119 WeakPolarHBondContact O-CG 3.46Å; V115-L119 PolarHBondContact O-N 3.44Å; V115-S198 VanDerWaalsContact CG2-CB 3.43Å; V115-V202 HydrophobicContact CB-CG2 4.27Å; V115-V202 HydrophobicContact CG2-CG2 3.71Å
116S87.6Confident82.5Confident20 Ų2052.2 Ų52.214%0.1426%0.263CS..Hα-helixtrans-61.7-40-179.6-590000112L112 D113 V118 L119 F120L112-S116 WeakPolarHBondContact O-CB 3.34Å; L112-S116 PolarHBondContact O-N 3.2Å; L112-S116 PolarHBondContact O-OG 2.99Å; D113-S116 PolarHBondContact O-N 2.95Å; S116-V118 VanDerWaalsContact C-N 3.28Å; S116-V118 PolarHBondContact O-N 2.9Å; S116-L119 PolarHBondContact O-N 2.88Å; S116-F120 WeakPolarHBondContact O-CA 3.27Å; S116-F120 WeakPolarHBondContact O-CB 3.34Å; S116-F120 PolarHBondContact O-N 3.4Å
117S84.8Confident81.5Confident19 Ų1958.2 Ų58.213%0.13329%0.287CS..Hα-helixtrans-62.6-32.9176.7-67.50000112.9D113 R114 V115D113-S117 VanDerWaalsContact O-CB 3.23Å; D113-S117 WeakPolarHBondContact O-CB 3.27Å; D113-S117 PolarHBondContact O-N 3.4Å; D113-S117 PolarHBondContact O-OG 3.15Å; R114-S117 PolarHBondContact O-N 3.38Å; V115-S117 VanDerWaalsContact C-N 3.32Å; V115-S117 PolarHBondContact O-N 3.2Å
118V82.1Confident80.7Confident23 Ų2359.5 Ų59.514%0.13930%0.295CS..Hα-helixtrans-85.2-38.5179.5174.10000112.1R114 V115 S116 V202 I205 V231R114-V118 WeakPolarHBondContact O-CG2 3.37Å; R114-V118 PolarHBondContact O-N 3.48Å; V115-V118 PolarHBondContact O-N 3.11Å; V115-V118 VanDerWaalsContact O-N 3.13Å; S116-V118 VanDerWaalsContact C-N 3.28Å; S116-V118 PolarHBondContact O-N 2.9Å; V118-V202 HydrophobicContact CG2-CG1 3.98Å; V118-I205 HydrophobicContact CG1-CB 3.94Å; V118-I205 HydrophobicContact CG1-CD1 4.01Å; V118-I205 HydrophobicContact CG1-CG2 3.44Å; V118-I205 VanDerWaalsContact CG1-CG2 3.44Å; V118-V231 HydrophobicContact CG2-CG1 4.17Å
119L80.8Confident80.3Confident81 Ų8165.6 Ų65.642%0.42433%0.327SS..Hα-helixtrans-74.9-39.3179-67.2178.1000112.6V115 S116 I205V115-L119 HydrophobicContact CG1-CD1 3.61Å; V115-L119 HydrophobicContact CG1-CG 4.2Å; V115-L119 WeakPolarHBondContact O-CG 3.46Å; V115-L119 PolarHBondContact O-N 3.44Å; S116-L119 PolarHBondContact O-N 2.88Å; L119-I205 HydrophobicContact CD2-CD1 3.61Å; L119-I205 HydrophobicContact CG-CD1 4.44Å
120F73.2Confident79.9Confident103 Ų10368.4 Ų68.445%0.45234%0.344SS..  trans-114.136.7-169.8-59.2-72.2000113.4S116 R122 S123 L124S116-F120 WeakPolarHBondContact O-CA 3.27Å; S116-F120 WeakPolarHBondContact O-CB 3.34Å; S116-F120 PolarHBondContact O-N 3.4Å; F120-R122 PolarHBondContact O-N 2.89Å; F120-S123 PolarHBondContact O-N 3.3Å; F120-L124 PolarHBondContact O-N 3.41Å; F120-L124 VanDerWaalsContact O-N 3.1Å
121L65.9Low79.7Confident134 Ų13470.3 Ų70.370%0.70235%0.352SS*.THydrogen-bonded Turntrans-42.8-39.3178.3-104.2132.8000113.6
122R57.3Low79.6Confident251 Ų25172.5 Ų72.595%0.94736%0.362SS*.THydrogen-bonded Turntrans-88.3-22.3-178-163.3171.3-174.7174.11.2114.3F120F120-R122 PolarHBondContact O-N 2.89Å
123S59.6Low79.7Confident37 Ų3772.8 Ų72.826%0.25937%0.367SS..THydrogen-bonded Turntrans-104.3-12.3-167.8-150.30000114.2F120 K125 A126 Y127F120-S123 PolarHBondContact O-N 3.3Å; S123-K125 PolarHBondContact O-N 3.37Å; S123-A126 WeakPolarHBondContact O-CB 3.48Å; S123-A126 PolarHBondContact O-N 2.98Å; S123-Y127 WeakPolarHBondContact O-CD2 3.42Å; S123-Y127 PolarHBondContact O-N 3.42Å; S123-Y127 WeakPolarHBondContact OG-CD2 3.46Å; S123-Y127 WeakPolarHBondContact OG-CE2 3.4Å
124L59.3Low79.9Confident29 Ų2977.4 Ų77.415%0.15239%0.391CS..Hα-helixtrans-53.5-33.5-173.4-149.191.7000113.6F120 T128 F131F120-L124 PolarHBondContact O-N 3.41Å; F120-L124 VanDerWaalsContact O-N 3.1Å; L124-T128 PolarHBondContact O-N 3.4Å; L124-T128 PolarHBondContact O-OG1 3.31Å; L124-F131 HydrophobicContact CD1-CE2 4.46Å
125K62.5Low80.1Confident196 Ų19677.8 Ų77.885%0.85239%0.393SS*.Hα-helixtrans-68.9-34.7177.8-166177.2-178.8-1770112.8S123S123-K125 PolarHBondContact O-N 3.37Å
126A69.9Low80.5Confident78 Ų7882.5 Ų82.565%0.64541%0.412SS*.Hα-helixtrans-73.7-35.5-179.800000112S123S123-A126 WeakPolarHBondContact O-CB 3.48Å; S123-A126 PolarHBondContact O-N 2.98Å
127Y76.8Confident81Confident125 Ų12586.3 Ų86.349%0.4943%0.43SS..Hα-helixtrans-101.36.9-173.8-66.1-78.4000114.5S123 N129 T130 F131S123-Y127 WeakPolarHBondContact O-CD2 3.42Å; S123-Y127 PolarHBondContact O-N 3.42Å; S123-Y127 WeakPolarHBondContact OG-CD2 3.46Å; S123-Y127 WeakPolarHBondContact OG-CE2 3.4Å; Y127-N129 VanDerWaalsContact C-N 3.32Å; Y127-N129 PolarHBondContact O-N 3.47Å; Y127-T130 WeakPolarHBondContact O-CB 3.33Å; Y127-T130 PolarHBondContact O-N 3.13Å; Y127-T130 VanDerWaalsContact O-N 3.07Å; Y127-F131 WeakPolarHBondContact O-CD2 3.33Å; Y127-F131 PolarHBondContact O-N 3Å
128T82Confident81.6Confident28 Ų2888.2 Ų88.217%0.17244%0.435CS..Hα-helixtrans-53.3-47.8-176.7-62.40000111.7L124 T130 F131 F132L124-T128 PolarHBondContact O-N 3.4Å; L124-T128 PolarHBondContact O-OG1 3.31Å; T128-T130 VanDerWaalsContact C-N 3.34Å; T128-T130 PolarHBondContact O-N 3.32Å; T128-F131 PolarHBondContact O-N 2.97Å; T128-F132 HydrophobicContact CG2-CD2 3.96Å; T128-F132 HydrophobicContact CG2-CE2 3.67Å; T128-F132 WeakPolarHBondContact O-CD2 3.28Å; T128-F132 PolarHBondContact O-N 2.95Å
129N87.8Confident82.4Confident129 Ų12987.9 Ų87.969%0.6943%0.432SS*.Hα-helixtrans-64.8-37.4-179.9-69.5-5000112.5Y127 F132 V133Y127-N129 VanDerWaalsContact C-N 3.32Å; Y127-N129 PolarHBondContact O-N 3.47Å; N129-F132 PolarHBondContact O-N 3.44Å; N129-V133 WeakPolarHBondContact O-CG2 3.49Å; N129-V133 PolarHBondContact O-N 3.44Å
130T89.8Confident83.2Confident71 Ų7188.4 Ų88.444%0.43644%0.435SS..Hα-helixtrans-63.1-42176.1-51.30000111.3Y127 T128 F132 V133 L134Y127-T130 WeakPolarHBondContact O-CB 3.33Å; Y127-T130 PolarHBondContact O-N 3.13Å; Y127-T130 VanDerWaalsContact O-N 3.07Å; T128-T130 VanDerWaalsContact C-N 3.34Å; T128-T130 PolarHBondContact O-N 3.32Å; T130-F132 VanDerWaalsContact C-N 3.31Å; T130-F132 PolarHBondContact O-N 3.09Å; T130-V133 PolarHBondContact O-N 2.91Å; T130-L134 HydrophobicContact CG2-CD1 4.1Å; T130-L134 HydrophobicContact CG2-CG 4.39Å; T130-L134 WeakPolarHBondContact O-CB 3.32Å; T130-L134 WeakPolarHBondContact O-CG 3.49Å; T130-L134 PolarHBondContact O-N 3.31Å
131F91.2Very high84.4Confident43 Ų4386.3 Ų86.319%0.18943%0.433CS..Hα-helixtrans-60.8-39.2175.2-74.3-66000112.3F42 L124 Y127 T128 Y135F42-F131 HydrophobicContact CD1-CB 4.14Å; F42-F131 HydrophobicContact CD2-CB 4.26Å; F42-F131 HydrophobicContact CE1-CB 4.1Å; F42-F131 HydrophobicContact CE2-CB 4.25Å; F42-F131 HydrophobicContact CG-CB 4.22Å; F42-F131 HydrophobicContact CZ-CB 4.17Å; L124-F131 HydrophobicContact CD1-CE2 4.46Å; Y127-F131 WeakPolarHBondContact O-CD2 3.33Å; Y127-F131 PolarHBondContact O-N 3Å; T128-F131 PolarHBondContact O-N 2.97Å; F131-Y135 VanDerWaalsContact O-CB 3.26Å; F131-Y135 WeakPolarHBondContact O-CB 3.48Å; F131-Y135 PolarHBondContact O-N 2.92Å
132F94.1Very high85.9Confident47 Ų4780.9 Ų80.921%0.20640%0.404CS..Hα-helixtrans-63.6-46.7174-82.4-77000112.4F42 F45 T128 N129 T130 L134 Y135 F136F42-F132 HydrophobicContact CB-CE2 4.29Å; F42-F132 HydrophobicContact CB-CZ 4.42Å; F42-F132 HydrophobicContact CD2-CD1 4.09Å; F42-F132 HydrophobicContact CD2-CD2 4.19Å; F42-F132 AromaticContact CD2-CE1 3.98Å; F42-F132 HydrophobicContact CD2-CE1 3.98Å; F42-F132 HydrophobicContact CD2-CE2 4.06Å; F42-F132 HydrophobicContact CD2-CG 4.19Å; F42-F132 AromaticContact CD2-CZ 3.95Å; F42-F132 HydrophobicContact CD2-CZ 3.95Å; F42-F132 HydrophobicContact CE2-CD1 4.36Å; F45-F132 HydrophobicContact CB-CE1 3.92Å; F45-F132 HydrophobicContact CB-CZ 4.02Å; F45-F132 HydrophobicContact CD1-CD1 4.24Å; F45-F132 AromaticContact CD1-CE1 3.57Å; F45-F132 HydrophobicContact CD1-CE1 3.57Å; F45-F132 HydrophobicContact CD1-CZ 4.4Å; F45-F132 AromaticContact CD2-CE1 4Å; F45-F132 HydrophobicContact CD2-CE1 4Å; F45-F132 HydrophobicContact CE1-CD1 4.3Å; F45-F132 HydrophobicContact CE1-CE1 4.02Å; F45-F132 HydrophobicContact CE2-CE1 4.41Å; F45-F132 AromaticContact CG-CE1 3.55Å; F45-F132 HydrophobicContact CG-CE1 3.55Å; F45-F132 HydrophobicContact CG-CZ 4.17Å; F45-F132 HydrophobicContact CZ-CE1 4.42Å; T128-F132 HydrophobicContact CG2-CD2 3.96Å; T128-F132 HydrophobicContact CG2-CE2 3.67Å; T128-F132 WeakPolarHBondContact O-CD2 3.28Å; T128-F132 PolarHBondContact O-N 2.95Å; N129-F132 PolarHBondContact O-N 3.44Å; T130-F132 VanDerWaalsContact C-N 3.31Å; T130-F132 PolarHBondContact O-N 3.09Å; F132-L134 PolarHBondContact O-N 2.98Å; F132-Y135 WeakPolarHBondContact O-CB 3.25Å; F132-Y135 PolarHBondContact O-N 3.35Å; F132-F136 HydrophobicContact CD1-CE2 4.19Å; F132-F136 WeakPolarHBondContact O-CD2 3.36Å; F132-F136 PolarHBondContact O-N 2.9Å
133V95.7Very high87.8Confident86 Ų8671.1 Ų71.152%0.52137%0.37SS..Hα-helixtrans-61.1-47178.5173.90000110.9N129 T130 Y135 F136 L137N129-V133 WeakPolarHBondContact O-CG2 3.49Å; N129-V133 PolarHBondContact O-N 3.44Å; T130-V133 PolarHBondContact O-N 2.91Å; V133-Y135 VanDerWaalsContact C-N 3.32Å; V133-Y135 PolarHBondContact O-N 3.47Å; V133-F136 PolarHBondContact O-N 3.45Å; V133-L137 HydrophobicContact CG1-CD1 3.96Å; V133-L137 HydrophobicContact CG1-CG 4.41Å; V133-L137 WeakPolarHBondContact O-CG 3.36Å; V133-L137 PolarHBondContact O-N 3.17Å
134L95.6Very high89.6Confident102 Ų10273.9 Ų73.953%0.53438%0.382SS..Hα-helixtrans-61.4-40.5177.5-70.5174.7000112.1T130 F132 Y138T130-L134 HydrophobicContact CG2-CD1 4.1Å; T130-L134 HydrophobicContact CG2-CG 4.39Å; T130-L134 WeakPolarHBondContact O-CB 3.32Å; T130-L134 WeakPolarHBondContact O-CG 3.49Å; T130-L134 PolarHBondContact O-N 3.31Å; F132-L134 PolarHBondContact O-N 2.98Å; L134-Y138 VanDerWaalsContact O-CB 3.26Å; L134-Y138 WeakPolarHBondContact O-CB 3.29Å; L134-Y138 PolarHBondContact O-N 2.97Å
135Y96.5Very high91.4Very high13 Ų1375.3 Ų75.35%0.05139%0.389CS..Hα-helixtrans-58.7-51.4174.4171-92.5000111.9F42 F45 L46 T49 N106 C109 F131 F132 V133 L137 Y138 M139F42-Y135 HydrophobicContact CE2-CD2 4.48Å; F42-Y135 HydrophobicContact CE2-CG 4.22Å; F42-Y135 HydrophobicContact CZ-CD2 4.33Å; F42-Y135 HydrophobicContact CZ-CG 4.4Å; F45-Y135 AromaticContact CE1-CD1 3.69Å; F45-Y135 HydrophobicContact CE1-CD1 3.69Å; F45-Y135 AromaticContact CE1-CE1 3.39Å; F45-Y135 HydrophobicContact CE1-CE1 3.39Å; F45-Y135 HydrophobicContact CE1-CE2 4.37Å; F45-Y135 HydrophobicContact CE1-CG 4.31Å; F45-Y135 AromaticContact CE1-CZ 3.74Å; F45-Y135 HydrophobicContact CZ-CD1 4.17Å; F45-Y135 AromaticContact CZ-CE1 3.64Å; F45-Y135 HydrophobicContact CZ-CE1 3.64Å; L46-Y135 HydrophobicContact CD2-CD2 3.55Å; L46-Y135 HydrophobicContact CD2-CE2 3.28Å; L46-Y135 HydrophobicContact CD2-CG 4.48Å; T49-Y135 WeakPolarHBondContact CG2-OH 3.24Å; N106-Y135 WeakPolarHBondContact OD1-CE2 3.21Å; N106-Y135 PolarHBondContact OD1-OH 3.41Å; C109-Y135 HydrophobicContact CB-CD2 3.87Å; C109-Y135 HydrophobicContact CB-CE2 4.01Å; C109-Y135 VanDerWaalsContact SG-CD2 3.59Å; F131-Y135 VanDerWaalsContact O-CB 3.26Å; F131-Y135 WeakPolarHBondContact O-CB 3.48Å; F131-Y135 PolarHBondContact O-N 2.92Å; F132-Y135 WeakPolarHBondContact O-CB 3.25Å; F132-Y135 PolarHBondContact O-N 3.35Å; V133-Y135 VanDerWaalsContact C-N 3.32Å; V133-Y135 PolarHBondContact O-N 3.47Å; Y135-L137 PolarHBondContact O-N 3.03Å; Y135-Y138 PolarHBondContact O-N 3.21Å; Y135-M139 HydrophobicContact CD1-CG 4.2Å; Y135-M139 HydrophobicContact CD2-CG 4.06Å; Y135-M139 HydrophobicContact CE1-CG 3.77Å; Y135-M139 HydrophobicContact CE2-CG 3.65Å; Y135-M139 HydrophobicContact CE2-SD 4.04Å; Y135-M139 HydrophobicContact CG-CG 4.33Å; Y135-M139 WeakPolarHBondContact O-CB 3.5Å; Y135-M139 VanDerWaalsContact O-CG 3.29Å; Y135-M139 WeakPolarHBondContact O-CG 3.49Å; Y135-M139 PolarHBondContact O-N 2.91Å
136F97.7Very high93Very high117 Ų11766.3 Ų66.351%0.51335%0.35SS..Hα-helixtrans-66.1-39-177.9-75.5-65.3000112.3F45 F132 V133 L140F45-F136 HydrophobicContact CE2-CZ 4.5Å; F45-F136 HydrophobicContact CZ-CE1 4.37Å; F45-F136 AromaticContact CZ-CZ 3.92Å; F45-F136 HydrophobicContact CZ-CZ 3.92Å; F132-F136 HydrophobicContact CD1-CE2 4.19Å; F132-F136 WeakPolarHBondContact O-CD2 3.36Å; F132-F136 PolarHBondContact O-N 2.9Å; V133-F136 PolarHBondContact O-N 3.45Å; F136-L140 WeakPolarHBondContact O-CB 3.18Å; F136-L140 PolarHBondContact O-N 2.92Å
137L98.1Very high94.2Very high100 Ų10063 Ų6352%0.52432%0.321SS..Hα-helixtrans-60.9-46.9173.7-70.9174.1000111.1V133 Y135 L140 S141V133-L137 HydrophobicContact CG1-CD1 3.96Å; V133-L137 HydrophobicContact CG1-CG 4.41Å; V133-L137 WeakPolarHBondContact O-CG 3.36Å; V133-L137 PolarHBondContact O-N 3.17Å; Y135-L137 PolarHBondContact O-N 3.03Å; L137-L140 PolarHBondContact O-N 3.44Å; L137-S141 WeakPolarHBondContact O-CB 3.48Å; L137-S141 PolarHBondContact O-N 2.92Å; L137-S141 PolarHBondContact O-OG 3.34Å
138Y98.1Very high95Very high59 Ų5960.2 Ų60.223%0.23131%0.314CS..Hα-helixtrans-59.8-51.6177.2174.7-98.1000112.5Q105 C109 L134 Y135 L140 S141 M142Q105-Y138 HydrophobicContact CB-CE1 4Å; Q105-Y138 PolarHBondContact OE1-OH 3.41Å; C109-Y138 VanDerWaalsContact SG-CD1 3.5Å; L134-Y138 VanDerWaalsContact O-CB 3.26Å; L134-Y138 WeakPolarHBondContact O-CB 3.29Å; L134-Y138 PolarHBondContact O-N 2.97Å; Y135-Y138 PolarHBondContact O-N 3.21Å; Y138-L140 VanDerWaalsContact C-N 3.32Å; Y138-L140 PolarHBondContact O-N 2.65Å; Y138-S141 PolarHBondContact O-N 2.99Å; Y138-M142 HydrophobicContact CD1-CG 4.47Å; Y138-M142 HydrophobicContact CD2-CE 4.15Å; Y138-M142 HydrophobicContact CD2-CG 4.48Å; Y138-M142 HydrophobicContact CE1-CG 4.07Å; Y138-M142 HydrophobicContact CE2-CE 3.36Å; Y138-M142 HydrophobicContact CE2-CG 4.1Å; Y138-M142 WeakPolarHBondContact O-CG 3.25Å; Y138-M142 PolarHBondContact O-N 2.99Å
139M98Very high95.5Very high17 Ų1759.3 Ų59.38%0.08431%0.309CS..Hα-helixtrans-61.9-41-179.5-69.1-58.4-68.700111.6M102 Q105 N106 Y135 M142 L143M102-M139 HydrophobicContact CB-CE 4.07Å; M102-M139 HydrophobicContact CG-CE 4.43Å; M102-M139 WeakPolarHBondContact O-CE 3.03Å; M102-M139 HydrophobicContact SD-CE 3.62Å; Q105-M139 HydrophobicContact CB-CE 4.22Å; Q105-M139 HydrophobicContact CB-SD 3.86Å; N106-M139 HydrophobicContact CB-CE 4.43Å; Y135-M139 HydrophobicContact CD1-CG 4.2Å; Y135-M139 HydrophobicContact CD2-CG 4.06Å; Y135-M139 HydrophobicContact CE1-CG 3.77Å; Y135-M139 HydrophobicContact CE2-CG 3.65Å; Y135-M139 HydrophobicContact CE2-SD 4.04Å; Y135-M139 HydrophobicContact CG-CG 4.33Å; Y135-M139 WeakPolarHBondContact O-CB 3.5Å; Y135-M139 VanDerWaalsContact O-CG 3.29Å; Y135-M139 WeakPolarHBondContact O-CG 3.49Å; Y135-M139 PolarHBondContact O-N 2.91Å; M139-M142 PolarHBondContact O-N 2.93Å; M139-L143 WeakPolarHBondContact O-CB 3.29Å; M139-L143 PolarHBondContact O-N 3.28Å
140L98.1Very high95.6Very high92 Ų9254.9 Ų54.948%0.48229%0.286SS..Hα-helixtrans-63.8-45.1175.3-178.862.5000111.4F136 L137 Y138 M142 L143 L144F136-L140 WeakPolarHBondContact O-CB 3.18Å; F136-L140 PolarHBondContact O-N 2.92Å; L137-L140 PolarHBondContact O-N 3.44Å; Y138-L140 VanDerWaalsContact C-N 3.32Å; Y138-L140 PolarHBondContact O-N 2.65Å; L140-M142 PolarHBondContact O-N 3.27Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3Å; L140-L144 HydrophobicContact CD1-CD1 4.4Å; L140-L144 HydrophobicContact CD1-CG 4.34Å; L140-L144 HydrophobicContact CG-CD1 4.2Å; L140-L144 VanDerWaalsContact O-CG 3.27Å; L140-L144 WeakPolarHBondContact O-CG 3.2Å; L140-L144 PolarHBondContact O-N 2.89Å
141S98.1Very high95.7Very high59 Ų5952.2 Ų52.241%0.41327%0.27SS..Hα-helixtrans-59.5-45.7176.1-65.10000112L137 Y138 L143 L144 I145L137-S141 WeakPolarHBondContact O-CB 3.48Å; L137-S141 PolarHBondContact O-N 2.92Å; L137-S141 PolarHBondContact O-OG 3.34Å; Y138-S141 PolarHBondContact O-N 2.99Å; S141-L143 PolarHBondContact O-N 2.93Å; S141-L144 PolarHBondContact O-N 3.45Å; S141-I145 WeakPolarHBondContact O-CB 3.35Å; S141-I145 WeakPolarHBondContact O-CD1 3.29Å; S141-I145 VanDerWaalsContact O-CG1 3.3Å; S141-I145 WeakPolarHBondContact O-CG1 3.45Å; S141-I145 PolarHBondContact O-N 3.43Å
142M97.8Very high95.6Very high20 Ų2054.5 Ų54.510%0.09928%0.284CS..Hα-helixtrans-65.8-38.1178.2-68.2-56.9172.700112.3Q105 Y138 M139 L140 I145 L146 L186Q105-M142 HydrophobicContact CG-CB 3.89Å; Q105-M142 HydrophobicContact CG-CG 4.01Å; Y138-M142 HydrophobicContact CD1-CG 4.47Å; Y138-M142 HydrophobicContact CD2-CE 4.15Å; Y138-M142 HydrophobicContact CD2-CG 4.48Å; Y138-M142 HydrophobicContact CE1-CG 4.07Å; Y138-M142 HydrophobicContact CE2-CE 3.36Å; Y138-M142 HydrophobicContact CE2-CG 4.1Å; Y138-M142 WeakPolarHBondContact O-CG 3.25Å; Y138-M142 PolarHBondContact O-N 2.99Å; M139-M142 PolarHBondContact O-N 2.93Å; L140-M142 PolarHBondContact O-N 3.27Å; M142-I145 PolarHBondContact O-N 3.05Å; M142-L146 HydrophobicContact CB-CD1 4.39Å; M142-L146 VanDerWaalsContact O-CB 3.3Å; M142-L146 WeakPolarHBondContact O-CB 3.47Å; M142-L146 PolarHBondContact O-N 3.27Å; M142-L146 HydrophobicContact SD-CD1 4.13Å; M142-L186 HydrophobicContact CE-CD2 4.48Å; M142-L186 HydrophobicContact SD-CB 4.4Å
143L97.3Very high95.3Very high45 Ų4552.9 Ų52.924%0.23628%0.277CS..Iπ-helixtrans-59.4-48173.2-179.971.6000111.4L98 M102 M139 L140 S141 I145 Y147 I148L98-L143 HydrophobicContact CD1-CD1 3.32Å; M102-L143 HydrophobicContact CE-CB 3.71Å; M102-L143 HydrophobicContact CE-CD1 3.75Å; M102-L143 HydrophobicContact CE-CG 4.36Å; M102-L143 HydrophobicContact SD-CB 4.29Å; M102-L143 HydrophobicContact SD-CD1 4.21Å; M139-L143 WeakPolarHBondContact O-CB 3.29Å; M139-L143 PolarHBondContact O-N 3.28Å; L140-L143 WeakPolarHBondContact O-CB 3.47Å; L140-L143 PolarHBondContact O-N 3Å; S141-L143 PolarHBondContact O-N 2.93Å; L143-I145 PolarHBondContact O-N 2.83Å; L143-Y147 HydrophobicContact CD1-CD1 3.86Å; L143-Y147 HydrophobicContact CD1-CG 4.12Å; L143-Y147 WeakPolarHBondContact O-CA 3.37Å; L143-Y147 WeakPolarHBondContact O-CB 3.31Å; L143-Y147 PolarHBondContact O-N 2.71Å; L143-I148 PolarHBondContact O-N 2.9Å; L143-I148 VanDerWaalsContact O-N 3.1Å
144L96.9Very high95.1Very high96 Ų9649.3 Ų49.350%0.50325%0.254SS..Iπ-helixtrans-65.3-37.6-179.3-68.7175.7000112.5L140 S141 I148L140-L144 HydrophobicContact CD1-CD1 4.4Å; L140-L144 HydrophobicContact CD1-CG 4.34Å; L140-L144 HydrophobicContact CG-CD1 4.2Å; L140-L144 VanDerWaalsContact O-CG 3.27Å; L140-L144 WeakPolarHBondContact O-CG 3.2Å; L140-L144 PolarHBondContact O-N 2.89Å; S141-L144 PolarHBondContact O-N 3.45Å; L144-I148 HydrophobicContact CD2-CG1 3.98Å
145I96.4Very high94.8Very high58 Ų5848.8 Ų48.830%0.29725%0.245SC..Iπ-helixtrans-81.8-45.9-176.7-67.8164.5000111.8S141 M142 L143 P149 L186S141-I145 WeakPolarHBondContact O-CB 3.35Å; S141-I145 WeakPolarHBondContact O-CD1 3.29Å; S141-I145 VanDerWaalsContact O-CG1 3.3Å; S141-I145 WeakPolarHBondContact O-CG1 3.45Å; S141-I145 PolarHBondContact O-N 3.43Å; M142-I145 PolarHBondContact O-N 3.05Å; L143-I145 PolarHBondContact O-N 2.83Å; I145-P149 WeakPolarHBondContact O-CD 3.39Å; I145-P149 VanDerWaalsContact O-CG 3.32Å; I145-P149 WeakPolarHBondContact O-CG 3.18Å; I145-L186 HydrophobicContact CG2-CD1 3.48Å; I145-L186 VanDerWaalsContact CG2-CD1 3.48Å
146L96.3Very high94.5Very high8 Ų849.9 Ų49.94%0.04225%0.25CC..Iπ-helixtrans-93.4-41.1-170.2-63.9170.2000112.6I101 M142 S182 L186 E187I101-L146 HydrophobicContact CD1-CB 4.15Å; I101-L146 HydrophobicContact CG2-CB 3.89Å; I101-L146 HydrophobicContact CG2-CD1 3.84Å; M142-L146 HydrophobicContact CB-CD1 4.39Å; M142-L146 VanDerWaalsContact O-CB 3.3Å; M142-L146 WeakPolarHBondContact O-CB 3.47Å; M142-L146 PolarHBondContact O-N 3.27Å; M142-L146 HydrophobicContact SD-CD1 4.13Å; L146-S182 VanDerWaalsContact CD2-O 3.29Å; L146-S182 WeakPolarHBondContact CD2-O 3.48Å; L146-L186 HydrophobicContact CD1-CB 4.05Å; L146-L186 HydrophobicContact CD2-CB 3.75Å; L146-L186 HydrophobicContact CD2-CD1 4.34Å; L146-L186 HydrophobicContact CG-CB 4.27Å; L146-E187 HydrophobicContact CD1-CB 4.39Å
147Y95.7Very high94Very high8 Ų847.1 Ų47.13%0.03124%0.242CC..Iπ-helixtrans-91.1-52.1-172.9-177.7-107.5000112.8A94 L98 I101 L143 P149 T150 P151A94-Y147 WeakPolarHBondContact O-CE2 3.2Å; L98-Y147 HydrophobicContact CB-CD2 3.86Å; L98-Y147 HydrophobicContact CB-CE1 4.27Å; L98-Y147 HydrophobicContact CB-CE2 3.45Å; L98-Y147 VanDerWaalsContact CB-CE2 3.45Å; L98-Y147 HydrophobicContact CB-CG 4.43Å; L98-Y147 HydrophobicContact CD1-CD1 3.7Å; L98-Y147 HydrophobicContact CD1-CD2 4.07Å; L98-Y147 HydrophobicContact CD1-CE1 3.89Å; L98-Y147 HydrophobicContact CD1-CE2 4.27Å; L98-Y147 HydrophobicContact CD1-CG 3.78Å; L98-Y147 HydrophobicContact CD2-CE1 4.28Å; L98-Y147 HydrophobicContact CG-CE1 4.37Å; L98-Y147 HydrophobicContact CG-CE2 4.35Å; I101-Y147 HydrophobicContact CD1-CD2 4.33Å; L143-Y147 HydrophobicContact CD1-CD1 3.86Å; L143-Y147 HydrophobicContact CD1-CG 4.12Å; L143-Y147 WeakPolarHBondContact O-CA 3.37Å; L143-Y147 WeakPolarHBondContact O-CB 3.31Å; L143-Y147 PolarHBondContact O-N 2.71Å; Y147-P149 VanDerWaalsContact C-CD 3.4Å; Y147-P149 VanDerWaalsContact C-N 3.33Å; Y147-T150 VanDerWaalsContact O-CB 3.28Å; Y147-T150 WeakPolarHBondContact O-CB 3.27Å; Y147-T150 PolarHBondContact O-N 3.28Å; Y147-P151 HydrophobicContact CD1-CG 4.45Å; Y147-P151 HydrophobicContact CE1-CG 3.86Å; Y147-P151 WeakPolarHBondContact O-CD 3.23Å
148I94.1Very high93.4Very high67 Ų6749.6 Ų49.634%0.34426%0.256SS..THydrogen-bonded Turntrans-54.2-37.4-172.3-65.2-61.2000114.6L143 L144 T150 P151 L152L143-I148 PolarHBondContact O-N 2.9Å; L143-I148 VanDerWaalsContact O-N 3.1Å; L144-I148 HydrophobicContact CD2-CG1 3.98Å; I148-T150 PolarHBondContact O-N 3.33Å; I148-T150 VanDerWaalsContact O-N 3.15Å; I148-P151 WeakPolarHBondContact O-CD 3.48Å; I148-L152 HydrophobicContact CG2-CD1 4.13Å; I148-L152 HydrophobicContact CG2-CG 4.44Å; I148-L152 WeakPolarHBondContact O-CG 3.3Å; I148-L152 PolarHBondContact O-N 2.85Å
149P92Very high92.6Very high9 Ų950.2 Ų50.26%0.05827%0.269CS..Hα-helixtrans-58.8-27.1175.2-27.737.8000113.9I145 Y147 L152 F175 Y178 I179I145-P149 WeakPolarHBondContact O-CD 3.39Å; I145-P149 VanDerWaalsContact O-CG 3.32Å; I145-P149 WeakPolarHBondContact O-CG 3.18Å; Y147-P149 VanDerWaalsContact C-CD 3.4Å; Y147-P149 VanDerWaalsContact C-N 3.33Å; P149-L152 PolarHBondContact O-N 3.45Å; P149-F175 HydrophobicContact CB-CE2 4.29Å; P149-F175 HydrophobicContact CB-CZ 4.01Å; P149-Y178 HydrophobicContact CG-CE1 4.07Å; P149-I179 HydrophobicContact CB-CD1 3.84Å; P149-I179 HydrophobicContact CB-CG1 3.69Å
150T90Very high92.1Very high36 Ų3654.7 Ų54.722%0.22129%0.29CS..Hα-helixtrans-71.7-50.7-175.4-61.80000112.5Y147 I148 L152 L153Y147-T150 VanDerWaalsContact O-CB 3.28Å; Y147-T150 WeakPolarHBondContact O-CB 3.27Å; Y147-T150 PolarHBondContact O-N 3.28Å; I148-T150 PolarHBondContact O-N 3.33Å; I148-T150 VanDerWaalsContact O-N 3.15Å; T150-L152 PolarHBondContact O-N 2.96Å; T150-L153 WeakPolarHBondContact O-CB 3.33Å; T150-L153 PolarHBondContact O-N 3.48Å
151P91Very high91.7Very high14 Ų1451.4 Ų51.49%0.09127%0.274CS..Hα-helixtrans-60.2-29.6170.4-26.834.7000114.6H88 Y147 I148 L153 R154H88-P151 HydrophobicContact CB-CB 4.25Å; H88-P151 PolarHBondContact CD2-O 3.4Å; Y147-P151 HydrophobicContact CD1-CG 4.45Å; Y147-P151 HydrophobicContact CE1-CG 3.86Å; Y147-P151 WeakPolarHBondContact O-CD 3.23Å; I148-P151 WeakPolarHBondContact O-CD 3.48Å; P151-L153 PolarHBondContact O-N 3.44Å; P151-R154 WeakPolarHBondContact O-CB 3.44Å; P151-R154 PolarHBondContact O-N 3.48Å
152L89.6Confident91.3Very high91 Ų9151 Ų5148%0.47627%0.269SS..Hα-helixtrans-64.9-25.4179.4-68.1176.3000112.9I148 P149 T150 R154 F167I148-L152 HydrophobicContact CG2-CD1 4.13Å; I148-L152 HydrophobicContact CG2-CG 4.44Å; I148-L152 WeakPolarHBondContact O-CG 3.3Å; I148-L152 PolarHBondContact O-N 2.85Å; P149-L152 PolarHBondContact O-N 3.45Å; T150-L152 PolarHBondContact O-N 2.96Å; L152-R154 PolarHBondContact O-N 2.91Å; L152-R154 VanDerWaalsContact O-N 3.14Å; L152-F167 HydrophobicContact CB-CZ 4.18Å; L152-F167 VanDerWaalsContact O-CZ 3.3Å; L152-F167 WeakPolarHBondContact O-CZ 3.45Å
153L89.2Confident90.8Very high13 Ų1352.5 Ų52.57%0.06828%0.276CS..THydrogen-bonded Turntrans-70.73173.2-71.2175.1000114T150 P151 M163 D164 F165 F167 F175 L176 I179T150-L153 WeakPolarHBondContact O-CB 3.33Å; T150-L153 PolarHBondContact O-N 3.48Å; P151-L153 PolarHBondContact O-N 3.44Å; L153-M163 HydrophobicContact CB-CE 3.77Å; L153-M163 HydrophobicContact CD1-CE 4.28Å; L153-M163 CarbonylContact O-C 3.55Å; L153-M163 WeakPolarHBondContact O-CA 3.42Å; L153-D164 CarbonylContact C-O 3.6Å; L153-D164 PolarHBondContact O-N 3.13Å; L153-F165 HydrophobicContact CD1-CE1 4.39Å; L153-F165 HydrophobicContact CD2-CD1 3.59Å; L153-F165 HydrophobicContact CD2-CE1 4.05Å; L153-F167 HydrophobicContact CD2-CE2 4.19Å; L153-F175 HydrophobicContact CD2-CD1 3.85Å; L153-F175 HydrophobicContact CD2-CE1 3.49Å; L153-F175 VanDerWaalsContact CD2-CE1 3.49Å; L153-F175 HydrophobicContact CG-CE1 3.88Å; L153-L176 HydrophobicContact CD1-CD2 4.47Å; L153-I179 HydrophobicContact CD1-CD1 3.64Å; L153-I179 HydrophobicContact CD2-CD1 4.5Å; L153-I179 HydrophobicContact CG-CD1 4.07Å
154R90.6Very high90.3Very high11 Ų1151.9 Ų51.94%0.04227%0.273CS..EExtended strand (participates in β ladder)trans-114.7137.1-176.1-53.8-179.1179.1116.27.1109.1C87 H88 F91 A94 P151 L152 V162 M163C87-R154 WeakPolarHBondContact O-CD 3.38Å; H88-R154 PolarHBondContact NE2-O 3.3Å; H88-R154 PolarHBondContact O-NH1 3.42Å; F91-R154 HydrophobicContact CD1-CG 4.31Å; F91-R154 PolarHBondContact O-NE 3.43Å; F91-R154 PolarHBondContact O-NH2 3.08Å; A94-R154 VanDerWaalsContact CB-CZ 3.42Å; A94-R154 VanDerWaalsContact CB-NH2 3.26Å; P151-R154 WeakPolarHBondContact O-CB 3.44Å; P151-R154 PolarHBondContact O-N 3.48Å; L152-R154 PolarHBondContact O-N 2.91Å; L152-R154 VanDerWaalsContact O-N 3.14Å; R154-V162 WeakPolarHBondContact CA-O 3.27Å; R154-M163 HydrophobicContact CG-SD 4.35Å
155R89.8Confident89.7Confident92 Ų9251.1 Ų51.135%0.34727%0.266SS..EExtended strand (participates in β ladder)trans-129.1144.6168.3-70.5-165.6-167.3159.91110.2T157 V162 D164 S166R155-T157 HydrophobicContact CB-CG2 4.14Å; R155-V162 PolarHBondContact N-O 2.85Å; R155-V162 PolarHBondContact O-N 3.33Å; R155-D164 HydrophobicContact CB-CB 4.14Å; R155-D164 WeakPolarHBondContact CD-OD2 3.3Å; R155-D164 HydrophobicContact CG-CB 3.8Å; R155-D164 IonicContact CZ-OD2 2.91Å; R155-D164 IonicContact NE-OD2 3.08Å; R155-D164 PolarHBondContact NE-OD2 2.84Å; R155-D164 VanDerWaalsContact NE-OD2 3.08Å; R155-D164 IonicContact NH1-OD2 2.65Å; R155-D164 PolarHBondContact NH1-OD2 2.78Å; R155-D164 IonicContact NH2-OD2 3.73Å; R155-S166 PolarHBondContact NH2-O 2.6Å
156Y89.5Confident89Confident36 Ų3651.3 Ų51.314%0.14127%0.272CS..EExtended strand (participates in β ladder)trans-98101.9172-172.2-110.8000108.5Y76 Y80 D83 I84 C87 S159 Q160Y76-Y156 HydrophobicContact CD1-CE2 4.14Å; Y76-Y156 HydrophobicContact CE1-CE2 4.1Å; Y80-Y156 HydrophobicContact CD2-CD1 4.14Å; Y80-Y156 AromaticContact CD2-CE1 3.79Å; Y80-Y156 HydrophobicContact CD2-CE1 3.79Å; Y80-Y156 AromaticContact CE2-CD1 3.78Å; Y80-Y156 HydrophobicContact CE2-CD1 3.78Å; Y80-Y156 AromaticContact CE2-CE1 3.88Å; Y80-Y156 HydrophobicContact CE2-CE1 3.88Å; D83-Y156 HydrophobicContact CB-CE1 4.15Å; D83-Y156 HydrophobicContact CB-CE2 3.94Å; D83-Y156 WeakPolarHBondContact CB-OH 3.39Å; I84-Y156 HydrophobicContact CG1-CD1 3.8Å; I84-Y156 HydrophobicContact CG1-CG 4.11Å; C87-Y156 HydrophobicContact CB-CD2 4.22Å; Y156-S159 WeakPolarHBondContact OH-CA 3.49Å; Y156-Q160 WeakPolarHBondContact CA-O 3.43Å
157T87.2Confident88.1Confident59 Ų5952 Ų5236%0.36228%0.275SS..EExtended strand (participates in β ladder)trans-130138.6-17653.80000109.7R155 S159 Q160 V162R155-T157 HydrophobicContact CB-CG2 4.14Å; T157-S159 PolarHBondContact O-N 3.3Å; T157-S159 VanDerWaalsContact O-N 3.17Å; T157-Q160 PolarHBondContact N-O 3.39Å; T157-Q160 PolarHBondContact O-N 2.99Å; T157-Q160 VanDerWaalsContact O-O 3.05Å; T157-V162 WeakPolarHBondContact OG1-CG2 3.46Å
158D84.6Confident87.3Confident152 Ų15257.3 Ų57.381%0.81331%0.31SS*.THydrogen-bonded Turntrans51.938.8177.4-56.9-38.5000114.3Q160D158-Q160 PolarHBondContact O-N 3.5Å
159S82.7Confident86.8Confident71 Ų7163.5 Ų63.550%0.49733%0.33SS..THydrogen-bonded Turntrans56.736.8-173.9-46.80000112.7Y76 Y156 T157Y76-S159 WeakPolarHBondContact CE1-O 3.26Å; Y76-S159 WeakPolarHBondContact CE2-O 3.46Å; Y76-S159 PolarHBondContact OH-O 3.4Å; Y156-S159 WeakPolarHBondContact OH-CA 3.49Å; T157-S159 PolarHBondContact O-N 3.3Å; T157-S159 VanDerWaalsContact O-N 3.17Å
160Q86.7Confident86.6Confident112 Ų11265.5 Ų65.552%0.52334%0.339SS..EExtended strand (participates in β ladder)trans-138.3145.6171.8-57.3-168-10.100110Y76 Y156 T157 D158 V162Y76-Q160 WeakPolarHBondContact OH-CA 3.3Å; Y76-Q160 WeakPolarHBondContact OH-CG 3.27Å; Y156-Q160 WeakPolarHBondContact CA-O 3.43Å; T157-Q160 PolarHBondContact N-O 3.39Å; T157-Q160 PolarHBondContact O-N 2.99Å; T157-Q160 VanDerWaalsContact O-O 3.05Å; D158-Q160 PolarHBondContact O-N 3.5Å; Q160-V162 HydrophobicContact CB-CG1 4.32Å
161C89.2Confident86.5Confident23 Ų2370.9 Ų70.916%0.15536%0.362CS..EExtended strand (participates in β ladder)trans-89.2116170-168.40000109C87 F91C87-C161 WeakPolarHBondContact CA-SG 3.16Å; C87-C161 HydrophobicContact CB-CB 3.63Å; C87-C161 WeakPolarHBondContact CB-SG 3.39Å; C87-C161 PolarHBondContact O-SG 3.44Å; C87-C161 VanDerWaalsContact O-SG 3.4Å; C87-C161 VanDerWaalsContact SG-CA 3.56Å; C87-C161 WeakPolarHBondContact SG-CB 3.28Å; C87-C161 CovalentContact SG-SG 2.04Å; C87-C161 PolarHBondContact SG-SG 3.27Å; F91-C161 HydrophobicContact CD2-CB 4.04Å; F91-C161 HydrophobicContact CE2-CB 4.35Å; F91-C161 HydrophobicContact CG-CB 4.21Å; F91-C161 VanDerWaalsContact CG-SG 3.5Å; F91-C161 WeakPolarHBondContact CZ-O 3.41Å
162V90.1Very high86.3Confident49 Ų4973 Ų7330%0.29738%0.375SS..EExtended strand (participates in β ladder)trans-121.1154.5-178.1-61.10000110.7R154 R155 T157 Q160R154-V162 WeakPolarHBondContact CA-O 3.27Å; R155-V162 PolarHBondContact N-O 2.85Å; R155-V162 PolarHBondContact O-N 3.33Å; T157-V162 WeakPolarHBondContact OG1-CG2 3.46Å; Q160-V162 HydrophobicContact CB-CG1 4.32Å
163M88.2Confident86.1Confident53 Ų5376.4 Ų76.426%0.26138%0.381SS..EExtended strand (participates in β ladder)trans-76.9124.8167.6-62.5-63.4-61.200108.2F91 L153 R154 F165F91-M163 HydrophobicContact CD1-SD 4.27Å; F91-M163 HydrophobicContact CE1-CG 4.11Å; F91-M163 HydrophobicContact CE1-SD 3.77Å; L153-M163 HydrophobicContact CB-CE 3.77Å; L153-M163 HydrophobicContact CD1-CE 4.28Å; L153-M163 CarbonylContact O-C 3.55Å; L153-M163 WeakPolarHBondContact O-CA 3.42Å; R154-M163 HydrophobicContact CG-SD 4.35Å; M163-F165 HydrophobicContact CB-CE2 3.82Å; M163-F165 HydrophobicContact CB-CZ 3.93Å; M163-F165 HydrophobicContact CE-CE1 4.1Å; M163-F165 HydrophobicContact CE-CZ 3.98Å
164D87.3Confident86.1Confident32 Ų3279.4 Ų79.417%0.17140%0.4CS..  trans-123.8116.3173.7-167.4-10.4000109.9L153 R155 S166L153-D164 CarbonylContact C-O 3.6Å; L153-D164 PolarHBondContact O-N 3.13Å; R155-D164 HydrophobicContact CB-CB 4.14Å; R155-D164 WeakPolarHBondContact CD-OD2 3.3Å; R155-D164 HydrophobicContact CG-CB 3.8Å; R155-D164 IonicContact CZ-OD2 2.91Å; R155-D164 IonicContact NE-OD2 3.08Å; R155-D164 PolarHBondContact NE-OD2 2.84Å; R155-D164 VanDerWaalsContact NE-OD2 3.08Å; R155-D164 IonicContact NH1-OD2 2.65Å; R155-D164 PolarHBondContact NH1-OD2 2.78Å; R155-D164 IonicContact NH2-OD2 3.73Å; D164-S166 VanDerWaalsContact OD1-CB 3.31Å; D164-S166 WeakPolarHBondContact OD1-CB 3.32Å; D164-S166 PolarHBondContact OD1-N 2.95Å; D164-S166 PolarHBondContact OD1-OG 3.28Å; D164-S166 PolarHBondContact OD2-OG 3.42Å
165F84.4Confident86.1Confident80 Ų8080 Ų8035%0.35140%0.403SS..  trans-98.11.2-179.2-56.4-79.7000112.7L153 M163 T172 L176L153-F165 HydrophobicContact CD1-CE1 4.39Å; L153-F165 HydrophobicContact CD2-CD1 3.59Å; L153-F165 HydrophobicContact CD2-CE1 4.05Å; M163-F165 HydrophobicContact CB-CE2 3.82Å; M163-F165 HydrophobicContact CB-CZ 3.93Å; M163-F165 HydrophobicContact CE-CE1 4.1Å; M163-F165 HydrophobicContact CE-CZ 3.98Å; F165-T172 HydrophobicContact CB-CG2 3.56Å; F165-T172 HydrophobicContact CG-CG2 4.48Å; F165-T172 PolarHBondContact O-OG1 2.95Å; F165-L176 HydrophobicContact CD1-CD1 4.27Å; F165-L176 HydrophobicContact CD1-CD2 3.79Å; F165-L176 HydrophobicContact CD1-CG 4.38Å; F165-L176 HydrophobicContact CE1-CD2 3.87Å
166S80.4Confident86Confident61 Ų6178.4 Ų78.443%0.42740%0.401SS..  trans-89112.7-176.469.40000110.9R155 D164R155-S166 PolarHBondContact NH2-O 2.6Å; D164-S166 VanDerWaalsContact OD1-CB 3.31Å; D164-S166 WeakPolarHBondContact OD1-CB 3.32Å; D164-S166 PolarHBondContact OD1-N 2.95Å; D164-S166 PolarHBondContact OD1-OG 3.28Å; D164-S166 PolarHBondContact OD2-OG 3.42Å
167F78.7Confident86Confident23 Ų2379.1 Ų79.110%0.10141%0.407CS..BIsolated β-bridgetrans-121.9128169.8-65.6-80.5000109.1L152 L153 W169 I170 F175L152-F167 HydrophobicContact CB-CZ 4.18Å; L152-F167 VanDerWaalsContact O-CZ 3.3Å; L152-F167 WeakPolarHBondContact O-CZ 3.45Å; L153-F167 HydrophobicContact CD2-CE2 4.19Å; F167-W169 HydrophobicContact CB-CD2 4.4Å; F167-W169 HydrophobicContact CB-CZ2 4.3Å; F167-W169 AromaticContact CD1-CH2 3.68Å; F167-W169 HydrophobicContact CD1-CH2 3.68Å; F167-W169 AromaticContact CD1-CZ2 3.44Å; F167-W169 HydrophobicContact CD1-CZ2 3.44Å; F167-W169 VanDerWaalsContact CD1-CZ2 3.44Å; F167-W169 HydrophobicContact CE1-CH2 4.39Å; F167-W169 HydrophobicContact CE1-CZ2 4.15Å; F167-W169 HydrophobicContact CG-CZ2 4.2Å; F167-W169 PolarHBondContact O-N 2.65Å; F167-I170 HydrophobicContact CB-CG2 3.48Å; F167-I170 VanDerWaalsContact CB-CG2 3.48Å; F167-I170 HydrophobicContact CD2-CG2 4.16Å; F167-I170 HydrophobicContact CG-CG2 4.04Å; F167-I170 PolarHBondContact O-N 3.22Å; F167-F175 HydrophobicContact CD2-CD1 4.04Å; F167-F175 HydrophobicContact CD2-CE1 4.22Å; F167-F175 AromaticContact CE2-CD1 3.63Å; F167-F175 HydrophobicContact CE2-CD1 3.63Å; F167-F175 AromaticContact CE2-CE1 3.42Å; F167-F175 HydrophobicContact CE2-CE1 3.42Å; F167-F175 VanDerWaalsContact CE2-CE1 3.42Å; F167-F175 HydrophobicContact CE2-CZ 4.18Å; F167-F175 AromaticContact CZ-CE1 3.99Å; F167-F175 HydrophobicContact CZ-CE1 3.99Å; F167-F175 HydrophobicContact CZ-CZ 4.42Å
168P79.2Confident86.3Confident119 Ų11981 Ų8177%0.77341%0.408SS*.THydrogen-bonded Turntrans-66.2-21.3-176.320-26.7000113.3
169W83.4Confident86.6Confident197 Ų19775.1 Ų75.175%0.74638%0.376SS*.THydrogen-bonded Turntrans-100.5-6.9-177.361.683.4000114.8F167F167-W169 HydrophobicContact CB-CD2 4.4Å; F167-W169 HydrophobicContact CB-CZ2 4.3Å; F167-W169 AromaticContact CD1-CH2 3.68Å; F167-W169 HydrophobicContact CD1-CH2 3.68Å; F167-W169 AromaticContact CD1-CZ2 3.44Å; F167-W169 HydrophobicContact CD1-CZ2 3.44Å; F167-W169 VanDerWaalsContact CD1-CZ2 3.44Å; F167-W169 HydrophobicContact CE1-CH2 4.39Å; F167-W169 HydrophobicContact CE1-CZ2 4.15Å; F167-W169 HydrophobicContact CG-CZ2 4.2Å; F167-W169 PolarHBondContact O-N 2.65Å
170I86.6Confident87Confident52 Ų5273 Ų7327%0.26736%0.36SS..BIsolated β-bridgetrans-143135.5-178.2-171.8162.7000111.4F167 T172 V174 F175F167-I170 HydrophobicContact CB-CG2 3.48Å; F167-I170 VanDerWaalsContact CB-CG2 3.48Å; F167-I170 HydrophobicContact CD2-CG2 4.16Å; F167-I170 HydrophobicContact CG-CG2 4.04Å; F167-I170 PolarHBondContact O-N 3.22Å; I170-T172 PolarHBondContact O-N 3.31Å; I170-V174 HydrophobicContact CD1-CG1 4.46Å; I170-F175 HydrophobicContact CD1-CB 4.03Å; I170-F175 HydrophobicContact CD1-CD2 4.19Å; I170-F175 HydrophobicContact CG1-CB 4.19Å; I170-F175 HydrophobicContact CG2-CB 4.25Å; I170-F175 HydrophobicContact CG2-CG 4.49Å
171Q87.7Confident87.4Confident149 Ų14973.7 Ų73.770%0.69636%0.359SS*.  trans-62.9130.1174.2-68.4-178.4-6.800110.1R173 V174 F175Q171-R173 VanDerWaalsContact C-N 3.3Å; Q171-R173 PolarHBondContact O-N 3.41Å; Q171-V174 HydrophobicContact CB-CB 4.34Å; Q171-V174 HydrophobicContact CB-CG2 3.98Å; Q171-V174 PolarHBondContact O-N 2.89Å; Q171-V174 VanDerWaalsContact O-N 3.11Å; Q171-F175 PolarHBondContact O-N 3.26Å; Q171-F175 VanDerWaalsContact O-N 3.1Å
172T86.4Confident87.6Confident58 Ų5873.4 Ų73.436%0.35636%0.357SS..Hα-helixtrans-51.5-45.1-177.4-60.90000113.4F165 I170 F175 L176F165-T172 HydrophobicContact CB-CG2 3.56Å; F165-T172 HydrophobicContact CG-CG2 4.48Å; F165-T172 PolarHBondContact O-OG1 2.95Å; I170-T172 PolarHBondContact O-N 3.31Å; T172-F175 PolarHBondContact O-N 3.01Å; T172-L176 HydrophobicContact CG2-CD1 3.96Å; T172-L176 HydrophobicContact CG2-CG 4.44Å; T172-L176 WeakPolarHBondContact O-CG 2.88Å; T172-L176 PolarHBondContact O-N 2.88Å
173R86.6Confident87.8Confident163 Ų16372.3 Ų72.362%0.61535%0.348SS*.Hα-helixtrans-61.1-47.3179.7-170.8177.5-171160.114.4111.8Q171 F175 L176 D177 E262Q171-R173 VanDerWaalsContact C-N 3.3Å; Q171-R173 PolarHBondContact O-N 3.41Å; R173-F175 VanDerWaalsContact C-N 3.29Å; R173-F175 PolarHBondContact O-N 2.98Å; R173-L176 PolarHBondContact O-N 2.91Å; R173-D177 WeakPolarHBondContact O-CB 3.35Å; R173-D177 PolarHBondContact O-N 3.45Å; R173-E262 IonicContact NH2-OE1 3.11Å; R173-E262 PolarHBondContact NH2-OE1 2.89Å; R173-E262 VanDerWaalsContact NH2-OE1 3.11Å
174V89.3Confident88.1Confident75 Ų7570.2 Ų70.246%0.45534%0.338SS..Hα-helixtrans-60.6-39.9179.2179.10000111.4I170 Q171 Y178I170-V174 HydrophobicContact CD1-CG1 4.46Å; Q171-V174 HydrophobicContact CB-CB 4.34Å; Q171-V174 HydrophobicContact CB-CG2 3.98Å; Q171-V174 PolarHBondContact O-N 2.89Å; Q171-V174 VanDerWaalsContact O-N 3.11Å; V174-Y178 WeakPolarHBondContact O-CB 3.45Å; V174-Y178 PolarHBondContact O-N 3.01Å
175F89.6Confident88.6Confident23 Ų2371.8 Ų71.810%0.10135%0.348CS..Hα-helixtrans-68.5-42.8177.9-175-119000112.6P149 L153 F167 I170 Q171 T172 R173 Y178 I179P149-F175 HydrophobicContact CB-CE2 4.29Å; P149-F175 HydrophobicContact CB-CZ 4.01Å; L153-F175 HydrophobicContact CD2-CD1 3.85Å; L153-F175 HydrophobicContact CD2-CE1 3.49Å; L153-F175 VanDerWaalsContact CD2-CE1 3.49Å; L153-F175 HydrophobicContact CG-CE1 3.88Å; F167-F175 HydrophobicContact CD2-CD1 4.04Å; F167-F175 HydrophobicContact CD2-CE1 4.22Å; F167-F175 AromaticContact CE2-CD1 3.63Å; F167-F175 HydrophobicContact CE2-CD1 3.63Å; F167-F175 AromaticContact CE2-CE1 3.42Å; F167-F175 HydrophobicContact CE2-CE1 3.42Å; F167-F175 VanDerWaalsContact CE2-CE1 3.42Å; F167-F175 HydrophobicContact CE2-CZ 4.18Å; F167-F175 AromaticContact CZ-CE1 3.99Å; F167-F175 HydrophobicContact CZ-CE1 3.99Å; F167-F175 HydrophobicContact CZ-CZ 4.42Å; I170-F175 HydrophobicContact CD1-CB 4.03Å; I170-F175 HydrophobicContact CD1-CD2 4.19Å; I170-F175 HydrophobicContact CG1-CB 4.19Å; I170-F175 HydrophobicContact CG2-CB 4.25Å; I170-F175 HydrophobicContact CG2-CG 4.49Å; Q171-F175 PolarHBondContact O-N 3.26Å; Q171-F175 VanDerWaalsContact O-N 3.1Å; T172-F175 PolarHBondContact O-N 3.01Å; R173-F175 VanDerWaalsContact C-N 3.29Å; R173-F175 PolarHBondContact O-N 2.98Å; F175-Y178 WeakPolarHBondContact O-CB 3.13Å; F175-Y178 PolarHBondContact O-N 3.26Å; F175-I179 HydrophobicContact CD1-CD1 3.94Å; F175-I179 HydrophobicContact CE1-CD1 3.49Å; F175-I179 VanDerWaalsContact CE1-CD1 3.49Å; F175-I179 HydrophobicContact CE1-CG1 4.47Å; F175-I179 HydrophobicContact CE2-CD1 4.23Å; F175-I179 HydrophobicContact CE2-CG1 4.43Å; F175-I179 HydrophobicContact CZ-CD1 3.65Å; F175-I179 HydrophobicContact CZ-CG1 4.31Å; F175-I179 WeakPolarHBondContact O-CG1 3.38Å; F175-I179 PolarHBondContact O-N 2.99Å
176L88.2Confident89.2Confident60 Ų6069.8 Ų69.831%0.31434%0.341SS..Hα-helixtrans-63.8-45.5176.1-72.6175.5000111.8L153 F165 T172 R173 Y178 I179 V180L153-L176 HydrophobicContact CD1-CD2 4.47Å; F165-L176 HydrophobicContact CD1-CD1 4.27Å; F165-L176 HydrophobicContact CD1-CD2 3.79Å; F165-L176 HydrophobicContact CD1-CG 4.38Å; F165-L176 HydrophobicContact CE1-CD2 3.87Å; T172-L176 HydrophobicContact CG2-CD1 3.96Å; T172-L176 HydrophobicContact CG2-CG 4.44Å; T172-L176 WeakPolarHBondContact O-CG 2.88Å; T172-L176 PolarHBondContact O-N 2.88Å; R173-L176 PolarHBondContact O-N 2.91Å; L176-Y178 VanDerWaalsContact C-N 3.3Å; L176-Y178 PolarHBondContact O-N 3.48Å; L176-I179 PolarHBondContact O-N 3.2Å; L176-V180 WeakPolarHBondContact O-CG2 3.34Å; L176-V180 PolarHBondContact O-N 3.08Å
177D90.2Very high89.9Confident50 Ų5067 Ų6727%0.26732%0.321SS..Hα-helixtrans-58.1-45.3175.4-68.2-14.8000110.1R173 I179 V180 Y181R173-D177 WeakPolarHBondContact O-CB 3.35Å; R173-D177 PolarHBondContact O-N 3.45Å; D177-I179 PolarHBondContact O-N 3.06Å; D177-V180 PolarHBondContact O-N 3.41Å; D177-Y181 HydrophobicContact CB-CD2 4.04Å; D177-Y181 HydrophobicContact CB-CE2 4.07Å; D177-Y181 VanDerWaalsContact O-CB 3.31Å; D177-Y181 WeakPolarHBondContact O-CB 3.28Å; D177-Y181 WeakPolarHBondContact O-CD2 3.32Å; D177-Y181 PolarHBondContact O-N 3.01Å
178Y91.9Very high90.8Very high100 Ų10067.7 Ų67.739%0.39232%0.324SS..Hα-helixtrans-57-47.4175.4168-98.1000112.5P149 V174 F175 L176 S182P149-Y178 HydrophobicContact CG-CE1 4.07Å; V174-Y178 WeakPolarHBondContact O-CB 3.45Å; V174-Y178 PolarHBondContact O-N 3.01Å; F175-Y178 WeakPolarHBondContact O-CB 3.13Å; F175-Y178 PolarHBondContact O-N 3.26Å; L176-Y178 VanDerWaalsContact C-N 3.3Å; L176-Y178 PolarHBondContact O-N 3.48Å; Y178-S182 WeakPolarHBondContact CD2-OG 3.31Å; Y178-S182 WeakPolarHBondContact CE2-OG 3.44Å; Y178-S182 WeakPolarHBondContact O-CB 3.44Å; Y178-S182 PolarHBondContact O-N 3.1Å; Y178-S182 PolarHBondContact O-OG 2.81Å
179I91.1Very high91.6Very high27 Ų2767.2 Ų67.214%0.13831%0.309CS..Hα-helixtrans-60.9-50.6179.9-69.7174.1000110.2P149 L153 F175 L176 D177 W183P149-I179 HydrophobicContact CB-CD1 3.84Å; P149-I179 HydrophobicContact CB-CG1 3.69Å; L153-I179 HydrophobicContact CD1-CD1 3.64Å; L153-I179 HydrophobicContact CD2-CD1 4.5Å; L153-I179 HydrophobicContact CG-CD1 4.07Å; F175-I179 HydrophobicContact CD1-CD1 3.94Å; F175-I179 HydrophobicContact CE1-CD1 3.49Å; F175-I179 VanDerWaalsContact CE1-CD1 3.49Å; F175-I179 HydrophobicContact CE1-CG1 4.47Å; F175-I179 HydrophobicContact CE2-CD1 4.23Å; F175-I179 HydrophobicContact CE2-CG1 4.43Å; F175-I179 HydrophobicContact CZ-CD1 3.65Å; F175-I179 HydrophobicContact CZ-CG1 4.31Å; F175-I179 WeakPolarHBondContact O-CG1 3.38Å; F175-I179 PolarHBondContact O-N 2.99Å; L176-I179 PolarHBondContact O-N 3.2Å; D177-I179 PolarHBondContact O-N 3.06Å; I179-W183 VanDerWaalsContact O-CB 3.32Å; I179-W183 WeakPolarHBondContact O-CB 3.32Å; I179-W183 PolarHBondContact O-N 2.82Å
180V92Very high92.2Very high26 Ų2660.2 Ų60.216%0.15829%0.288CS..Hα-helixtrans-66.8-47.1-175.4175.50000110.9L176 D177 W183 I184 Q256 I260L176-V180 WeakPolarHBondContact O-CG2 3.34Å; L176-V180 PolarHBondContact O-N 3.08Å; D177-V180 PolarHBondContact O-N 3.41Å; V180-W183 PolarHBondContact O-N 2.88Å; V180-I184 HydrophobicContact CG1-CD1 3.68Å; V180-I184 HydrophobicContact CG1-CG1 4.46Å; V180-I184 WeakPolarHBondContact O-CB 3.06Å; V180-I184 VanDerWaalsContact O-CG1 3.3Å; V180-I184 WeakPolarHBondContact O-CG1 3.15Å; V180-I184 PolarHBondContact O-N 3.49Å; V180-Q256 HydrophobicContact CG1-CB 4.29Å; V180-I260 HydrophobicContact CB-CD1 4.08Å; V180-I260 HydrophobicContact CG1-CB 4.18Å; V180-I260 HydrophobicContact CG1-CD1 3.9Å; V180-I260 HydrophobicContact CG1-CG2 4.48Å
181Y94.6Very high92.8Very high127 Ų12757.8 Ų57.850%0.49828%0.276SS..Hα-helixtrans-67.1-40.9178-74.3-58000112.6D177 W183 I184 V185 I260D177-Y181 HydrophobicContact CB-CD2 4.04Å; D177-Y181 HydrophobicContact CB-CE2 4.07Å; D177-Y181 VanDerWaalsContact O-CB 3.31Å; D177-Y181 WeakPolarHBondContact O-CB 3.28Å; D177-Y181 WeakPolarHBondContact O-CD2 3.32Å; D177-Y181 PolarHBondContact O-N 3.01Å; Y181-W183 VanDerWaalsContact C-N 3.27Å; Y181-W183 PolarHBondContact O-N 3.32Å; Y181-I184 PolarHBondContact O-N 3.47Å; Y181-V185 WeakPolarHBondContact O-CB 3.33Å; Y181-V185 VanDerWaalsContact O-CG2 3.26Å; Y181-V185 WeakPolarHBondContact O-CG2 3.39Å; Y181-V185 PolarHBondContact O-N 3.4Å; Y181-I260 HydrophobicContact CD1-CD1 4.41Å; Y181-I260 HydrophobicContact CD2-CD1 3.88Å; Y181-I260 HydrophobicContact CE1-CD1 3.98Å; Y181-I260 HydrophobicContact CE2-CD1 3.38Å; Y181-I260 HydrophobicContact CE2-CG1 4.49Å; Y181-I260 HydrophobicContact CG-CD1 4.36Å; Y181-I260 VanDerWaalsContact CZ-CD1 3.43Å
182S94.7Very high93.2Very high17 Ų1752.2 Ų52.212%0.11925%0.252CS..Hα-helixtrans-61.2-41.4176.4-62.40000110.7L146 Y178 L186L146-S182 VanDerWaalsContact CD2-O 3.29Å; L146-S182 WeakPolarHBondContact CD2-O 3.48Å; Y178-S182 WeakPolarHBondContact CD2-OG 3.31Å; Y178-S182 WeakPolarHBondContact CE2-OG 3.44Å; Y178-S182 WeakPolarHBondContact O-CB 3.44Å; Y178-S182 PolarHBondContact O-N 3.1Å; Y178-S182 PolarHBondContact O-OG 2.81Å; S182-L186 VanDerWaalsContact O-CB 3.25Å; S182-L186 WeakPolarHBondContact O-CB 3.45Å; S182-L186 PolarHBondContact O-N 3.45Å
183W93.4Very high93.7Very high27 Ų2754.7 Ų54.710%0.10226%0.263CS..Hα-helixtrans-63-55.3174.8-166.793.9000111.3W97 I179 V180 Y181 V185 L186 E187 E252 C253 Q256W97-W183 HydrophobicContact CZ3-CZ2 4.07Å; I179-W183 VanDerWaalsContact O-CB 3.32Å; I179-W183 WeakPolarHBondContact O-CB 3.32Å; I179-W183 PolarHBondContact O-N 2.82Å; V180-W183 PolarHBondContact O-N 2.88Å; Y181-W183 VanDerWaalsContact C-N 3.27Å; Y181-W183 PolarHBondContact O-N 3.32Å; W183-V185 PolarHBondContact O-N 3.48Å; W183-L186 PolarHBondContact O-N 3.01Å; W183-E187 HydrophobicContact CD2-CB 4.06Å; W183-E187 HydrophobicContact CD2-CG 4.27Å; W183-E187 HydrophobicContact CG-CB 4.13Å; W183-E187 HydrophobicContact CZ2-CB 4.48Å; W183-E187 HydrophobicContact CZ2-CG 3.85Å; W183-E187 WeakPolarHBondContact O-CA 3.27Å; W183-E187 WeakPolarHBondContact O-CB 3.43Å; W183-E187 PolarHBondContact O-N 3.49Å; W183-E252 HydrophobicContact CH2-CB 3.84Å; W183-E252 HydrophobicContact CH2-CG 3.29Å; W183-E252 HydrophobicContact CZ2-CG 3.8Å; W183-E252 HydrophobicContact CZ3-CG 3.95Å; W183-C253 HydrophobicContact CZ3-CB 4.27Å; W183-Q256 HydrophobicContact CE3-CG 4.29Å; W183-Q256 HydrophobicContact CZ3-CG 4.31Å
184I95.1Very high94.2Very high8 Ų848.9 Ų48.94%0.04125%0.245CC..Iπ-helixtrans-53.7-43.4179.3-71.9165.6000111.6V180 Y181 Y188 F189 Q256 I257V180-I184 HydrophobicContact CG1-CD1 3.68Å; V180-I184 HydrophobicContact CG1-CG1 4.46Å; V180-I184 WeakPolarHBondContact O-CB 3.06Å; V180-I184 VanDerWaalsContact O-CG1 3.3Å; V180-I184 WeakPolarHBondContact O-CG1 3.15Å; V180-I184 PolarHBondContact O-N 3.49Å; Y181-I184 PolarHBondContact O-N 3.47Å; I184-Y188 WeakPolarHBondContact O-CB 3.44Å; I184-Y188 PolarHBondContact O-N 2.89Å; I184-F189 HydrophobicContact CG2-CD2 3.61Å; I184-F189 HydrophobicContact CG2-CE2 3.49Å; I184-F189 VanDerWaalsContact CG2-CE2 3.49Å; I184-F189 WeakPolarHBondContact O-CD2 3.32Å; I184-F189 PolarHBondContact O-N 2.88Å; I184-Q256 HydrophobicContact CD1-CB 4.06Å; I184-Q256 HydrophobicContact CG1-CB 4.13Å; I184-I257 HydrophobicContact CD1-CG1 3.76Å; I184-I257 HydrophobicContact CG1-CG1 4.47Å
185V96.6Very high94.5Very high65 Ų6545.5 Ų45.539%0.39422%0.224SC..Iπ-helixtrans-77-54.1-176.9175.10000111.7Y181 W183 F189 V190Y181-V185 WeakPolarHBondContact O-CB 3.33Å; Y181-V185 VanDerWaalsContact O-CG2 3.26Å; Y181-V185 WeakPolarHBondContact O-CG2 3.39Å; Y181-V185 PolarHBondContact O-N 3.4Å; W183-V185 PolarHBondContact O-N 3.48Å; V185-F189 PolarHBondContact O-N 2.92Å; V185-V190 HydrophobicContact CG1-CG2 3.91Å; V185-V190 WeakPolarHBondContact O-CB 3.46Å; V185-V190 WeakPolarHBondContact O-CG2 3.3Å; V185-V190 PolarHBondContact O-N 2.92Å
186L97Very high94.7Very high39 Ų3949.8 Ų49.820%0.20425%0.248CC..Iπ-helixtrans-90.4-20.6-168.7-60.5173.7000114Q105 M142 I145 L146 S182 W183 V190 P191Q105-L186 PolarHBondContact NE2-O 2.92Å; M142-L186 HydrophobicContact CE-CD2 4.48Å; M142-L186 HydrophobicContact SD-CB 4.4Å; I145-L186 HydrophobicContact CG2-CD1 3.48Å; I145-L186 VanDerWaalsContact CG2-CD1 3.48Å; L146-L186 HydrophobicContact CD1-CB 4.05Å; L146-L186 HydrophobicContact CD2-CB 3.75Å; L146-L186 HydrophobicContact CD2-CD1 4.34Å; L146-L186 HydrophobicContact CG-CB 4.27Å; S182-L186 VanDerWaalsContact O-CB 3.25Å; S182-L186 WeakPolarHBondContact O-CB 3.45Å; S182-L186 PolarHBondContact O-N 3.45Å; W183-L186 PolarHBondContact O-N 3.01Å; L186-V190 HydrophobicContact CD2-CG2 4.36Å; L186-P191 WeakPolarHBondContact O-CD 3.43Å; L186-P191 WeakPolarHBondContact O-CG 3.18Å
187E95.9Very high95.1Very high1 Ų150.4 Ų50.41%0.00525%0.254CS..Iπ-helixtrans-95.1-25.9175.4-17161.2-172.200112.3I101 V104 Q105 L146 W183 P191I101-E187 WeakPolarHBondContact CA-OE1 3.39Å; V104-E187 WeakPolarHBondContact CB-OE1 3.42Å; V104-E187 WeakPolarHBondContact CG1-O 3.46Å; V104-E187 WeakPolarHBondContact CG1-OE1 3.29Å; V104-E187 WeakPolarHBondContact CG2-OE1 3.43Å; Q105-E187 PolarHBondContact NE2-OE2 2.74Å; L146-E187 HydrophobicContact CD1-CB 4.39Å; W183-E187 HydrophobicContact CD2-CB 4.06Å; W183-E187 HydrophobicContact CD2-CG 4.27Å; W183-E187 HydrophobicContact CG-CB 4.13Å; W183-E187 HydrophobicContact CZ2-CB 4.48Å; W183-E187 HydrophobicContact CZ2-CG 3.85Å; W183-E187 WeakPolarHBondContact O-CA 3.27Å; W183-E187 WeakPolarHBondContact O-CB 3.43Å; W183-E187 PolarHBondContact O-N 3.49Å; E187-P191 WeakPolarHBondContact O-CG 3.4Å
188Y96.4Very high95.3Very high39 Ų3948.2 Ų48.215%0.15324%0.243CC..Iπ-helixtrans-116.8-71.6-178.9-174.8-103.4000113.9I184 V190 P191 V192 A246 H249 S250 C253I184-Y188 WeakPolarHBondContact O-CB 3.44Å; I184-Y188 PolarHBondContact O-N 2.89Å; Y188-V190 PolarHBondContact O-N 3.49Å; Y188-P191 WeakPolarHBondContact O-CD 3.32Å; Y188-V192 HydrophobicContact CD2-CG2 4.15Å; Y188-V192 HydrophobicContact CE2-CG2 4.02Å; Y188-V192 WeakPolarHBondContact O-CB 3.13Å; Y188-V192 WeakPolarHBondContact O-CG2 3.48Å; Y188-V192 PolarHBondContact O-N 2.82Å; Y188-A246 WeakPolarHBondContact CE2-O 3.49Å; Y188-A246 PolarHBondContact OH-O 2.92Å; Y188-H249 HydrophobicContact CD2-CB 3.87Å; Y188-H249 HydrophobicContact CE2-CB 4.15Å; Y188-S250 WeakPolarHBondContact OH-CB 3.06Å; Y188-C253 HydrophobicContact CD1-CB 3.8Å; Y188-C253 WeakPolarHBondContact CD1-SG 3.39Å; Y188-C253 HydrophobicContact CD2-CB 4.13Å; Y188-C253 HydrophobicContact CE1-CB 4.13Å; Y188-C253 HydrophobicContact CE2-CB 4.44Å; Y188-C253 HydrophobicContact CG-CB 3.78Å
189F96.8Very high95.4Very high108 Ų10844 Ų4447%0.47423%0.227SC..Iπ-helixtrans-62.1-48.2-169.3-79.5-69.9000113.9I184 V185 V192 L193I184-F189 HydrophobicContact CG2-CD2 3.61Å; I184-F189 HydrophobicContact CG2-CE2 3.49Å; I184-F189 VanDerWaalsContact CG2-CE2 3.49Å; I184-F189 WeakPolarHBondContact O-CD2 3.32Å; I184-F189 PolarHBondContact O-N 2.88Å; V185-F189 PolarHBondContact O-N 2.92Å; F189-V192 PolarHBondContact O-N 2.91Å; F189-L193 VanDerWaalsContact O-CB 3.26Å; F189-L193 WeakPolarHBondContact O-CB 3.4Å; F189-L193 PolarHBondContact O-N 3.31Å
190V96.8Very high95.5Very high51 Ų5145.4 Ų45.431%0.30924%0.242SC..Hα-helixtrans-64.5-50.1179.6169.80000110.7V185 L186 Y188 V192 L193 V194V185-V190 HydrophobicContact CG1-CG2 3.91Å; V185-V190 WeakPolarHBondContact O-CB 3.46Å; V185-V190 WeakPolarHBondContact O-CG2 3.3Å; V185-V190 PolarHBondContact O-N 2.92Å; L186-V190 HydrophobicContact CD2-CG2 4.36Å; Y188-V190 PolarHBondContact O-N 3.49Å; V190-V192 PolarHBondContact O-N 3.49Å; V190-L193 PolarHBondContact O-N 2.86Å; V190-V194 HydrophobicContact CG1-CG2 4.16Å; V190-V194 WeakPolarHBondContact O-CB 3.14Å; V190-V194 VanDerWaalsContact O-CG2 3.27Å; V190-V194 WeakPolarHBondContact O-CG2 3.48Å; V190-V194 PolarHBondContact O-N 3.43Å
191P97.6Very high95.6Very high0 Ų050.5 Ų50.50%026%0.258CS..Hα-helixtrans-53.6-49.7173.3-33.640.3000113.5V104 V108 L186 E187 Y188 L193 V194 M195V104-P191 HydrophobicContact CG1-CB 4.06Å; V104-P191 HydrophobicContact CG1-CG 4.03Å; V108-P191 HydrophobicContact CG2-CB 3.54Å; V108-P191 HydrophobicContact CG2-CG 3.97Å; L186-P191 WeakPolarHBondContact O-CD 3.43Å; L186-P191 WeakPolarHBondContact O-CG 3.18Å; E187-P191 WeakPolarHBondContact O-CG 3.4Å; Y188-P191 WeakPolarHBondContact O-CD 3.32Å; P191-L193 PolarHBondContact O-N 2.6Å; P191-V194 PolarHBondContact O-N 2.87Å; P191-M195 HydrophobicContact CB-CE 4.23Å; P191-M195 WeakPolarHBondContact O-CB 3.45Å; P191-M195 WeakPolarHBondContact O-CE 3.21Å; P191-M195 WeakPolarHBondContact O-CG 3.43Å; P191-M195 PolarHBondContact O-N 2.97Å
192V96.9Very high95.5Very high33 Ų3344.5 Ų44.520%0.224%0.235CC..Hα-helixtrans-60-46.1179.9170.70000111.1Y188 F189 V190 M195 L196 A246Y188-V192 HydrophobicContact CD2-CG2 4.15Å; Y188-V192 HydrophobicContact CE2-CG2 4.02Å; Y188-V192 WeakPolarHBondContact O-CB 3.13Å; Y188-V192 WeakPolarHBondContact O-CG2 3.48Å; Y188-V192 PolarHBondContact O-N 2.82Å; F189-V192 PolarHBondContact O-N 2.91Å; V190-V192 PolarHBondContact O-N 3.49Å; V192-M195 PolarHBondContact O-N 3.3Å; V192-L196 VanDerWaalsContact O-CB 3.24Å; V192-L196 WeakPolarHBondContact O-CB 3.36Å; V192-L196 PolarHBondContact O-N 3.34Å; V192-A246 HydrophobicContact CG1-CB 4.26Å; V192-A246 HydrophobicContact CG2-CB 3.71Å
193L96.8Very high95.2Very high110 Ų11047 Ų4758%0.57625%0.246SC*.Hα-helixtrans-62.7-49.1178.9-178.465.4000111.4F189 V190 P191 M195 L196 V197F189-L193 VanDerWaalsContact O-CB 3.26Å; F189-L193 WeakPolarHBondContact O-CB 3.4Å; F189-L193 PolarHBondContact O-N 3.31Å; V190-L193 PolarHBondContact O-N 2.86Å; P191-L193 PolarHBondContact O-N 2.6Å; L193-M195 PolarHBondContact O-N 3.1Å; L193-L196 PolarHBondContact O-N 2.92Å; L193-V197 HydrophobicContact CD1-CG2 3.99Å; L193-V197 HydrophobicContact CG-CG2 4.39Å; L193-V197 WeakPolarHBondContact O-CB 3.24Å; L193-V197 VanDerWaalsContact O-CG2 3.3Å; L193-V197 WeakPolarHBondContact O-CG2 3.37Å; L193-V197 PolarHBondContact O-N 3.26Å
194V96.8Very high95.1Very high41 Ų4152.1 Ų52.125%0.24827%0.269CS..Hα-helixtrans-61.6-45.6-179.9173.20000110.5V108 L112 V190 P191 S198V108-V194 HydrophobicContact CG1-CB 4.21Å; V108-V194 HydrophobicContact CG1-CG1 3.71Å; L112-V194 HydrophobicContact CD1-CG1 4.35Å; L112-V194 HydrophobicContact CD2-CG1 3.73Å; L112-V194 HydrophobicContact CG-CG1 3.95Å; V190-V194 HydrophobicContact CG1-CG2 4.16Å; V190-V194 WeakPolarHBondContact O-CB 3.14Å; V190-V194 VanDerWaalsContact O-CG2 3.27Å; V190-V194 WeakPolarHBondContact O-CG2 3.48Å; V190-V194 PolarHBondContact O-N 3.43Å; P191-V194 PolarHBondContact O-N 2.87Å; V194-S198 WeakPolarHBondContact O-CB 2.93Å; V194-S198 PolarHBondContact O-N 3.3Å; V194-S198 PolarHBondContact O-OG 2.95Å
195M95.9Very high94.8Very high3 Ų353.8 Ų53.82%0.01528%0.278CS..Hα-helixtrans-62.4-46.1177-68.9-173.7-64.600111.5L107 P191 V192 L193 S198 H199 S242L107-M195 HydrophobicContact CB-SD 4.42Å; L107-M195 HydrophobicContact CD2-SD 3.75Å; L107-M195 HydrophobicContact CG-SD 3.85Å; P191-M195 HydrophobicContact CB-CE 4.23Å; P191-M195 WeakPolarHBondContact O-CB 3.45Å; P191-M195 WeakPolarHBondContact O-CE 3.21Å; P191-M195 WeakPolarHBondContact O-CG 3.43Å; P191-M195 PolarHBondContact O-N 2.97Å; V192-M195 PolarHBondContact O-N 3.3Å; L193-M195 PolarHBondContact O-N 3.1Å; M195-S198 WeakPolarHBondContact CA-OG 3.32Å; M195-S198 PolarHBondContact O-N 3.47Å; M195-S198 PolarHBondContact O-OG 2.93Å; M195-H199 WeakPolarHBondContact O-CB 3.28Å; M195-H199 PolarHBondContact O-CD2 3.49Å; M195-H199 PolarHBondContact O-N 2.91Å; M195-S242 WeakPolarHBondContact SD-CB 3.34Å; M195-S242 PolarHBondContact SD-OG 2.88Å
196L95Very high94.3Very high114 Ų11452 Ų5260%0.59727%0.266SS*.Hα-helixtrans-63.5-48.9179.9-174.2146.9000112.1V192 L193 H199 A200V192-L196 VanDerWaalsContact O-CB 3.24Å; V192-L196 WeakPolarHBondContact O-CB 3.36Å; V192-L196 PolarHBondContact O-N 3.34Å; L193-L196 PolarHBondContact O-N 2.92Å; L196-H199 PolarHBondContact O-N 3.43Å; L196-A200 VanDerWaalsContact O-CB 3.23Å; L196-A200 WeakPolarHBondContact O-CB 3.35Å; L196-A200 PolarHBondContact O-N 2.81Å
197V95.7Very high93.8Very high72 Ų7259 Ų5944%0.43629%0.29SS..Hα-helixtrans-63.6-44.2179.21730000110.9L193 A200 W201L193-V197 HydrophobicContact CD1-CG2 3.99Å; L193-V197 HydrophobicContact CG-CG2 4.39Å; L193-V197 WeakPolarHBondContact O-CB 3.24Å; L193-V197 VanDerWaalsContact O-CG2 3.3Å; L193-V197 WeakPolarHBondContact O-CG2 3.37Å; L193-V197 PolarHBondContact O-N 3.26Å; V197-A200 PolarHBondContact O-N 3.43Å; V197-W201 VanDerWaalsContact O-CB 3.27Å; V197-W201 WeakPolarHBondContact O-CB 3.49Å; V197-W201 PolarHBondContact O-N 2.84Å
198S94.6Very high93.3Very high5 Ų566.4 Ų66.44%0.03532%0.322CS..Hα-helixtrans-61.2-46.5179.664.70000112.2S111 V115 V194 M195 W201 V202S111-S198 WeakPolarHBondContact CB-OG 3.37Å; V115-S198 VanDerWaalsContact CG2-CB 3.43Å; V194-S198 WeakPolarHBondContact O-CB 2.93Å; V194-S198 PolarHBondContact O-N 3.3Å; V194-S198 PolarHBondContact O-OG 2.95Å; M195-S198 WeakPolarHBondContact CA-OG 3.32Å; M195-S198 PolarHBondContact O-N 3.47Å; M195-S198 PolarHBondContact O-OG 2.93Å; S198-W201 PolarHBondContact O-N 3.47Å; S198-V202 WeakPolarHBondContact O-CB 3.08Å; S198-V202 VanDerWaalsContact O-CG2 3.26Å; S198-V202 WeakPolarHBondContact O-CG2 3.29Å; S198-V202 PolarHBondContact O-N 2.9Å
199H93.6Very high92.4Very high12 Ų1268.5 Ų68.56%0.05634%0.342CS..Hα-helixtrans-68.9-42.9178.1-68.8-46.2000112.1S111 M195 L196 W201 V202 I203 T238 A239 S242S111-H199 PolarHBondContact OG-NE2 3Å; M195-H199 WeakPolarHBondContact O-CB 3.28Å; M195-H199 PolarHBondContact O-CD2 3.49Å; M195-H199 PolarHBondContact O-N 2.91Å; L196-H199 PolarHBondContact O-N 3.43Å; H199-W201 VanDerWaalsContact C-N 3.3Å; H199-W201 PolarHBondContact O-N 2.74Å; H199-V202 PolarHBondContact O-N 3.25Å; H199-I203 WeakPolarHBondContact O-CB 3.14Å; H199-I203 WeakPolarHBondContact O-CD1 3.38Å; H199-I203 WeakPolarHBondContact O-CG1 3.36Å; H199-I203 PolarHBondContact O-N 3.38Å; H199-T238 PolarHBondContact CE1-OG1 3.36Å; H199-A239 HydrophobicContact CB-CB 4.42Å; H199-S242 PolarHBondContact NE2-OG 3.29Å
200A93.5Very high91.1Very high55 Ų5568.9 Ų68.946%0.45535%0.346SS..Hα-helixtrans-58.4-44.3176.100000111.4L196 V197 F204L196-A200 VanDerWaalsContact O-CB 3.23Å; L196-A200 WeakPolarHBondContact O-CB 3.35Å; L196-A200 PolarHBondContact O-N 2.81Å; V197-A200 PolarHBondContact O-N 3.43Å; A200-F204 WeakPolarHBondContact O-CB 3.33Å; A200-F204 PolarHBondContact O-N 3.12Å
201W94.1Very high89.3Confident133 Ų13370.7 Ų70.750%0.50436%0.36SS..Hα-helixtrans-63.5-50.7176.4-167.5-24.7000111.2V197 S198 H199 I203 F204 I205V197-W201 VanDerWaalsContact O-CB 3.27Å; V197-W201 WeakPolarHBondContact O-CB 3.49Å; V197-W201 PolarHBondContact O-N 2.84Å; S198-W201 PolarHBondContact O-N 3.47Å; H199-W201 VanDerWaalsContact C-N 3.3Å; H199-W201 PolarHBondContact O-N 2.74Å; W201-I203 VanDerWaalsContact C-N 3.32Å; W201-I203 PolarHBondContact O-N 2.67Å; W201-F204 WeakPolarHBondContact O-CB 3.26Å; W201-F204 PolarHBondContact O-N 2.98Å; W201-F204 VanDerWaalsContact O-N 3.09Å; W201-I205 PolarHBondContact O-N 3.34Å
202V91.7Very high87Confident1 Ų176.6 Ų76.61%0.00640%0.398CS..Hα-helixtrans-58.8-44.6-179.5169.40000111.4R114 V115 V118 S198 H199 F204 I205 I206 V235R114-V202 HydrophobicContact CB-CG2 4.27Å; V115-V202 HydrophobicContact CB-CG2 4.27Å; V115-V202 HydrophobicContact CG2-CG2 3.71Å; V118-V202 HydrophobicContact CG2-CG1 3.98Å; S198-V202 WeakPolarHBondContact O-CB 3.08Å; S198-V202 VanDerWaalsContact O-CG2 3.26Å; S198-V202 WeakPolarHBondContact O-CG2 3.29Å; S198-V202 PolarHBondContact O-N 2.9Å; H199-V202 PolarHBondContact O-N 3.25Å; V202-F204 VanDerWaalsContact C-N 3.31Å; V202-F204 PolarHBondContact O-N 3.19Å; V202-I205 PolarHBondContact O-N 2.86Å; V202-I206 HydrophobicContact CG1-CD1 3.6Å; V202-I206 HydrophobicContact CG1-CG1 4.32Å; V202-I206 WeakPolarHBondContact O-CB 3.37Å; V202-I206 VanDerWaalsContact O-CG1 3.26Å; V202-I206 WeakPolarHBondContact O-CG1 3.46Å; V202-I206 PolarHBondContact O-N 3.44Å; V202-V235 HydrophobicContact CG1-CB 4.31Å; V202-V235 HydrophobicContact CG1-CG1 3.8Å; V202-V235 HydrophobicContact CG1-CG2 3.49Å; V202-V235 VanDerWaalsContact CG1-CG2 3.49Å
203I90.2Very high84.8Confident71 Ų7185.9 Ų85.936%0.36443%0.43SS..Hα-helixtrans-60.7-42.9176.4-69166.5000110.6H199 W201 I206 R207 V235H199-I203 WeakPolarHBondContact O-CB 3.14Å; H199-I203 WeakPolarHBondContact O-CD1 3.38Å; H199-I203 WeakPolarHBondContact O-CG1 3.36Å; H199-I203 PolarHBondContact O-N 3.38Å; W201-I203 VanDerWaalsContact C-N 3.32Å; W201-I203 PolarHBondContact O-N 2.67Å; I203-I206 PolarHBondContact O-N 3.06Å; I203-R207 WeakPolarHBondContact O-CB 3.39Å; I203-R207 WeakPolarHBondContact O-CG 3.08Å; I203-R207 PolarHBondContact O-N 2.74Å; I203-V235 HydrophobicContact CG1-CG1 4.43Å
204F91Very high82.3Confident133 Ų13389.5 Ų89.558%0.58344%0.443SS*.Hα-helixtrans-60.1-47.1176.6175.3-98.3000112.3A200 W201 V202 R207 K208A200-F204 WeakPolarHBondContact O-CB 3.33Å; A200-F204 PolarHBondContact O-N 3.12Å; W201-F204 WeakPolarHBondContact O-CB 3.26Å; W201-F204 PolarHBondContact O-N 2.98Å; W201-F204 VanDerWaalsContact O-N 3.09Å; V202-F204 VanDerWaalsContact C-N 3.31Å; V202-F204 PolarHBondContact O-N 3.19Å; F204-R207 PolarHBondContact O-N 3.01Å; F204-K208 PolarHBondContact O-N 3.39Å
205I88.3Confident80Confident43 Ų4392.4 Ų92.422%0.22147%0.466CS..Hα-helixtrans-63.7-45.2177.7-68.6167.1000111V118 L119 W201 V202 R207 K208 S209V118-I205 HydrophobicContact CG1-CB 3.94Å; V118-I205 HydrophobicContact CG1-CD1 4.01Å; V118-I205 HydrophobicContact CG1-CG2 3.44Å; V118-I205 VanDerWaalsContact CG1-CG2 3.44Å; L119-I205 HydrophobicContact CD2-CD1 3.61Å; L119-I205 HydrophobicContact CG-CD1 4.44Å; W201-I205 PolarHBondContact O-N 3.34Å; V202-I205 PolarHBondContact O-N 2.86Å; I205-R207 VanDerWaalsContact C-N 3.29Å; I205-R207 PolarHBondContact O-N 3.33Å; I205-K208 PolarHBondContact O-N 3.47Å; I205-S209 WeakPolarHBondContact O-CB 3.32Å; I205-S209 PolarHBondContact O-N 3.29Å
206I85.8Confident77.7Confident28 Ų28100 Ų10014%0.14451%0.507CS..Hα-helixtrans-59.8-43-179.3-70.4169.2000110.4V202 I203 S209 Q210 I232 V235V202-I206 HydrophobicContact CG1-CD1 3.6Å; V202-I206 HydrophobicContact CG1-CG1 4.32Å; V202-I206 WeakPolarHBondContact O-CB 3.37Å; V202-I206 VanDerWaalsContact O-CG1 3.26Å; V202-I206 WeakPolarHBondContact O-CG1 3.46Å; V202-I206 PolarHBondContact O-N 3.44Å; I203-I206 PolarHBondContact O-N 3.06Å; I206-S209 PolarHBondContact O-N 2.98Å; I206-Q210 WeakPolarHBondContact O-CG 3.25Å; I206-Q210 PolarHBondContact O-N 3.38Å; I206-I232 HydrophobicContact CD1-CG1 4.24Å; I206-I232 HydrophobicContact CG2-CD1 4.23Å; I206-I232 HydrophobicContact CG2-CG1 4.19Å; I206-V235 HydrophobicContact CD1-CG2 4.33Å
207R86.1Confident75.9Confident187 Ų18797 Ų9771%0.70650%0.498SS*.Hα-helixtrans-63.8-44.8176-75.5-177.4175-175-0.3112.1I203 F204 I205 S209 Q210I203-R207 WeakPolarHBondContact O-CB 3.39Å; I203-R207 WeakPolarHBondContact O-CG 3.08Å; I203-R207 PolarHBondContact O-N 2.74Å; F204-R207 PolarHBondContact O-N 3.01Å; I205-R207 VanDerWaalsContact C-N 3.29Å; I205-R207 PolarHBondContact O-N 3.33Å; R207-S209 VanDerWaalsContact C-N 3.31Å; R207-S209 PolarHBondContact O-N 3.05Å; R207-Q210 PolarHBondContact O-N 2.98Å
208K85.3Confident74.2Confident155 Ų15598.7 Ų98.767%0.67451%0.513SS*.Hα-helixtrans-62-38.1177.8-171.6176-179.9178.10112.2F204 I205 Q210 S211F204-K208 PolarHBondContact O-N 3.39Å; I205-K208 PolarHBondContact O-N 3.47Å; K208-Q210 VanDerWaalsContact C-N 3.26Å; K208-Q210 PolarHBondContact O-N 3.29Å; K208-S211 PolarHBondContact O-N 3.26Å
209S78.1Confident72.4Confident84 Ų84106.6 Ų106.659%0.58755%0.549SS*.THydrogen-bonded Turntrans-73.6-10.3178.7-177.80000114.2I205 I206 R207 S211I205-S209 WeakPolarHBondContact O-CB 3.32Å; I205-S209 PolarHBondContact O-N 3.29Å; I206-S209 PolarHBondContact O-N 2.98Å; R207-S209 VanDerWaalsContact C-N 3.31Å; R207-S209 PolarHBondContact O-N 3.05Å; S209-S211 VanDerWaalsContact C-N 3.28Å
210Q69.1Low71.1Confident116 Ų116111.8 Ų111.854%0.54258%0.577SS.*THydrogen-bonded Turntrans-82.9-2.2174.6-75.3174.7-12.900113.4I206 R207 K208I206-Q210 WeakPolarHBondContact O-CG 3.25Å; I206-Q210 PolarHBondContact O-N 3.38Å; R207-Q210 PolarHBondContact O-N 2.98Å; K208-Q210 VanDerWaalsContact C-N 3.26Å; K208-Q210 PolarHBondContact O-N 3.29Å
211S58.5Low70.1Confident88 Ų88111.4 Ų111.462%0.61558%0.575SS**SBendtrans-59.5128.5171.8-171.50000110K208 S209 R213K208-S211 PolarHBondContact O-N 3.26Å; S209-S211 VanDerWaalsContact C-N 3.28Å; S211-R213 PolarHBondContact O-N 2.89Å
212P50.5Low69.3Low124 Ų124112.2 Ų112.281%0.80558%0.584SS**  trans-72.293.2-170.128.7-33.3000110.1
213R50.9Low68.6Low229 Ų229115 Ų11586%0.86460%0.603SS**  trans-89.9112.9155.6-84-175174.4179.4-2.3107.9S211 S215S211-R213 PolarHBondContact O-N 2.89Å; R213-S215 PolarHBondContact O-N 3.24Å
214H43.1Very low68Low185 Ų185114.7 Ų114.786%0.85661%0.608SS**  trans-44.8117.5162.1-92.8-65.4000109
215S49.9Very low67.6Low103 Ų103113.1 Ų113.172%0.7261%0.605SS**  trans-148.5103.1167.3-630000108.5R213 A217R213-S215 PolarHBondContact O-N 3.24Å; S215-A217 PolarHBondContact O-N 3.43Å
216D47.2Very low67.3Low163 Ų163117.2 Ų117.287%0.87262%0.623SS**  trans-61.4107.2172.1-63.3-53.1000110.6
217A57.6Low67.1Low50 Ų50120.6 Ų120.641%0.41364%0.64SS.*  trans-165.383.116200000109.7S215 Q219 N220 A221S215-A217 PolarHBondContact O-N 3.43Å; A217-Q219 PolarHBondContact O-N 2.9Å; A217-N220 HydrophobicContact CB-CB 4.33Å; A217-N220 PolarHBondContact O-N 3.47Å; A217-A221 WeakPolarHBondContact O-CB 3.45Å; A217-A221 PolarHBondContact O-N 3.34Å
218S58.9Low66.9Low107 Ų107115.6 Ų115.675%0.74862%0.624SS**Hα-helixtrans-60-35-169.555.70000115.2
219Q56.4Low67Low172 Ų172115.6 Ų115.680%0.80462%0.62SS**Hα-helixtrans-83.2-34.7-179-69.5-175.2-10.600113.6A217 A221A217-Q219 PolarHBondContact O-N 2.9Å; Q219-A221 VanDerWaalsContact C-N 3.27Å
220N66.2Low67.3Low120 Ų120113 Ų11364%0.64260%0.6SS**Hα-helixtrans-76.6-18.8173-69.9-22.3000111.9A217 S223 S224A217-N220 HydrophobicContact CB-CB 4.33Å; A217-N220 PolarHBondContact O-N 3.47Å; N220-S223 PolarHBondContact O-OG 2.61Å; N220-S224 WeakPolarHBondContact O-CB 3.32Å; N220-S224 PolarHBondContact O-N 3.38Å; N220-S224 VanDerWaalsContact O-N 3.13Å; N220-S224 PolarHBondContact O-OG 3.32Å
221A72.5Confident68.1Low48 Ų48109.2 Ų109.240%0.39759%0.585SS.*Hα-helixtrans-67.2-43.1178.600000112.7A217 Q219 S224 L225A217-A221 WeakPolarHBondContact O-CB 3.45Å; A217-A221 PolarHBondContact O-N 3.34Å; Q219-A221 VanDerWaalsContact C-N 3.27Å; A221-S224 WeakPolarHBondContact CA-OG 3.49Å; A221-S224 PolarHBondContact O-OG 3.25Å; A221-L225 WeakPolarHBondContact O-CB 3.45Å; A221-L225 PolarHBondContact O-N 3.48Å
222E79Confident69.5Low149 Ų149107.4 Ų107.470%0.69657%0.568SS**Hα-helixtrans-69-47.3-177.1-170.9174.8-170.400112.1S224 L225 Q226E222-S224 PolarHBondContact O-N 3.33Å; E222-L225 PolarHBondContact O-N 2.65Å; E222-Q226 PolarHBondContact O-N 3.34Å
223S75.9Confident71.5Confident60 Ų60103.1 Ų103.142%0.4254%0.537SS..Hα-helixtrans-62.3-42.7177.560.20000111.8N220 L225 Q226 I227N220-S223 PolarHBondContact O-OG 2.61Å; S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 2.84Å; S223-Q226 PolarHBondContact O-N 3.27Å; S223-I227 VanDerWaalsContact O-CG1 3.25Å; S223-I227 WeakPolarHBondContact O-CG1 3.21Å; S223-I227 PolarHBondContact O-N 3.5Å
224S78.6Confident73.4Confident65 Ų6592.4 Ų92.446%0.45550%0.497SS..Hα-helixtrans-65.6-35.8175.1630000112.5N220 A221 E222 K228N220-S224 WeakPolarHBondContact O-CB 3.32Å; N220-S224 PolarHBondContact O-N 3.38Å; N220-S224 VanDerWaalsContact O-N 3.13Å; N220-S224 PolarHBondContact O-OG 3.32Å; A221-S224 WeakPolarHBondContact CA-OG 3.49Å; A221-S224 PolarHBondContact O-OG 3.25Å; E222-S224 PolarHBondContact O-N 3.33Å; S224-K228 VanDerWaalsContact O-CB 3.24Å; S224-K228 WeakPolarHBondContact O-CB 3.42Å; S224-K228 PolarHBondContact O-N 3.45Å
225L82.4Confident75.7Confident99 Ų9983.8 Ų83.852%0.51846%0.457SS..Hα-helixtrans-68.8-39.6175.7-168.5147.2000111.8A221 E222 S223 K228 R229A221-L225 WeakPolarHBondContact O-CB 3.45Å; A221-L225 PolarHBondContact O-N 3.48Å; E222-L225 PolarHBondContact O-N 2.65Å; S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 2.84Å; L225-K228 PolarHBondContact O-N 2.85Å; L225-R229 WeakPolarHBondContact O-CB 3.27Å; L225-R229 PolarHBondContact O-N 3.3Å
226Q82.3Confident77.7Confident130 Ų13083.3 Ų83.361%0.60745%0.445SS*.Hα-helixtrans-65.8-43.2175-174176.6-7.100111.9E222 S223 R229 T230E222-Q226 PolarHBondContact O-N 3.34Å; S223-Q226 PolarHBondContact O-N 3.27Å; Q226-R229 PolarHBondContact O-N 3.35Å; Q226-T230 PolarHBondContact O-N 3.32Å; Q226-T230 PolarHBondContact O-OG1 3.42Å
227I80.2Confident79.9Confident99 Ų9975.5 Ų75.551%0.50840%0.404SS..Hα-helixtrans-60.1-48.9173.6-68.3165.5000109.7S223 R229 T230 V231S223-I227 VanDerWaalsContact O-CG1 3.25Å; S223-I227 WeakPolarHBondContact O-CG1 3.21Å; S223-I227 PolarHBondContact O-N 3.5Å; I227-R229 PolarHBondContact O-N 3.18Å; I227-T230 WeakPolarHBondContact O-CB 3.04Å; I227-T230 PolarHBondContact O-N 3.31Å; I227-T230 VanDerWaalsContact O-N 3.15Å; I227-V231 HydrophobicContact CG2-CG2 4.45Å; I227-V231 WeakPolarHBondContact O-CG2 3.5Å; I227-V231 PolarHBondContact O-N 2.9Å
228K82.8Confident81.7Confident82 Ų8273.3 Ų73.336%0.35739%0.385SS..Hα-helixtrans-59.2-44.1178.7-174.9174.1-177.9175.40112.2S224 L225 T230 V231 I232S224-K228 VanDerWaalsContact O-CB 3.24Å; S224-K228 WeakPolarHBondContact O-CB 3.42Å; S224-K228 PolarHBondContact O-N 3.45Å; L225-K228 PolarHBondContact O-N 2.85Å; K228-T230 VanDerWaalsContact C-N 3.33Å; K228-T230 PolarHBondContact O-N 2.94Å; K228-V231 PolarHBondContact O-N 3Å; K228-I232 HydrophobicContact CG-CD1 3.98Å; K228-I232 VanDerWaalsContact O-CG1 3.3Å; K228-I232 WeakPolarHBondContact O-CG1 3.46Å; K228-I232 PolarHBondContact O-N 3.41Å
229R86.4Confident83.4Confident155 Ų15569.4 Ų69.459%0.58536%0.359SS*.Hα-helixtrans-61.3-42.5176-176.5-178.8-74.2168-3.5111.4L225 Q226 I227 I232 Q233L225-R229 WeakPolarHBondContact O-CB 3.27Å; L225-R229 PolarHBondContact O-N 3.3Å; Q226-R229 PolarHBondContact O-N 3.35Å; I227-R229 PolarHBondContact O-N 3.18Å; R229-I232 PolarHBondContact O-N 2.94Å; R229-Q233 WeakPolarHBondContact O-CB 3.4Å; R229-Q233 WeakPolarHBondContact O-CG 3.31Å; R229-Q233 PolarHBondContact O-N 3.38Å
230T85.9Confident85.3Confident30 Ų3064.8 Ų64.818%0.18434%0.34CS..Hα-helixtrans-64-43.9177.6-55.10000111.2I38 Q226 I227 K228 Q233 L234I38-T230 HydrophobicContact CG2-CG2 4.02Å; Q226-T230 PolarHBondContact O-N 3.32Å; Q226-T230 PolarHBondContact O-OG1 3.42Å; I227-T230 WeakPolarHBondContact O-CB 3.04Å; I227-T230 PolarHBondContact O-N 3.31Å; I227-T230 VanDerWaalsContact O-N 3.15Å; K228-T230 VanDerWaalsContact C-N 3.33Å; K228-T230 PolarHBondContact O-N 2.94Å; T230-Q233 PolarHBondContact O-N 3.5Å; T230-L234 HydrophobicContact CG2-CD1 4.19Å; T230-L234 WeakPolarHBondContact O-CG 3.43Å; T230-L234 PolarHBondContact O-N 2.88Å
231V85.8Confident86.7Confident36 Ų3659.1 Ų59.122%0.21831%0.309CS..Hα-helixtrans-60.6-48.3175.51720000110.8V118 I227 K228 Q233 L234 V235V118-V231 HydrophobicContact CG2-CG1 4.17Å; I227-V231 HydrophobicContact CG2-CG2 4.45Å; I227-V231 WeakPolarHBondContact O-CG2 3.5Å; I227-V231 PolarHBondContact O-N 2.9Å; K228-V231 PolarHBondContact O-N 3Å; V231-Q233 PolarHBondContact O-N 2.98Å; V231-L234 PolarHBondContact O-N 3.43Å; V231-V235 HydrophobicContact CG1-CG2 4.36Å; V231-V235 VanDerWaalsContact O-CG2 3.28Å; V231-V235 WeakPolarHBondContact O-CG2 3.39Å; V231-V235 PolarHBondContact O-N 3.09Å
232I87.6Confident87.8Confident49 Ų4957.1 Ų57.125%0.25129%0.292SS..Hα-helixtrans-59.8-44.9178.4-69.9167000111.2I206 K228 R229 L234 V235 I236I206-I232 HydrophobicContact CD1-CG1 4.24Å; I206-I232 HydrophobicContact CG2-CD1 4.23Å; I206-I232 HydrophobicContact CG2-CG1 4.19Å; K228-I232 HydrophobicContact CG-CD1 3.98Å; K228-I232 VanDerWaalsContact O-CG1 3.3Å; K228-I232 WeakPolarHBondContact O-CG1 3.46Å; K228-I232 PolarHBondContact O-N 3.41Å; R229-I232 PolarHBondContact O-N 2.94Å; I232-L234 VanDerWaalsContact C-N 3.34Å; I232-L234 PolarHBondContact O-N 2.86Å; I232-V235 PolarHBondContact O-N 3.33Å; I232-I236 HydrophobicContact CG2-CD1 3.77Å; I232-I236 HydrophobicContact CG2-CG1 4.42Å; I232-I236 WeakPolarHBondContact O-CG1 3.38Å; I232-I236 PolarHBondContact O-N 2.99Å
233Q91.6Very high88.6Confident35 Ų3553.4 Ų53.416%0.16428%0.282CS..Hα-helixtrans-60-45.2177.2-76.8179.32.900111.7R229 T230 V231 I236 T237 T296R229-Q233 WeakPolarHBondContact O-CB 3.4Å; R229-Q233 WeakPolarHBondContact O-CG 3.31Å; R229-Q233 PolarHBondContact O-N 3.38Å; T230-Q233 PolarHBondContact O-N 3.5Å; V231-Q233 PolarHBondContact O-N 2.98Å; Q233-I236 PolarHBondContact O-N 3.19Å; Q233-T237 WeakPolarHBondContact O-CB 3.48Å; Q233-T237 PolarHBondContact O-N 3.5Å; Q233-T237 PolarHBondContact O-OG1 2.95Å; Q233-T296 PolarHBondContact NE2-OG1 2.88Å; Q233-T296 PolarHBondContact OE1-OG1 3.18Å
234L91.3Very high89.6Confident3 Ų352.3 Ų52.32%0.01627%0.27CS..Hα-helixtrans-62.6-43.5176.8-70.8170.1000111.4I38 T43 L47 R114 T230 V231 I232 I236 T237 T238I38-L234 HydrophobicContact CG2-CD1 3.86Å; I38-L234 HydrophobicContact CG2-CD2 4.01Å; I38-L234 HydrophobicContact CG2-CG 4.3Å; T43-L234 HydrophobicContact CG2-CD1 4.35Å; L47-L234 HydrophobicContact CD1-CD2 4.13Å; R114-L234 VanDerWaalsContact NH1-CD1 3.29Å; T230-L234 HydrophobicContact CG2-CD1 4.19Å; T230-L234 WeakPolarHBondContact O-CG 3.43Å; T230-L234 PolarHBondContact O-N 2.88Å; V231-L234 PolarHBondContact O-N 3.43Å; I232-L234 VanDerWaalsContact C-N 3.34Å; I232-L234 PolarHBondContact O-N 2.86Å; L234-I236 PolarHBondContact O-N 3.21Å; L234-T237 WeakPolarHBondContact O-CB 3.33Å; L234-T237 PolarHBondContact O-N 2.87Å; L234-T238 WeakPolarHBondContact O-CB 3.5Å; L234-T238 VanDerWaalsContact O-CG2 3.25Å; L234-T238 WeakPolarHBondContact O-CG2 3.31Å; L234-T238 PolarHBondContact O-N 3.41Å; L234-T238 PolarHBondContact O-OG1 3.13Å
235V91.6Very high90.4Very high5 Ų549.9 Ų49.93%0.0325%0.252CS..Hα-helixtrans-59.2-48.4176.9170.50000111.4R114 V202 I203 I206 V231 I232 T237 T238 A239R114-V235 HydrophobicContact CB-CG2 4.35Å; R114-V235 HydrophobicContact CG-CG2 4.39Å; V202-V235 HydrophobicContact CG1-CB 4.31Å; V202-V235 HydrophobicContact CG1-CG1 3.8Å; V202-V235 HydrophobicContact CG1-CG2 3.49Å; V202-V235 VanDerWaalsContact CG1-CG2 3.49Å; I203-V235 HydrophobicContact CG1-CG1 4.43Å; I206-V235 HydrophobicContact CD1-CG2 4.33Å; V231-V235 HydrophobicContact CG1-CG2 4.36Å; V231-V235 VanDerWaalsContact O-CG2 3.28Å; V231-V235 WeakPolarHBondContact O-CG2 3.39Å; V231-V235 PolarHBondContact O-N 3.09Å; I232-V235 PolarHBondContact O-N 3.33Å; V235-T237 VanDerWaalsContact C-N 3.34Å; V235-T237 PolarHBondContact O-N 2.97Å; V235-T238 WeakPolarHBondContact CA-OG1 2.94Å; V235-T238 PolarHBondContact O-N 3.48Å; V235-T238 PolarHBondContact O-OG1 3.43Å; V235-A239 VanDerWaalsContact O-CB 3.28Å; V235-A239 WeakPolarHBondContact O-CB 3.16Å; V235-A239 PolarHBondContact O-N 3.32Å
236I92.1Very high91.1Very high92 Ų9246 Ų4647%0.47223%0.234SC..Hα-helixtrans-60-47.2177.6-68.2168.3000110.2I232 Q233 L234 T238 A239 I240I232-I236 HydrophobicContact CG2-CD1 3.77Å; I232-I236 HydrophobicContact CG2-CG1 4.42Å; I232-I236 WeakPolarHBondContact O-CG1 3.38Å; I232-I236 PolarHBondContact O-N 2.99Å; Q233-I236 PolarHBondContact O-N 3.19Å; L234-I236 PolarHBondContact O-N 3.21Å; I236-T238 PolarHBondContact O-N 2.92Å; I236-A239 PolarHBondContact O-N 2.83Å; I236-I240 HydrophobicContact CG2-CD1 3.8Å; I236-I240 HydrophobicContact CG2-CG1 4.46Å; I236-I240 VanDerWaalsContact O-CG1 3.29Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 2.82Å
237T93.5Very high91.8Very high0 Ų045 Ų450%023%0.232CC..Hα-helixtrans-56.4-51178.7-55.50000111Q233 L234 V235 A239 I240 M241 I290 L291 S294Q233-T237 WeakPolarHBondContact O-CB 3.48Å; Q233-T237 PolarHBondContact O-N 3.5Å; Q233-T237 PolarHBondContact O-OG1 2.95Å; L234-T237 WeakPolarHBondContact O-CB 3.33Å; L234-T237 PolarHBondContact O-N 2.87Å; V235-T237 VanDerWaalsContact C-N 3.34Å; V235-T237 PolarHBondContact O-N 2.97Å; T237-A239 VanDerWaalsContact C-N 3.33Å; T237-A239 PolarHBondContact O-N 2.73Å; T237-I240 PolarHBondContact O-N 3.07Å; T237-M241 HydrophobicContact CG2-SD 4.15Å; T237-M241 WeakPolarHBondContact O-CG 3.4Å; T237-M241 PolarHBondContact O-N 3.04Å; T237-I290 HydrophobicContact CG2-CG2 4.08Å; T237-L291 HydrophobicContact CG2-CB 4.37Å; T237-L291 HydrophobicContact CG2-CD1 3.88Å; T237-S294 WeakPolarHBondContact OG1-CB 3.2Å
238T94.2Very high92.5Very high3 Ų341.2 Ų41.22%0.01821%0.212CC..Hα-helixtrans-68.3-33.5-177.953.80000112.1I110 R114 H199 L234 V235 I236 M241 S242I110-T238 HydrophobicContact CG2-CG2 3.23Å; R114-T238 HydrophobicContact CG-CG2 4.4Å; H199-T238 PolarHBondContact CE1-OG1 3.36Å; L234-T238 WeakPolarHBondContact O-CB 3.5Å; L234-T238 VanDerWaalsContact O-CG2 3.25Å; L234-T238 WeakPolarHBondContact O-CG2 3.31Å; L234-T238 PolarHBondContact O-N 3.41Å; L234-T238 PolarHBondContact O-OG1 3.13Å; V235-T238 WeakPolarHBondContact CA-OG1 2.94Å; V235-T238 PolarHBondContact O-N 3.48Å; V235-T238 PolarHBondContact O-OG1 3.43Å; I236-T238 PolarHBondContact O-N 2.92Å; T238-M241 PolarHBondContact O-N 2.83Å; T238-S242 VanDerWaalsContact O-CB 3.29Å; T238-S242 WeakPolarHBondContact O-CB 3.29Å; T238-S242 PolarHBondContact O-N 3.36Å; T238-S242 PolarHBondContact O-OG 3.43Å
239A94.8Very high93.2Very high25 Ų2537.8 Ų37.821%0.20720%0.198CC..Hα-helixtrans-67.1-40.4174.700000111.6H199 V235 I236 T237 S242 C243H199-A239 HydrophobicContact CB-CB 4.42Å; V235-A239 VanDerWaalsContact O-CB 3.28Å; V235-A239 WeakPolarHBondContact O-CB 3.16Å; V235-A239 PolarHBondContact O-N 3.32Å; I236-A239 PolarHBondContact O-N 2.83Å; T237-A239 VanDerWaalsContact C-N 3.33Å; T237-A239 PolarHBondContact O-N 2.73Å; A239-S242 PolarHBondContact O-N 2.82Å; A239-C243 VanDerWaalsContact O-CB 3.25Å; A239-C243 WeakPolarHBondContact O-CB 3.42Å; A239-C243 PolarHBondContact O-N 3.37Å
240I96Very high93.6Very high76 Ų7631.8 Ų31.839%0.3918%0.18SC..Hα-helixtrans-63.4-49.2174.6-66166.1000110.1I236 T237 S242 C243 Q244 I290I236-I240 HydrophobicContact CG2-CD1 3.8Å; I236-I240 HydrophobicContact CG2-CG1 4.46Å; I236-I240 VanDerWaalsContact O-CG1 3.29Å; I236-I240 WeakPolarHBondContact O-CG1 3.34Å; I236-I240 PolarHBondContact O-N 2.82Å; T237-I240 PolarHBondContact O-N 3.07Å; I240-S242 VanDerWaalsContact C-N 3.31Å; I240-S242 PolarHBondContact O-N 3.35Å; I240-C243 PolarHBondContact O-N 2.89Å; I240-Q244 VanDerWaalsContact O-CB 3.31Å; I240-Q244 WeakPolarHBondContact O-CB 3.33Å; I240-Q244 PolarHBondContact O-N 3.42Å; I240-I290 HydrophobicContact CB-CG2 4.04Å; I240-I290 HydrophobicContact CG2-CD1 3.91Å; I240-I290 HydrophobicContact CG2-CG1 4.16Å; I240-I290 HydrophobicContact CG2-CG2 3.77Å
241M95.8Very high94Very high1 Ų133.5 Ų33.51%0.00519%0.185CC..Hα-helixtrans-57.9-43.6176.6-67.117369.300111.7Q50 L107 T237 T238 Q244 Q245 N287 I290Q50-M241 HydrophobicContact CG-CE 3.93Å; L107-M241 HydrophobicContact CD1-CB 4.08Å; L107-M241 HydrophobicContact CD1-CE 4.04Å; L107-M241 HydrophobicContact CD2-CB 4.16Å; T237-M241 HydrophobicContact CG2-SD 4.15Å; T237-M241 WeakPolarHBondContact O-CG 3.4Å; T237-M241 PolarHBondContact O-N 3.04Å; T238-M241 PolarHBondContact O-N 2.83Å; M241-Q244 PolarHBondContact O-N 3.47Å; M241-Q245 WeakPolarHBondContact O-CB 3.38Å; M241-Q245 PolarHBondContact O-N 2.97Å; M241-N287 HydrophobicContact CE-CB 3.89Å; M241-I290 HydrophobicContact CG-CB 4.25Å; M241-I290 HydrophobicContact CG-CD1 4.44Å; M241-I290 HydrophobicContact CG-CG2 3.76Å
242S95.8Very high94.4Very high6 Ų632.1 Ų32.14%0.04218%0.176CC..Hα-helixtrans-65.3-44.3179.6-57.60000112.3M195 H199 T238 A239 I240 Q245 A246M195-S242 WeakPolarHBondContact SD-CB 3.34Å; M195-S242 PolarHBondContact SD-OG 2.88Å; H199-S242 PolarHBondContact NE2-OG 3.29Å; T238-S242 VanDerWaalsContact O-CB 3.29Å; T238-S242 WeakPolarHBondContact O-CB 3.29Å; T238-S242 PolarHBondContact O-N 3.36Å; T238-S242 PolarHBondContact O-OG 3.43Å; A239-S242 PolarHBondContact O-N 2.82Å; I240-S242 VanDerWaalsContact C-N 3.31Å; I240-S242 PolarHBondContact O-N 3.35Å; S242-Q245 PolarHBondContact O-N 2.89Å; S242-A246 WeakPolarHBondContact O-CB 3.5Å; S242-A246 PolarHBondContact O-N 2.68Å
243C96.3Very high94.7Very high70 Ų7029.9 Ų29.947%0.47317%0.165SC..Hα-helixtrans-64.4-45.3178.4-174.60000110.8A239 I240 Q245 A246 I247A239-C243 VanDerWaalsContact O-CB 3.25Å; A239-C243 WeakPolarHBondContact O-CB 3.42Å; A239-C243 PolarHBondContact O-N 3.37Å; I240-C243 PolarHBondContact O-N 2.89Å; C243-Q245 PolarHBondContact O-N 3.25Å; C243-A246 PolarHBondContact O-N 3.35Å; C243-I247 WeakPolarHBondContact O-CG1 3.29Å; C243-I247 PolarHBondContact O-N 2.91Å
244Q96.4Very high94.8Very high37 Ų3732.8 Ų32.817%0.17318%0.18CC..Hα-helixtrans-59.1-48.5175.2-179.9-176.1-81.200111.4I240 M241 A246 I247 L248 G283 S286 N287I240-Q244 VanDerWaalsContact O-CB 3.31Å; I240-Q244 WeakPolarHBondContact O-CB 3.33Å; I240-Q244 PolarHBondContact O-N 3.42Å; M241-Q244 PolarHBondContact O-N 3.47Å; Q244-A246 VanDerWaalsContact C-N 3.33Å; Q244-A246 PolarHBondContact O-N 3.15Å; Q244-I247 PolarHBondContact O-N 2.82Å; Q244-L248 HydrophobicContact CG-CD1 3.47Å; Q244-L248 VanDerWaalsContact CG-CD1 3.47Å; Q244-L248 HydrophobicContact CG-CG 4.17Å; Q244-L248 WeakPolarHBondContact O-CB 3.39Å; Q244-L248 VanDerWaalsContact O-CG 3.28Å; Q244-L248 WeakPolarHBondContact O-CG 3.4Å; Q244-L248 PolarHBondContact O-N 3.32Å; Q244-G283 PolarHBondContact NE2-O 3.25Å; Q244-S286 PolarHBondContact NE2-OG 3.35Å; Q244-S286 PolarHBondContact OE1-OG 3.23Å; Q244-S286 VanDerWaalsContact OE1-OG 3.12Å; Q244-N287 PolarHBondContact NE2-OD1 3.11Å
245Q95.3Very high94.8Very high14 Ų1433.1 Ų33.17%0.06518%0.183CC..Hα-helixtrans-58.4-46.3177.4-174.4-171.3-61.100111.4V104 L107 M241 S242 C243 I247 L248 H249V104-Q245 HydrophobicContact CG2-CG 4.24Å; L107-Q245 HydrophobicContact CD2-CB 4.2Å; M241-Q245 WeakPolarHBondContact O-CB 3.38Å; M241-Q245 PolarHBondContact O-N 2.97Å; S242-Q245 PolarHBondContact O-N 2.89Å; C243-Q245 PolarHBondContact O-N 3.25Å; Q245-I247 VanDerWaalsContact C-N 3.3Å; Q245-I247 PolarHBondContact O-N 3.04Å; Q245-L248 PolarHBondContact O-N 3.27Å; Q245-H249 WeakPolarHBondContact O-CB 3.03Å; Q245-H249 PolarHBondContact O-CD2 2.78Å; Q245-H249 PolarHBondContact O-N 3.43Å
246A96.4Very high94.8Very high19 Ų1934.5 Ų34.516%0.15719%0.189CC..Hα-helixtrans-57.5-44177.900000111.8Y188 V192 S242 C243 Q244 S250Y188-A246 WeakPolarHBondContact CE2-O 3.49Å; Y188-A246 PolarHBondContact OH-O 2.92Å; V192-A246 HydrophobicContact CG1-CB 4.26Å; V192-A246 HydrophobicContact CG2-CB 3.71Å; S242-A246 WeakPolarHBondContact O-CB 3.5Å; S242-A246 PolarHBondContact O-N 2.68Å; C243-A246 PolarHBondContact O-N 3.35Å; Q244-A246 VanDerWaalsContact C-N 3.33Å; Q244-A246 PolarHBondContact O-N 3.15Å; A246-S250 WeakPolarHBondContact O-CB 3.13Å; A246-S250 PolarHBondContact O-N 3.08Å
247I97.1Very high94.8Very high108 Ų10833.1 Ų33.155%0.55418%0.182SC*.Hα-helixtrans-67-48.9178.6-66.8165.9000110.7C243 Q244 Q245 S250C243-I247 WeakPolarHBondContact O-CG1 3.29Å; C243-I247 PolarHBondContact O-N 2.91Å; Q244-I247 PolarHBondContact O-N 2.82Å; Q245-I247 VanDerWaalsContact C-N 3.3Å; Q245-I247 PolarHBondContact O-N 3.04Å; I247-S250 WeakPolarHBondContact O-CB 3.04Å; I247-S250 PolarHBondContact O-N 2.9Å; I247-S250 PolarHBondContact O-OG 3.1Å
248L96.6Very high94.8Very high19 Ų1936.2 Ų36.210%0.09920%0.198CC..Hα-helixtrans-71.7-37.3-172.8-65.5174000112.8Q244 Q245 S250 L279 F282Q244-L248 HydrophobicContact CG-CD1 3.47Å; Q244-L248 VanDerWaalsContact CG-CD1 3.47Å; Q244-L248 HydrophobicContact CG-CG 4.17Å; Q244-L248 WeakPolarHBondContact O-CB 3.39Å; Q244-L248 VanDerWaalsContact O-CG 3.28Å; Q244-L248 WeakPolarHBondContact O-CG 3.4Å; Q244-L248 PolarHBondContact O-N 3.32Å; Q245-L248 PolarHBondContact O-N 3.27Å; L248-S250 VanDerWaalsContact C-N 3.29Å; L248-S250 PolarHBondContact O-N 3.34Å; L248-L279 HydrophobicContact CB-CB 4.43Å; L248-L279 WeakPolarHBondContact CB-O 3.41Å; L248-L279 WeakPolarHBondContact CD1-O 3.35Å; L248-L279 HydrophobicContact CD2-CB 4.24Å; L248-L279 HydrophobicContact CD2-CD2 4.04Å; L248-F282 HydrophobicContact CD1-CB 4.5Å; L248-F282 HydrophobicContact CD1-CD1 3.91Å; L248-F282 HydrophobicContact CD2-CD1 4.12Å
249H95.9Very high94.5Very high10 Ų1037.9 Ų37.95%0.04621%0.206CC..Hα-helixtrans-76.1-16.3175.5-76.9-114.5000113.2V104 Y188 Q245 F251 E252 C253V104-H249 VanDerWaalsContact CG2-CE1 3.4Å; V104-H249 WeakPolarHBondContact CG2-CE1 3.41Å; Y188-H249 HydrophobicContact CD2-CB 3.87Å; Y188-H249 HydrophobicContact CE2-CB 4.15Å; Q245-H249 WeakPolarHBondContact O-CB 3.03Å; Q245-H249 PolarHBondContact O-CD2 2.78Å; Q245-H249 PolarHBondContact O-N 3.43Å; H249-F251 PolarHBondContact O-N 3.02Å; H249-E252 PolarHBondContact O-N 2.84Å; H249-C253 PolarHBondContact O-N 3.41Å
250S95.6Very high94.2Very high30 Ų3038.3 Ų38.321%0.2121%0.205CC..Hα-helixtrans-59.2-36.1-179.171.70000112.4Y188 A246 I247 L248 C253 I254Y188-S250 WeakPolarHBondContact OH-CB 3.06Å; A246-S250 WeakPolarHBondContact O-CB 3.13Å; A246-S250 PolarHBondContact O-N 3.08Å; I247-S250 WeakPolarHBondContact O-CB 3.04Å; I247-S250 PolarHBondContact O-N 2.9Å; I247-S250 PolarHBondContact O-OG 3.1Å; L248-S250 VanDerWaalsContact C-N 3.29Å; L248-S250 PolarHBondContact O-N 3.34Å; S250-C253 PolarHBondContact O-N 3.41Å; S250-I254 WeakPolarHBondContact O-CB 3.12Å; S250-I254 WeakPolarHBondContact O-CD1 3.37Å; S250-I254 WeakPolarHBondContact O-CG1 3.37Å; S250-I254 PolarHBondContact O-N 3.45Å
251F95Very high93.9Very high65 Ų6538 Ų3829%0.28521%0.209SC..Hα-helixtrans-63.8-45.7179.1179.6-88.9000112H249 I254 S255 I272 M275 L279H249-F251 PolarHBondContact O-N 3.02Å; F251-I254 PolarHBondContact O-N 3.3Å; F251-S255 WeakPolarHBondContact O-CB 3.42Å; F251-S255 PolarHBondContact O-N 2.9Å; F251-S255 PolarHBondContact O-OG 3.07Å; F251-I272 HydrophobicContact CE1-CG2 4.49Å; F251-I272 WeakPolarHBondContact CE1-O 3.36Å; F251-I272 HydrophobicContact CZ-CG2 4.42Å; F251-M275 HydrophobicContact CD1-CG 4.31Å; F251-M275 HydrophobicContact CE1-CB 3.72Å; F251-M275 HydrophobicContact CE1-CG 3.81Å; F251-M275 HydrophobicContact CE2-CG 4.28Å; F251-M275 HydrophobicContact CZ-CB 3.92Å; F251-M275 HydrophobicContact CZ-CG 3.79Å; F251-L279 HydrophobicContact CB-CD1 3.5Å; F251-L279 HydrophobicContact CD1-CD1 4.14Å; F251-L279 HydrophobicContact CD2-CD1 4.34Å; F251-L279 HydrophobicContact CG-CD1 3.73Å
252E92.8Very high93.5Very high8 Ų845 Ų454%0.03724%0.242CC..Hα-helixtrans-63.4-45.1176.5-177.261.8-155.200110W97 W183 H249 I254 S255 Q256 I280W97-E252 HydrophobicContact CH2-CG 4.08Å; W183-E252 HydrophobicContact CH2-CB 3.84Å; W183-E252 HydrophobicContact CH2-CG 3.29Å; W183-E252 HydrophobicContact CZ2-CG 3.8Å; W183-E252 HydrophobicContact CZ3-CG 3.95Å; H249-E252 PolarHBondContact O-N 2.84Å; E252-I254 PolarHBondContact O-N 2.85Å; E252-S255 WeakPolarHBondContact O-CB 3.36Å; E252-S255 PolarHBondContact O-N 3.01Å; E252-Q256 HydrophobicContact CG-CG 4.48Å; E252-Q256 VanDerWaalsContact O-CG 3.29Å; E252-Q256 WeakPolarHBondContact O-CG 3.36Å; E252-Q256 PolarHBondContact O-N 2.89Å; E252-Q256 PolarHBondContact OE1-NE2 3.35Å; E252-I280 HydrophobicContact CB-CD1 4.24Å; E252-I280 HydrophobicContact CG-CD1 4.42Å
253C93.9Very high93.2Very high2 Ų249.6 Ų49.61%0.01427%0.27CS..Hα-helixtrans-58.8-46.5176.5-174.90000112.8W183 Y188 H249 S250 S255 Q256 I257W183-C253 HydrophobicContact CZ3-CB 4.27Å; Y188-C253 HydrophobicContact CD1-CB 3.8Å; Y188-C253 WeakPolarHBondContact CD1-SG 3.39Å; Y188-C253 HydrophobicContact CD2-CB 4.13Å; Y188-C253 HydrophobicContact CE1-CB 4.13Å; Y188-C253 HydrophobicContact CE2-CB 4.44Å; Y188-C253 HydrophobicContact CG-CB 3.78Å; H249-C253 PolarHBondContact O-N 3.41Å; S250-C253 PolarHBondContact O-N 3.41Å; C253-S255 VanDerWaalsContact C-N 3.32Å; C253-S255 PolarHBondContact O-N 3.21Å; C253-Q256 PolarHBondContact O-N 2.9Å; C253-I257 VanDerWaalsContact O-CG1 3.29Å; C253-I257 WeakPolarHBondContact O-CG1 3.43Å; C253-I257 PolarHBondContact O-N 3.39Å
254I93.9Very high92.7Very high96 Ų9648.3 Ų48.349%0.49226%0.26SS..Hα-helixtrans-62.3-43.3177-69.3163.6000110S250 F251 E252 Q256 I257 L258S250-I254 WeakPolarHBondContact O-CB 3.12Å; S250-I254 WeakPolarHBondContact O-CD1 3.37Å; S250-I254 WeakPolarHBondContact O-CG1 3.37Å; S250-I254 PolarHBondContact O-N 3.45Å; F251-I254 PolarHBondContact O-N 3.3Å; E252-I254 PolarHBondContact O-N 2.85Å; I254-Q256 VanDerWaalsContact C-N 3.35Å; I254-Q256 PolarHBondContact O-N 2.91Å; I254-I257 PolarHBondContact O-N 3.07Å; I254-L258 HydrophobicContact CG2-CD1 4.05Å; I254-L258 HydrophobicContact CG2-CG 4.36Å; I254-L258 VanDerWaalsContact O-CG 3.32Å; I254-L258 WeakPolarHBondContact O-CG 3.48Å; I254-L258 PolarHBondContact O-N 3.02Å
255S92.2Very high92.1Very high10 Ų1052.4 Ų52.47%0.0729%0.287CS..Hα-helixtrans-60.1-44.8178-60.20000111.5F251 E252 C253 I257 L258 I259F251-S255 WeakPolarHBondContact O-CB 3.42Å; F251-S255 PolarHBondContact O-N 2.9Å; F251-S255 PolarHBondContact O-OG 3.07Å; E252-S255 WeakPolarHBondContact O-CB 3.36Å; E252-S255 PolarHBondContact O-N 3.01Å; C253-S255 VanDerWaalsContact C-N 3.32Å; C253-S255 PolarHBondContact O-N 3.21Å; S255-I257 PolarHBondContact O-N 3.42Å; S255-L258 PolarHBondContact O-N 3.31Å; S255-I259 WeakPolarHBondContact O-CD1 3.42Å; S255-I259 VanDerWaalsContact O-CG1 3.24Å; S255-I259 WeakPolarHBondContact O-CG1 3.19Å; S255-I259 PolarHBondContact O-N 3.48Å
256Q91.3Very high91.4Very high33 Ų3356.6 Ų56.615%0.15430%0.303CS..Hα-helixtrans-63.4-39.9175.9-66-63.9-11.700112.3V180 W183 I184 E252 C253 I254 I259 I260V180-Q256 HydrophobicContact CG1-CB 4.29Å; W183-Q256 HydrophobicContact CE3-CG 4.29Å; W183-Q256 HydrophobicContact CZ3-CG 4.31Å; I184-Q256 HydrophobicContact CD1-CB 4.06Å; I184-Q256 HydrophobicContact CG1-CB 4.13Å; E252-Q256 HydrophobicContact CG-CG 4.48Å; E252-Q256 VanDerWaalsContact O-CG 3.29Å; E252-Q256 WeakPolarHBondContact O-CG 3.36Å; E252-Q256 PolarHBondContact O-N 2.89Å; E252-Q256 PolarHBondContact OE1-NE2 3.35Å; C253-Q256 PolarHBondContact O-N 2.9Å; I254-Q256 VanDerWaalsContact C-N 3.35Å; I254-Q256 PolarHBondContact O-N 2.91Å; Q256-I259 PolarHBondContact O-N 2.71Å; Q256-I260 WeakPolarHBondContact O-CG2 3.32Å; Q256-I260 PolarHBondContact O-N 3.33Å
257I92.4Very high90.5Very high64 Ų6459.3 Ų59.333%0.32832%0.318SS..Hα-helixtrans-62.4-42.4174.3-69.5166.4000111.1I184 C253 I254 S255 I259 I260 S261I184-I257 HydrophobicContact CD1-CG1 3.76Å; I184-I257 HydrophobicContact CG1-CG1 4.47Å; C253-I257 VanDerWaalsContact O-CG1 3.29Å; C253-I257 WeakPolarHBondContact O-CG1 3.43Å; C253-I257 PolarHBondContact O-N 3.39Å; I254-I257 PolarHBondContact O-N 3.07Å; S255-I257 PolarHBondContact O-N 3.42Å; I257-I259 VanDerWaalsContact C-N 3.32Å; I257-I259 PolarHBondContact O-N 3.34Å; I257-I260 VanDerWaalsContact O-CG2 3.32Å; I257-I260 WeakPolarHBondContact O-CG2 3.08Å; I257-S261 VanDerWaalsContact O-CB 3.28Å; I257-S261 WeakPolarHBondContact O-CB 3.3Å; I257-S261 PolarHBondContact O-N 3.16Å; I257-S261 PolarHBondContact O-OG 3.16Å
258L92.3Very high89.6Confident65 Ų6557.2 Ų57.234%0.3430%0.303SS..Hα-helixtrans-66.9-34.8177.6-68.2174000112.1I254 S255 E262 V263 V264I254-L258 HydrophobicContact CG2-CD1 4.05Å; I254-L258 HydrophobicContact CG2-CG 4.36Å; I254-L258 VanDerWaalsContact O-CG 3.32Å; I254-L258 WeakPolarHBondContact O-CG 3.48Å; I254-L258 PolarHBondContact O-N 3.02Å; S255-L258 PolarHBondContact O-N 3.31Å; L258-E262 PolarHBondContact O-N 3.48Å; L258-V263 HydrophobicContact CB-CB 4.48Å; L258-V263 HydrophobicContact CD2-CB 4.2Å; L258-V263 HydrophobicContact CD2-CG1 4.15Å; L258-V263 HydrophobicContact CD2-CG2 4.49Å; L258-V263 PolarHBondContact O-N 3.32Å; L258-V264 HydrophobicContact CB-CB 4.32Å; L258-V264 HydrophobicContact CB-CG2 3.99Å; L258-V264 HydrophobicContact CD1-CG2 4.41Å; L258-V264 PolarHBondContact O-N 2.62Å
259I88.3Confident88.6Confident37 Ų3757.1 Ų57.119%0.1931%0.307CS..Hα-helixtrans-65.9-50.8176-71.8159.6000111.1S255 Q256 I257 S261 E262 V264 Y266S255-I259 WeakPolarHBondContact O-CD1 3.42Å; S255-I259 VanDerWaalsContact O-CG1 3.24Å; S255-I259 WeakPolarHBondContact O-CG1 3.19Å; S255-I259 PolarHBondContact O-N 3.48Å; Q256-I259 PolarHBondContact O-N 2.71Å; I257-I259 VanDerWaalsContact C-N 3.32Å; I257-I259 PolarHBondContact O-N 3.34Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 3.42Å; I259-E262 WeakPolarHBondContact O-CA 3.08Å; I259-E262 PolarHBondContact O-N 3.3Å; I259-V264 WeakPolarHBondContact CA-O 3.39Å; I259-V264 HydrophobicContact CG1-CB 4.47Å; I259-V264 HydrophobicContact CG1-CG1 4.49Å; I259-Y266 HydrophobicContact CD1-CD2 3.68Å; I259-Y266 HydrophobicContact CD1-CG 4.36Å
260I88.1Confident87.9Confident34 Ų3458.5 Ų58.517%0.17432%0.316CS..Hα-helixtrans-69.6-26.8-179.1-164.9159.8000112.6V180 Y181 Q256 I257 E262V180-I260 HydrophobicContact CB-CD1 4.08Å; V180-I260 HydrophobicContact CG1-CB 4.18Å; V180-I260 HydrophobicContact CG1-CD1 3.9Å; V180-I260 HydrophobicContact CG1-CG2 4.48Å; Y181-I260 HydrophobicContact CD1-CD1 4.41Å; Y181-I260 HydrophobicContact CD2-CD1 3.88Å; Y181-I260 HydrophobicContact CE1-CD1 3.98Å; Y181-I260 HydrophobicContact CE2-CD1 3.38Å; Y181-I260 HydrophobicContact CE2-CG1 4.49Å; Y181-I260 HydrophobicContact CG-CD1 4.36Å; Y181-I260 VanDerWaalsContact CZ-CD1 3.43Å; Q256-I260 WeakPolarHBondContact O-CG2 3.32Å; Q256-I260 PolarHBondContact O-N 3.33Å; I257-I260 VanDerWaalsContact O-CG2 3.32Å; I257-I260 WeakPolarHBondContact O-CG2 3.08Å; I260-E262 PolarHBondContact O-N 3.24Å
261S89.8Confident87.3Confident70 Ų7060.1 Ų60.149%0.4933%0.326SS..THydrogen-bonded Turntrans-76.84.2171.9-52.20000112.9I257 I259 V263I257-S261 VanDerWaalsContact O-CB 3.28Å; I257-S261 WeakPolarHBondContact O-CB 3.3Å; I257-S261 PolarHBondContact O-N 3.16Å; I257-S261 PolarHBondContact O-OG 3.16Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 3.42Å; S261-V263 PolarHBondContact O-N 3.37Å
262E87.8Confident86.8Confident147 Ų14760.6 Ų60.669%0.68733%0.331SS*.THydrogen-bonded Turntrans58.817.7-178.4-58.1176.7-170.400113.6R173 L258 I259 I260R173-E262 IonicContact NH2-OE1 3.11Å; R173-E262 PolarHBondContact NH2-OE1 2.89Å; R173-E262 VanDerWaalsContact NH2-OE1 3.11Å; L258-E262 PolarHBondContact O-N 3.48Å; I259-E262 WeakPolarHBondContact O-CA 3.08Å; I259-E262 PolarHBondContact O-N 3.3Å; I260-E262 PolarHBondContact O-N 3.24Å
263V89.6Confident86.3Confident103 Ų10360.8 Ų60.862%0.62433%0.331SS*.SBendtrans-77.1-33.1176.9-179.40000110.7L258 S261L258-V263 HydrophobicContact CB-CB 4.48Å; L258-V263 HydrophobicContact CD2-CB 4.2Å; L258-V263 HydrophobicContact CD2-CG1 4.15Å; L258-V263 HydrophobicContact CD2-CG2 4.49Å; L258-V263 PolarHBondContact O-N 3.32Å; S261-V263 PolarHBondContact O-N 3.37Å
264V85.9Confident86Confident43 Ų4360.8 Ų60.826%0.26133%0.331SS..SBendtrans-127.7130.7178.8176.40000109.4L258 I259 Y266 I272L258-V264 HydrophobicContact CB-CB 4.32Å; L258-V264 HydrophobicContact CB-CG2 3.99Å; L258-V264 HydrophobicContact CD1-CG2 4.41Å; L258-V264 PolarHBondContact O-N 2.62Å; I259-V264 WeakPolarHBondContact CA-O 3.39Å; I259-V264 HydrophobicContact CG1-CB 4.47Å; I259-V264 HydrophobicContact CG1-CG1 4.49Å; V264-Y266 PolarHBondContact O-N 3.49Å; V264-I272 HydrophobicContact CG1-CD1 4.08Å
265V84.1Confident85.8Confident123 Ų12360 Ų6075%0.74533%0.326SS*.  trans-79.9122.2175.4-178.20000109.7T267V265-T267 PolarHBondContact O-N 3.4Å
266Y79.2Confident85.8Confident103 Ų10359.5 Ų59.540%0.40432%0.323SS..  trans-66.5119.2175.2-179.7-110.6000111.2R92 I259 V264R92-Y266 VanDerWaalsContact NH2-CZ 3.28Å; R92-Y266 PolarHBondContact NH2-OH 2.04Å; I259-Y266 HydrophobicContact CD1-CD2 3.68Å; I259-Y266 HydrophobicContact CD1-CG 4.36Å; V264-Y266 PolarHBondContact O-N 3.49Å
267T78.9Confident85.8Confident76 Ų7657.9 Ų57.947%0.46632%0.316SS..  trans-132.1129.7172.7-58.30000109.2V265 T270V265-T267 PolarHBondContact O-N 3.4Å; T267-T270 HydrophobicContact CG2-CG2 3.9Å; T267-T270 WeakPolarHBondContact O-CB 3.26Å; T267-T270 WeakPolarHBondContact O-CG2 3.33Å; T267-T270 PolarHBondContact O-N 3.27Å; T267-T270 PolarHBondContact O-OG1 3.4Å
268Y76.9Confident85.9Confident63 Ų6356.1 Ų56.125%0.24731%0.307CS..THydrogen-bonded Turntrans-65.8142.1-179.4-172.3-118.7000112.3Y64 R92 T270 E273Y64-Y268 PolarHBondContact OH-OH 3.4Å; R92-Y268 HydrophobicContact CB-CD2 4.42Å; R92-Y268 HydrophobicContact CB-CE2 3.79Å; R92-Y268 HydrophobicContact CG-CD1 4.23Å; R92-Y268 HydrophobicContact CG-CD2 4.25Å; R92-Y268 HydrophobicContact CG-CE1 3.93Å; R92-Y268 HydrophobicContact CG-CE2 3.93Å; R92-Y268 HydrophobicContact CG-CG 4.4Å; R92-Y268 VanDerWaalsContact NE-CG 3.29Å; R92-Y268 VanDerWaalsContact NH2-CB 3.25Å; Y268-T270 PolarHBondContact O-N 3.47Å; Y268-E273 WeakPolarHBondContact CD2-OE2 3.24Å; Y268-E273 WeakPolarHBondContact CE2-OE1 3.35Å
269G76.1Confident86.1Confident18 Ų1854.9 Ų54.919%0.18630%0.3CS..THydrogen-bonded Turntrans71.312.8179.100000113.3T8 E273T8-G269 WeakPolarHBondContact CG2-O 3.47Å; G269-E273 WeakPolarHBondContact CA-OE2 3.36Å; G269-E273 PolarHBondContact N-OE2 2.92Å
270T82.3Confident86.5Confident39 Ų3953.2 Ų53.224%0.23929%0.291CS..  trans-71154.5170.850.40000110.7T267 Y268 I272 E273 Q274T267-T270 HydrophobicContact CG2-CG2 3.9Å; T267-T270 WeakPolarHBondContact O-CB 3.26Å; T267-T270 WeakPolarHBondContact O-CG2 3.33Å; T267-T270 PolarHBondContact O-N 3.27Å; T267-T270 PolarHBondContact O-OG1 3.4Å; Y268-T270 PolarHBondContact O-N 3.47Å; T270-I272 PolarHBondContact O-N 3.31Å; T270-I272 VanDerWaalsContact O-N 3.13Å; T270-E273 PolarHBondContact O-N 3.03Å; T270-Q274 WeakPolarHBondContact O-CG 3.37Å; T270-Q274 PolarHBondContact O-N 2.97Å; T270-Q274 VanDerWaalsContact O-N 3.11Å
271P82.5Confident86.8Confident63 Ų6351.6 Ų51.641%0.40928%0.283SS..Hα-helixtrans-54.7-31.3173.5-2735.8000113.4V7 I11 M275V7-P271 HydrophobicContact CG1-CG 3.87Å; I11-P271 HydrophobicContact CD1-CB 3.96Å; I11-P271 HydrophobicContact CD1-CG 4.23Å; P271-M275 VanDerWaalsContact O-CB 3.25Å; P271-M275 WeakPolarHBondContact O-CB 3.38Å; P271-M275 PolarHBondContact O-N 3.28Å
272I84.1Confident87.2Confident75 Ų7553.5 Ų53.539%0.38528%0.283SS..Hα-helixtrans-64.4-52.8179.1-61.2173.7000110.6F251 V264 T270 Q274 M275 G276F251-I272 HydrophobicContact CE1-CG2 4.49Å; F251-I272 WeakPolarHBondContact CE1-O 3.36Å; F251-I272 HydrophobicContact CZ-CG2 4.42Å; V264-I272 HydrophobicContact CG1-CD1 4.08Å; T270-I272 PolarHBondContact O-N 3.31Å; T270-I272 VanDerWaalsContact O-N 3.13Å; I272-Q274 VanDerWaalsContact C-N 3.3Å; I272-Q274 PolarHBondContact O-N 3.06Å; I272-M275 PolarHBondContact O-N 3.31Å; I272-G276 PolarHBondContact O-N 3.49Å
273E83.2Confident87.6Confident12 Ų1246.9 Ų46.96%0.05625%0.254CS..Hα-helixtrans-61.9-39.7178.2-178-118.3164.100111.9Y268 G269 T270 G276 T277Y268-E273 WeakPolarHBondContact CD2-OE2 3.24Å; Y268-E273 WeakPolarHBondContact CE2-OE1 3.35Å; G269-E273 WeakPolarHBondContact CA-OE2 3.36Å; G269-E273 PolarHBondContact N-OE2 2.92Å; T270-E273 PolarHBondContact O-N 3.03Å; E273-G276 PolarHBondContact O-N 3.17Å; E273-T277 PolarHBondContact O-N 2.96Å; E273-T277 PolarHBondContact O-OG1 3.06Å
274Q87.6Confident88Confident2 Ų242.2 Ų42.21%0.00923%0.226CC..Hα-helixtrans-69.7-34.2179.1-64.8-176.1-39.600112.5I11 T270 I272 G276 T277 I278I11-Q274 HydrophobicContact CG2-CB 3.51Å; I11-Q274 HydrophobicContact CG2-CG 4.22Å; I11-Q274 VanDerWaalsContact CG2-OE1 3.23Å; T270-Q274 WeakPolarHBondContact O-CG 3.37Å; T270-Q274 PolarHBondContact O-N 2.97Å; T270-Q274 VanDerWaalsContact O-N 3.11Å; I272-Q274 VanDerWaalsContact C-N 3.3Å; I272-Q274 PolarHBondContact O-N 3.06Å; Q274-G276 VanDerWaalsContact C-N 3.35Å; Q274-T277 WeakPolarHBondContact O-CB 3.43Å; Q274-T277 PolarHBondContact O-N 3.14Å; Q274-I278 WeakPolarHBondContact O-CG1 3.47Å; Q274-I278 PolarHBondContact O-N 3.38Å
275M89.9Confident88.5Confident79 Ų7940.6 Ų40.639%0.38922%0.216SC..Hα-helixtrans-64-39.9176.3-173.464-177.300111.8F251 P271 I272 T277 I278 L279F251-M275 HydrophobicContact CD1-CG 4.31Å; F251-M275 HydrophobicContact CE1-CB 3.72Å; F251-M275 HydrophobicContact CE1-CG 3.81Å; F251-M275 HydrophobicContact CE2-CG 4.28Å; F251-M275 HydrophobicContact CZ-CB 3.92Å; F251-M275 HydrophobicContact CZ-CG 3.79Å; P271-M275 VanDerWaalsContact O-CB 3.25Å; P271-M275 WeakPolarHBondContact O-CB 3.38Å; P271-M275 PolarHBondContact O-N 3.28Å; I272-M275 PolarHBondContact O-N 3.31Å; M275-T277 VanDerWaalsContact C-N 3.33Å; M275-T277 PolarHBondContact O-N 3.35Å; M275-I278 PolarHBondContact O-N 2.9Å; M275-L279 HydrophobicContact CE-CD1 4.11Å; M275-L279 HydrophobicContact CE-CD2 4.04Å; M275-L279 HydrophobicContact CE-CG 4.04Å; M275-L279 HydrophobicContact CG-CD1 4.41Å; M275-L279 WeakPolarHBondContact O-CG 3.41Å; M275-L279 PolarHBondContact O-N 3.48Å
276G90.9Very high89Confident0 Ų035.6 Ų35.60%019%0.187CC..Hα-helixtrans-59-45.2172.300000111.9I272 E273 Q274 I278 L279 I280I272-G276 PolarHBondContact O-N 3.49Å; E273-G276 PolarHBondContact O-N 3.17Å; Q274-G276 VanDerWaalsContact C-N 3.35Å; G276-I278 PolarHBondContact O-N 3.18Å; G276-L279 PolarHBondContact O-N 3.19Å; G276-I280 WeakPolarHBondContact O-CB 3.36Å; G276-I280 VanDerWaalsContact O-CG1 3.29Å; G276-I280 WeakPolarHBondContact O-CG1 3.48Å; G276-I280 PolarHBondContact O-N 3.02Å; G276-I280 VanDerWaalsContact O-N 3.07Å
277T91.8Very high89.8Confident0 Ų031.1 Ų31.10%017%0.17CC..Hα-helixtrans-60.4-45.7175.6-58.30000112.2V15 Y65 F96 E273 Q274 M275 I280 L281V15-T277 HydrophobicContact CG1-CG2 4.46Å; Y65-T277 HydrophobicContact CE2-CG2 4.39Å; F96-T277 HydrophobicContact CD1-CG2 4.47Å; F96-T277 HydrophobicContact CE1-CG2 3.92Å; F96-T277 HydrophobicContact CZ-CG2 4Å; E273-T277 PolarHBondContact O-N 2.96Å; E273-T277 PolarHBondContact O-OG1 3.06Å; Q274-T277 WeakPolarHBondContact O-CB 3.43Å; Q274-T277 PolarHBondContact O-N 3.14Å; M275-T277 VanDerWaalsContact C-N 3.33Å; M275-T277 PolarHBondContact O-N 3.35Å; T277-I280 PolarHBondContact O-N 3.43Å; T277-L281 WeakPolarHBondContact O-CB 3.46Å; T277-L281 PolarHBondContact O-N 2.69Å
278I94.5Very high90.5Very high27 Ų2727.6 Ų27.614%0.13815%0.148CC..Hα-helixtrans-57.8-52178-73.1168.5000110.6I11 I14 V15 Q274 M275 G276 I280 L281 F282I11-I278 HydrophobicContact CG2-CD1 3.69Å; I14-I278 HydrophobicContact CG2-CD1 4.21Å; V15-I278 HydrophobicContact CG2-CD1 3.99Å; V15-I278 HydrophobicContact CG2-CG1 3.4Å; Q274-I278 WeakPolarHBondContact O-CG1 3.47Å; Q274-I278 PolarHBondContact O-N 3.38Å; M275-I278 PolarHBondContact O-N 2.9Å; G276-I278 PolarHBondContact O-N 3.18Å; I278-I280 VanDerWaalsContact C-N 3.35Å; I278-I280 PolarHBondContact O-N 2.97Å; I278-L281 PolarHBondContact O-N 2.86Å; I278-F282 PolarHBondContact O-N 2.72Å
279L96.2Very high91.4Very high39 Ų3926.2 Ų26.220%0.20415%0.147CC..Hα-helixtrans-62.5-41.9-177.3-69.3174.3000112.2L248 F251 M275 G276 F282 G283L248-L279 HydrophobicContact CB-CB 4.43Å; L248-L279 WeakPolarHBondContact CB-O 3.41Å; L248-L279 WeakPolarHBondContact CD1-O 3.35Å; L248-L279 HydrophobicContact CD2-CB 4.24Å; L248-L279 HydrophobicContact CD2-CD2 4.04Å; F251-L279 HydrophobicContact CB-CD1 3.5Å; F251-L279 HydrophobicContact CD1-CD1 4.14Å; F251-L279 HydrophobicContact CD2-CD1 4.34Å; F251-L279 HydrophobicContact CG-CD1 3.73Å; M275-L279 HydrophobicContact CE-CD1 4.11Å; M275-L279 HydrophobicContact CE-CD2 4.04Å; M275-L279 HydrophobicContact CE-CG 4.04Å; M275-L279 HydrophobicContact CG-CD1 4.41Å; M275-L279 WeakPolarHBondContact O-CG 3.41Å; M275-L279 PolarHBondContact O-N 3.48Å; G276-L279 PolarHBondContact O-N 3.19Å; L279-F282 WeakPolarHBondContact O-CB 3.29Å; L279-F282 PolarHBondContact O-N 3.18Å; L279-G283 PolarHBondContact O-N 2.97Å
280I96.1Very high92.3Very high1 Ų126.4 Ų26.41%0.00514%0.144CC..Hα-helixtrans-64.5-44176.5-69.1172.6000110.7F96 W97 C100 E252 G276 T277 I278 F282 G283 C284F96-I280 HydrophobicContact CE2-CG2 4.49Å; F96-I280 HydrophobicContact CZ-CB 4.3Å; F96-I280 HydrophobicContact CZ-CG2 3.76Å; W97-I280 HydrophobicContact CH2-CD1 3.88Å; W97-I280 HydrophobicContact CZ3-CD1 3.84Å; C100-I280 WeakPolarHBondContact SG-CG2 3.41Å; E252-I280 HydrophobicContact CB-CD1 4.24Å; E252-I280 HydrophobicContact CG-CD1 4.42Å; G276-I280 WeakPolarHBondContact O-CB 3.36Å; G276-I280 VanDerWaalsContact O-CG1 3.29Å; G276-I280 WeakPolarHBondContact O-CG1 3.48Å; G276-I280 PolarHBondContact O-N 3.02Å; G276-I280 VanDerWaalsContact O-N 3.07Å; T277-I280 PolarHBondContact O-N 3.43Å; I278-I280 VanDerWaalsContact C-N 3.35Å; I278-I280 PolarHBondContact O-N 2.97Å; I280-F282 VanDerWaalsContact C-N 3.28Å; I280-F282 PolarHBondContact O-N 3.37Å; I280-G283 WeakPolarHBondContact O-CA 3.19Å; I280-G283 PolarHBondContact O-N 3.42Å; I280-C284 PolarHBondContact O-N 3.45Å
281L96.2Very high92.8Very high0 Ų024.6 Ų24.60%013%0.133CC..Hα-helixtrans-63.3-35.4179.4-171.764.6000112.1V15 E18 C58 A61 F96 T277 I278 G283 C284 S285V15-L281 HydrophobicContact CG1-CD2 3.83Å; V15-L281 WeakPolarHBondContact O-CD2 3.29Å; E18-L281 HydrophobicContact CB-CD2 3.95Å; E18-L281 HydrophobicContact CB-CG 4.48Å; E18-L281 HydrophobicContact CG-CB 4.48Å; E18-L281 HydrophobicContact CG-CD2 3.89Å; E18-L281 HydrophobicContact CG-CG 3.9Å; C58-L281 HydrophobicContact CB-CD1 4.12Å; A61-L281 HydrophobicContact CB-CD1 4.13Å; A61-L281 HydrophobicContact CB-CD2 4.4Å; F96-L281 HydrophobicContact CE2-CD1 4.29Å; T277-L281 WeakPolarHBondContact O-CB 3.46Å; T277-L281 PolarHBondContact O-N 2.69Å; I278-L281 PolarHBondContact O-N 2.86Å; L281-G283 PolarHBondContact O-N 2.88Å; L281-C284 PolarHBondContact O-N 3.23Å; L281-S285 VanDerWaalsContact O-CB 3.32Å; L281-S285 WeakPolarHBondContact O-CB 3.44Å; L281-S285 PolarHBondContact O-N 3.36Å; L281-S285 PolarHBondContact O-OG 2.96Å
282F97Very high93.3Very high111 Ų11122 Ų2249%0.48712%0.116SC..Hα-helixtrans-58.8-40.6171.5-173.5-109000111E18 L248 I278 L279 I280 S285 S286E18-F282 WeakPolarHBondContact OE1-CA 3.47Å; E18-F282 WeakPolarHBondContact OE1-CB 3.49Å; E18-F282 PolarHBondContact OE1-N 3.2Å; L248-F282 HydrophobicContact CD1-CB 4.5Å; L248-F282 HydrophobicContact CD1-CD1 3.91Å; L248-F282 HydrophobicContact CD2-CD1 4.12Å; I278-F282 PolarHBondContact O-N 2.72Å; L279-F282 WeakPolarHBondContact O-CB 3.29Å; L279-F282 PolarHBondContact O-N 3.18Å; I280-F282 VanDerWaalsContact C-N 3.28Å; I280-F282 PolarHBondContact O-N 3.37Å; F282-S285 PolarHBondContact O-N 2.9Å; F282-S286 WeakPolarHBondContact O-CB 3.22Å; F282-S286 PolarHBondContact O-N 3.44Å; F282-S286 PolarHBondContact O-OG 3.48Å
283G96.5Very high93.8Very high7 Ų724.2 Ų24.27%0.07212%0.122CC..Hα-helixtrans-59.6-56.117500000112.1Q244 L279 I280 L281 S285 S286 N287Q244-G283 PolarHBondContact NE2-O 3.25Å; L279-G283 PolarHBondContact O-N 2.97Å; I280-G283 WeakPolarHBondContact O-CA 3.19Å; I280-G283 PolarHBondContact O-N 3.42Å; L281-G283 PolarHBondContact O-N 2.88Å; G283-S285 PolarHBondContact O-N 3.22Å; G283-S286 PolarHBondContact O-N 3.22Å; G283-S286 PolarHBondContact O-OG 3.26Å; G283-S286 VanDerWaalsContact O-OG 3.06Å; G283-N287 PolarHBondContact O-N 2.88Å; G283-N287 PolarHBondContact O-OD1 3.4Å
284C97.2Very high94.2Very high6 Ų625.2 Ų25.24%0.04113%0.131CC..Hα-helixtrans-58.5-34.5177.6-67.40000112.7N26 D54 I280 L281 P288N26-C284 PolarHBondContact ND2-O 3.39Å; D54-C284 HydrophobicContact CB-CB 4.14Å; D54-C284 PolarHBondContact OD1-SG 2.89Å; D54-C284 VanDerWaalsContact OD1-SG 3.33Å; I280-C284 PolarHBondContact O-N 3.45Å; L281-C284 PolarHBondContact O-N 3.23Å; C284-P288 VanDerWaalsContact O-CD 3.29Å; C284-P288 WeakPolarHBondContact O-CD 3.31Å
285S96.4Very high94.3Very high8 Ų825.2 Ų25.26%0.05613%0.131CC..Hα-helixtrans-74.3-32.9180-57.50000112.9G22 L281 F282 G283 P288G22-S285 VanDerWaalsContact CA-OG 3.25Å; G22-S285 WeakPolarHBondContact CA-OG 3.29Å; L281-S285 VanDerWaalsContact O-CB 3.32Å; L281-S285 WeakPolarHBondContact O-CB 3.44Å; L281-S285 PolarHBondContact O-N 3.36Å; L281-S285 PolarHBondContact O-OG 2.96Å; F282-S285 PolarHBondContact O-N 2.9Å; G283-S285 PolarHBondContact O-N 3.22Å; S285-P288 WeakPolarHBondContact O-CD 3.48Å; S285-P288 WeakPolarHBondContact O-CG 3.3Å
286S96.4Very high94.3Very high19 Ų1923 Ų2313%0.13312%0.122CC..Hα-helixtrans-91-24.3-176.552.30000113.8Q244 F282 G283 C289 I290Q244-S286 PolarHBondContact NE2-OG 3.35Å; Q244-S286 PolarHBondContact OE1-OG 3.23Å; Q244-S286 VanDerWaalsContact OE1-OG 3.12Å; F282-S286 WeakPolarHBondContact O-CB 3.22Å; F282-S286 PolarHBondContact O-N 3.44Å; F282-S286 PolarHBondContact O-OG 3.48Å; G283-S286 PolarHBondContact O-N 3.22Å; G283-S286 PolarHBondContact O-OG 3.26Å; G283-S286 VanDerWaalsContact O-OG 3.06Å; S286-C289 WeakPolarHBondContact O-CA 3.4Å; S286-C289 WeakPolarHBondContact O-CB 3.4Å; S286-C289 PolarHBondContact O-N 3.28Å; S286-I290 WeakPolarHBondContact O-CG1 3.37Å; S286-I290 PolarHBondContact O-N 2.9Å
287N95.5Very high94.2Very high8 Ų825.7 Ų25.74%0.04314%0.138CC..Hα-helixtrans-45.4-52.5172.5-80.2-10.2000114.9D54 M241 Q244 G283 C289 I290 L291D54-N287 WeakPolarHBondContact OD2-CB 3.33Å; D54-N287 PolarHBondContact OD2-ND2 2.79Å; M241-N287 HydrophobicContact CE-CB 3.89Å; Q244-N287 PolarHBondContact NE2-OD1 3.11Å; G283-N287 PolarHBondContact O-N 2.88Å; G283-N287 PolarHBondContact O-OD1 3.4Å; N287-C289 VanDerWaalsContact C-N 3.28Å; N287-C289 PolarHBondContact O-N 3.24Å; N287-I290 PolarHBondContact O-N 2.84Å; N287-L291 WeakPolarHBondContact O-CB 3.09Å; N287-L291 PolarHBondContact O-N 3.42Å
288P93.5Very high94.2Very high2 Ų225.7 Ų25.71%0.01314%0.139CC..Hα-helixtrans-60.4-37.6177.923-35.9000112.7F25 N26 A29 C284 S285 L291 I292F25-P288 HydrophobicContact CB-CB 4.5Å; F25-P288 HydrophobicContact CB-CG 3.78Å; N26-P288 WeakPolarHBondContact OD1-CD 3.49Å; N26-P288 WeakPolarHBondContact OD1-CG 3.35Å; A29-P288 HydrophobicContact CB-CB 3.48Å; A29-P288 VanDerWaalsContact CB-CB 3.48Å; C284-P288 VanDerWaalsContact O-CD 3.29Å; C284-P288 WeakPolarHBondContact O-CD 3.31Å; S285-P288 WeakPolarHBondContact O-CD 3.48Å; S285-P288 WeakPolarHBondContact O-CG 3.3Å; P288-L291 PolarHBondContact O-N 3.27Å; P288-I292 WeakPolarHBondContact O-CB 3.42Å; P288-I292 WeakPolarHBondContact O-CD1 3.43Å; P288-I292 VanDerWaalsContact O-CG1 3.24Å; P288-I292 WeakPolarHBondContact O-CG1 2.86Å; P288-I292 PolarHBondContact O-N 3.44Å
289C94.9Very high94.1Very high34 Ų3429.3 Ų29.323%0.2315%0.15CC..Hα-helixtrans-65.1-49.1176.8-64.40000110.7S286 N287 L291 I292 F293S286-C289 WeakPolarHBondContact O-CA 3.4Å; S286-C289 WeakPolarHBondContact O-CB 3.4Å; S286-C289 PolarHBondContact O-N 3.28Å; N287-C289 VanDerWaalsContact C-N 3.28Å; N287-C289 PolarHBondContact O-N 3.24Å; C289-L291 VanDerWaalsContact C-N 3.28Å; C289-L291 PolarHBondContact O-N 2.79Å; C289-I292 PolarHBondContact O-N 3.26Å; C289-F293 HydrophobicContact CB-CD2 4.14Å; C289-F293 HydrophobicContact CB-CE2 4.23Å; C289-F293 WeakPolarHBondContact O-CB 3.4Å; C289-F293 WeakPolarHBondContact O-CD2 3.17Å; C289-F293 PolarHBondContact O-N 2.92Å
290I95.1Very high93.9Very high22 Ų2234.2 Ų34.211%0.11317%0.17CC..Hα-helixtrans-55.3-48.1176.2-68162.9000110.1T237 I240 M241 S286 N287 S294T237-I290 HydrophobicContact CG2-CG2 4.08Å; I240-I290 HydrophobicContact CB-CG2 4.04Å; I240-I290 HydrophobicContact CG2-CD1 3.91Å; I240-I290 HydrophobicContact CG2-CG1 4.16Å; I240-I290 HydrophobicContact CG2-CG2 3.77Å; M241-I290 HydrophobicContact CG-CB 4.25Å; M241-I290 HydrophobicContact CG-CD1 4.44Å; M241-I290 HydrophobicContact CG-CG2 3.76Å; S286-I290 WeakPolarHBondContact O-CG1 3.37Å; S286-I290 PolarHBondContact O-N 2.9Å; N287-I290 PolarHBondContact O-N 2.84Å; I290-S294 WeakPolarHBondContact O-CB 3.31Å; I290-S294 PolarHBondContact O-N 2.85Å; I290-S294 PolarHBondContact O-OG 2.91Å
291L94.1Very high93.8Very high2 Ų237.7 Ų37.71%0.0118%0.184CC..Hα-helixtrans-60.7-50.6-178.7-179.355.3000112.6I33 L47 T237 N287 P288 C289 T295 L298I33-L291 HydrophobicContact CD1-CD2 3.43Å; I33-L291 VanDerWaalsContact CD1-CD2 3.43Å; I33-L291 HydrophobicContact CD1-CG 4.37Å; I33-L291 HydrophobicContact CG1-CD2 4.4Å; L47-L291 HydrophobicContact CD1-CD1 4.47Å; L47-L291 HydrophobicContact CD2-CD1 3.96Å; L47-L291 HydrophobicContact CD2-CD2 4.27Å; T237-L291 HydrophobicContact CG2-CB 4.37Å; T237-L291 HydrophobicContact CG2-CD1 3.88Å; N287-L291 WeakPolarHBondContact O-CB 3.09Å; N287-L291 PolarHBondContact O-N 3.42Å; P288-L291 PolarHBondContact O-N 3.27Å; C289-L291 VanDerWaalsContact C-N 3.28Å; C289-L291 PolarHBondContact O-N 2.79Å; L291-T295 VanDerWaalsContact O-CB 3.28Å; L291-T295 WeakPolarHBondContact O-CB 3.46Å; L291-T295 PolarHBondContact O-N 3.36Å; L291-T295 PolarHBondContact O-OG1 2.79Å; L291-L298 HydrophobicContact CD1-CD1 4.03Å; L291-L298 HydrophobicContact CG-CD1 3.77Å
292I93.1Very high93.6Very high9 Ų939.2 Ų39.25%0.04619%0.192CC..Hα-helixtrans-66.8-47.8-178.1-67.6164.5000111.2A29 I32 P288 C289 T295 L298 R299 L302A29-I292 HydrophobicContact CB-CD1 4.02Å; I32-I292 HydrophobicContact CD1-CD1 3.72Å; I32-I292 HydrophobicContact CD1-CG1 4.27Å; P288-I292 WeakPolarHBondContact O-CB 3.42Å; P288-I292 WeakPolarHBondContact O-CD1 3.43Å; P288-I292 VanDerWaalsContact O-CG1 3.24Å; P288-I292 WeakPolarHBondContact O-CG1 2.86Å; P288-I292 PolarHBondContact O-N 3.44Å; C289-I292 PolarHBondContact O-N 3.26Å; I292-T295 VanDerWaalsContact O-O 3.11Å; I292-L298 HydrophobicContact CG2-CB 4.41Å; I292-R299 PolarHBondContact O-N 2.98Å; I292-L302 HydrophobicContact CG2-CB 4.39Å; I292-L302 HydrophobicContact CG2-CD2 3.8Å
293F92.9Very high93.4Very high120 Ų12038.2 Ų38.253%0.52619%0.191SC..Hα-helixtrans-75-30-173.1-70.9-61.9000113.2C289 R299C289-F293 HydrophobicContact CB-CD2 4.14Å; C289-F293 HydrophobicContact CB-CE2 4.23Å; C289-F293 WeakPolarHBondContact O-CB 3.4Å; C289-F293 WeakPolarHBondContact O-CD2 3.17Å; C289-F293 PolarHBondContact O-N 2.92Å; F293-R299 PolarHBondContact O-NH1 3.37Å
294S91.4Very high93.2Very high34 Ų3441.4 Ų41.424%0.23821%0.212CC..Hα-helixtrans-80.6-23.6178.3-54.70000112.8T237 I290T237-S294 WeakPolarHBondContact OG1-CB 3.2Å; I290-S294 WeakPolarHBondContact O-CB 3.31Å; I290-S294 PolarHBondContact O-N 2.85Å; I290-S294 PolarHBondContact O-OG 2.91Å
295T90.8Very high92.9Very high1 Ų144.7 Ų44.71%0.00623%0.229CC..  trans-99.7115.5-179.4-52.80000111.5I38 L291 I292 T297 L298 R299I38-T295 HydrophobicContact CD1-CG2 3.92Å; L291-T295 VanDerWaalsContact O-CB 3.28Å; L291-T295 WeakPolarHBondContact O-CB 3.46Å; L291-T295 PolarHBondContact O-N 3.36Å; L291-T295 PolarHBondContact O-OG1 2.79Å; I292-T295 VanDerWaalsContact O-O 3.11Å; T295-T297 VanDerWaalsContact C-N 3.29Å; T295-T297 PolarHBondContact O-N 3.42Å; T295-L298 HydrophobicContact CG2-CB 4.48Å; T295-L298 HydrophobicContact CG2-CD1 4.21Å; T295-L298 HydrophobicContact CG2-CG 3.98Å; T295-L298 PolarHBondContact O-N 3.49Å; T295-R299 PolarHBondContact O-N 3.36Å
296T89.4Confident92.6Very high32 Ų3249 Ų4920%0.19625%0.25CS..Hα-helixtrans-59.9-38.4-174.3-63.20000112.9Q233 K300Q233-T296 PolarHBondContact NE2-OG1 2.88Å; Q233-T296 PolarHBondContact OE1-OG1 3.18Å; T296-K300 HydrophobicContact CG2-CD 4.05Å; T296-K300 HydrophobicContact CG2-CG 4.31Å; T296-K300 WeakPolarHBondContact O-CB 3.25Å; T296-K300 VanDerWaalsContact O-CG 3.3Å; T296-K300 WeakPolarHBondContact O-CG 3.21Å; T296-K300 PolarHBondContact O-N 2.78Å
297T89.3Confident92.4Very high57 Ų5754.9 Ų54.935%0.3527%0.274SS..Hα-helixtrans-65.1-45.1-179.9-47.50000111.7V36 I38 T295 K300 Y301V36-T297 HydrophobicContact CG1-CG2 3.43Å; V36-T297 VanDerWaalsContact CG1-CG2 3.43Å; I38-T297 HydrophobicContact CD1-CG2 4.34Å; I38-T297 HydrophobicContact CG1-CG2 4.09Å; T295-T297 VanDerWaalsContact C-N 3.29Å; T295-T297 PolarHBondContact O-N 3.42Å; T297-K300 PolarHBondContact O-N 2.85Å; T297-Y301 PolarHBondContact O-N 2.6Å; T297-Y301 VanDerWaalsContact O-N 3.09Å
298L91.3Very high91.9Very high1 Ų155.9 Ų55.91%0.00529%0.285CS..Hα-helixtrans-65.4-46.4177.7-62179000110.8I32 I33 V36 I38 L291 I292 T295 K300 Y301 L302I32-L298 HydrophobicContact CG2-CB 4.15Å; I32-L298 HydrophobicContact CG2-CD2 3.64Å; I32-L298 HydrophobicContact CG2-CG 4.47Å; I33-L298 HydrophobicContact CG1-CD1 4.22Å; I33-L298 HydrophobicContact CG1-CD2 4.02Å; V36-L298 HydrophobicContact CB-CD2 4.1Å; V36-L298 HydrophobicContact CG1-CD2 4.17Å; V36-L298 HydrophobicContact CG2-CD2 4.37Å; I38-L298 HydrophobicContact CD1-CD1 4.18Å; I38-L298 HydrophobicContact CD1-CD2 3.37Å; I38-L298 HydrophobicContact CD1-CG 3.47Å; I38-L298 VanDerWaalsContact CD1-CG 3.47Å; L291-L298 HydrophobicContact CD1-CD1 4.03Å; L291-L298 HydrophobicContact CG-CD1 3.77Å; I292-L298 HydrophobicContact CG2-CB 4.41Å; T295-L298 HydrophobicContact CG2-CB 4.48Å; T295-L298 HydrophobicContact CG2-CD1 4.21Å; T295-L298 HydrophobicContact CG2-CG 3.98Å; T295-L298 PolarHBondContact O-N 3.49Å; L298-K300 PolarHBondContact O-N 2.65Å; L298-Y301 PolarHBondContact O-N 2.86Å; L298-Y301 VanDerWaalsContact O-N 3.16Å; L298-L302 PolarHBondContact O-N 2.99Å
299R93.2Very high91.4Very high102 Ų10263.6 Ų63.639%0.38532%0.319SS..Hα-helixtrans-57.8-45.5176.9-172.1171.965.8-147.86.9112.5I292 F293 T295 Y301 L302 L303I292-R299 PolarHBondContact O-N 2.98Å; F293-R299 PolarHBondContact O-NH1 3.37Å; T295-R299 PolarHBondContact O-N 3.36Å; R299-Y301 VanDerWaalsContact C-N 3.32Å; R299-Y301 PolarHBondContact O-N 3.34Å; R299-L302 PolarHBondContact O-N 2.83Å; R299-L303 HydrophobicContact CG-CD1 4.32Å; R299-L303 WeakPolarHBondContact O-CG 3.45Å; R299-L303 PolarHBondContact O-N 2.85Å
300K92.5Very high90.9Very high143 Ų14369.7 Ų69.762%0.62234%0.342SS*.Hα-helixtrans-62.1-40.5177.1-78.3-179.1177.1-1740111.7T296 T297 L298 L303 S304T296-K300 HydrophobicContact CG2-CD 4.05Å; T296-K300 HydrophobicContact CG2-CG 4.31Å; T296-K300 WeakPolarHBondContact O-CB 3.25Å; T296-K300 VanDerWaalsContact O-CG 3.3Å; T296-K300 WeakPolarHBondContact O-CG 3.21Å; T296-K300 PolarHBondContact O-N 2.78Å; T297-K300 PolarHBondContact O-N 2.85Å; L298-K300 PolarHBondContact O-N 2.65Å; K300-L303 PolarHBondContact O-N 3.08Å; K300-S304 PolarHBondContact O-N 2.78Å
301Y92.4Very high90.2Very high73 Ų7374.9 Ų74.929%0.28637%0.365SS..Hα-helixtrans-66.2-45.5178-169.8-99.5000111.9I32 K35 V36 T297 L298 R299 L303 S304 L305I32-Y301 HydrophobicContact CB-CD1 4.33Å; I32-Y301 HydrophobicContact CG1-CD1 4.23Å; I32-Y301 HydrophobicContact CG2-CD1 3.92Å; K35-Y301 HydrophobicContact CB-CE1 3.85Å; K35-Y301 HydrophobicContact CB-CE2 4.41Å; K35-Y301 WeakPolarHBondContact CB-OH 3.45Å; K35-Y301 HydrophobicContact CG-CE1 4.43Å; V36-Y301 HydrophobicContact CG2-CD1 4.05Å; V36-Y301 HydrophobicContact CG2-CD2 3.98Å; V36-Y301 HydrophobicContact CG2-CG 3.68Å; T297-Y301 PolarHBondContact O-N 2.6Å; T297-Y301 VanDerWaalsContact O-N 3.09Å; L298-Y301 PolarHBondContact O-N 2.86Å; L298-Y301 VanDerWaalsContact O-N 3.16Å; R299-Y301 VanDerWaalsContact C-N 3.32Å; R299-Y301 PolarHBondContact O-N 3.34Å; Y301-L303 VanDerWaalsContact C-N 3.34Å; Y301-L303 PolarHBondContact O-N 3.41Å; Y301-S304 WeakPolarHBondContact O-CB 3.4Å; Y301-S304 PolarHBondContact O-N 2.99Å; Y301-S304 VanDerWaalsContact O-N 3.11Å; Y301-L305 HydrophobicContact CD1-CD1 3.92Å; Y301-L305 HydrophobicContact CD1-CG 4.21Å; Y301-L305 HydrophobicContact CE1-CD1 3.62Å; Y301-L305 HydrophobicContact CE1-CD2 4.2Å; Y301-L305 HydrophobicContact CE1-CG 3.94Å; Y301-L305 PolarHBondContact O-N 2.97Å
302L92.9Very high89.5Confident33 Ų3379.9 Ų79.917%0.17339%0.392CS..Hα-helixtrans-56.6-47.3174.1174.859.5000111.6I32 I292 L298 R299 S304 L305 I306I32-L302 HydrophobicContact CD1-CB 4Å; I32-L302 HydrophobicContact CD1-CD1 4.03Å; I32-L302 HydrophobicContact CD1-CG 4.42Å; I292-L302 HydrophobicContact CG2-CB 4.39Å; I292-L302 HydrophobicContact CG2-CD2 3.8Å; L298-L302 PolarHBondContact O-N 2.99Å; R299-L302 PolarHBondContact O-N 2.83Å; L302-S304 VanDerWaalsContact C-N 3.27Å; L302-S304 PolarHBondContact O-N 3.31Å; L302-L305 PolarHBondContact O-N 2.87Å; L302-I306 HydrophobicContact CD1-CD1 3.88Å; L302-I306 HydrophobicContact CD1-CG1 4.18Å; L302-I306 HydrophobicContact CG-CD1 3.89Å; L302-I306 WeakPolarHBondContact O-CG1 3.24Å; L302-I306 PolarHBondContact O-N 3.34Å
303L93.4Very high88.9Confident89 Ų8984.3 Ų84.347%0.46642%0.415SS..Hα-helixtrans-61.7-35.7177.4-71172.2000112.4R299 K300 Y301 I306 K307R299-L303 HydrophobicContact CG-CD1 4.32Å; R299-L303 WeakPolarHBondContact O-CG 3.45Å; R299-L303 PolarHBondContact O-N 2.85Å; K300-L303 PolarHBondContact O-N 3.08Å; Y301-L303 VanDerWaalsContact C-N 3.34Å; Y301-L303 PolarHBondContact O-N 3.41Å; L303-I306 PolarHBondContact O-N 3.38Å; L303-K307 WeakPolarHBondContact O-CB 3.32Å; L303-K307 VanDerWaalsContact O-CG 3.29Å; L303-K307 WeakPolarHBondContact O-CG 3.39Å; L303-K307 PolarHBondContact O-N 3.1Å
304S92Very high88.2Confident74 Ų7481.3 Ų81.352%0.51741%0.409SS..Hα-helixtrans-63.6-45.3174.4-171.20000111.7K300 Y301 L302 I306 K307 G308K300-S304 PolarHBondContact O-N 2.78Å; Y301-S304 WeakPolarHBondContact O-CB 3.4Å; Y301-S304 PolarHBondContact O-N 2.99Å; Y301-S304 VanDerWaalsContact O-N 3.11Å; L302-S304 VanDerWaalsContact C-N 3.27Å; L302-S304 PolarHBondContact O-N 3.31Å; S304-I306 PolarHBondContact O-N 3.35Å; S304-K307 PolarHBondContact O-N 3.4Å; S304-G308 PolarHBondContact O-N 3.06Å
305L90.6Very high87.6Confident75 Ų7582.6 Ų82.639%0.39342%0.418SS..Hα-helixtrans-60.7-44.3176.3-68.6177.5000112.1I32 Y301 L302 G308 K309I32-L305 HydrophobicContact CG1-CD1 4.4Å; Y301-L305 HydrophobicContact CD1-CD1 3.92Å; Y301-L305 HydrophobicContact CD1-CG 4.21Å; Y301-L305 HydrophobicContact CE1-CD1 3.62Å; Y301-L305 HydrophobicContact CE1-CD2 4.2Å; Y301-L305 HydrophobicContact CE1-CG 3.94Å; Y301-L305 PolarHBondContact O-N 2.97Å; L302-L305 PolarHBondContact O-N 2.87Å; L305-G308 PolarHBondContact O-N 3.24Å; L305-K309 WeakPolarHBondContact O-CB 3.47Å; L305-K309 PolarHBondContact O-N 3.35Å
306I90.3Very high86.9Confident98 Ų9888.1 Ų88.150%0.50345%0.447SS..Hα-helixtrans-63.5-44.6178.5-65.6167.3000110.4L302 L303 S304 K309 K310L302-I306 HydrophobicContact CD1-CD1 3.88Å; L302-I306 HydrophobicContact CD1-CG1 4.18Å; L302-I306 HydrophobicContact CG-CD1 3.89Å; L302-I306 WeakPolarHBondContact O-CG1 3.24Å; L302-I306 PolarHBondContact O-N 3.34Å; L303-I306 PolarHBondContact O-N 3.38Å; S304-I306 PolarHBondContact O-N 3.35Å; I306-K309 PolarHBondContact O-N 3.35Å; I306-K310 PolarHBondContact O-N 3.06Å
307K90.9Very high86Confident144 Ų14492.6 Ų92.663%0.62647%0.465SS*.Hα-helixtrans-63.9-45.6177.5-76.1179.9179.5-172.10112.3L303 S304 K309 K310 Q311L303-K307 WeakPolarHBondContact O-CB 3.32Å; L303-K307 VanDerWaalsContact O-CG 3.29Å; L303-K307 WeakPolarHBondContact O-CG 3.39Å; L303-K307 PolarHBondContact O-N 3.1Å; S304-K307 PolarHBondContact O-N 3.4Å; K307-K309 VanDerWaalsContact C-N 3.33Å; K307-K309 PolarHBondContact O-N 3.06Å; K307-K310 PolarHBondContact O-N 3.25Å; K307-Q311 WeakPolarHBondContact O-CG 3.28Å; K307-Q311 PolarHBondContact O-N 3.32Å
308G85.9Confident85.2Confident28 Ų2893.8 Ų93.829%0.28947%0.473SS..Hα-helixtrans-60.8-41.3177.300000112.1S304 L305 K310 Q311 N312S304-G308 PolarHBondContact O-N 3.06Å; L305-G308 PolarHBondContact O-N 3.24Å; G308-K310 PolarHBondContact O-N 2.98Å; G308-Q311 PolarHBondContact O-N 3.45Å; G308-N312 PolarHBondContact O-N 2.79Å
309K83.7Confident83.9Confident165 Ų165101.6 Ų101.672%0.71750%0.503SS*.Hα-helixtrans-65.2-39.4175.1-166178.3-178.2-177.30112.3L305 I306 K307 N312 L313L305-K309 WeakPolarHBondContact O-CB 3.47Å; L305-K309 PolarHBondContact O-N 3.35Å; I306-K309 PolarHBondContact O-N 3.35Å; K307-K309 VanDerWaalsContact C-N 3.33Å; K307-K309 PolarHBondContact O-N 3.06Å; K309-N312 PolarHBondContact O-N 3.23Å; K309-L313 PolarHBondContact O-N 3.13Å
310K83.7Confident82.6Confident162 Ų16298.8 Ų98.870%0.70451%0.505SS*.Hα-helixtrans-63.2-40.8176.9-170177.1-179.7179.70111.9I306 K307 G308 L313 S314I306-K310 PolarHBondContact O-N 3.06Å; K307-K310 PolarHBondContact O-N 3.25Å; G308-K310 PolarHBondContact O-N 2.98Å; K310-L313 PolarHBondContact O-N 3.45Å; K310-S314 PolarHBondContact O-N 3.25Å; K310-S314 PolarHBondContact O-OG 3.49Å
311Q81.3Confident81.3Confident131 Ų13198.6 Ų98.661%0.61251%0.507SS*.Hα-helixtrans-66.7-39.2176.4-72.4175.6-25.100112.6K307 G308 S314 S315K307-Q311 WeakPolarHBondContact O-CG 3.28Å; K307-Q311 PolarHBondContact O-N 3.32Å; G308-Q311 PolarHBondContact O-N 3.45Å; Q311-S314 WeakPolarHBondContact CA-OG 3.32Å; Q311-S314 PolarHBondContact O-OG 2.91Å; Q311-S315 PolarHBondContact O-N 3.21Å; Q311-S315 VanDerWaalsContact O-N 3.1Å; Q311-S315 PolarHBondContact O-OG 3.3Å
312N79.5Confident80Confident106 Ų10698.9 Ų98.957%0.56752%0.516SS*.Hα-helixtrans-66.3-38.2174.5-70.7-6000111.8G308 K309 S315 I316G308-N312 PolarHBondContact O-N 2.79Å; K309-N312 PolarHBondContact O-N 3.23Å; N312-S315 WeakPolarHBondContact CA-OG 3.06Å; N312-S315 PolarHBondContact O-N 2.99Å; N312-S315 PolarHBondContact O-OG 3.5Å; N312-I316 VanDerWaalsContact O-CG1 3.31Å; N312-I316 WeakPolarHBondContact O-CG1 3.32Å; N312-I316 PolarHBondContact O-N 2.7Å
313L79.8Confident78.3Confident102 Ų102102.9 Ų102.953%0.53453%0.534SS..Hα-helixtrans-67.2-44.2177.5-167.669000111.8K309 K310 S315 I316 E317K309-L313 PolarHBondContact O-N 3.13Å; K310-L313 PolarHBondContact O-N 3.45Å; L313-S315 VanDerWaalsContact C-N 3.31Å; L313-S315 PolarHBondContact O-N 2.95Å; L313-I316 PolarHBondContact O-N 3Å; L313-E317 PolarHBondContact O-N 3.22Å
314S78.9Confident76.6Confident57 Ų57108.2 Ų108.240%0.39955%0.55SS..Hα-helixtrans-64.6-33.1177.6550000113.3K310 Q311 T318K310-S314 PolarHBondContact O-N 3.25Å; K310-S314 PolarHBondContact O-OG 3.49Å; Q311-S314 WeakPolarHBondContact CA-OG 3.32Å; Q311-S314 PolarHBondContact O-OG 2.91Å; S314-T318 PolarHBondContact O-N 3.38Å; S314-T318 VanDerWaalsContact O-N 3.08Å; S314-T318 PolarHBondContact O-OG1 3.38Å
315S77Confident75.2Confident62 Ų62111.7 Ų111.743%0.43456%0.561SS.*Hα-helixtrans-71.5-35.7176.446.20000112.3Q311 N312 L313 T318 Y319Q311-S315 PolarHBondContact O-N 3.21Å; Q311-S315 VanDerWaalsContact O-N 3.1Å; Q311-S315 PolarHBondContact O-OG 3.3Å; N312-S315 WeakPolarHBondContact CA-OG 3.06Å; N312-S315 PolarHBondContact O-N 2.99Å; N312-S315 PolarHBondContact O-OG 3.5Å; L313-S315 VanDerWaalsContact C-N 3.31Å; L313-S315 PolarHBondContact O-N 2.95Å; S315-T318 PolarHBondContact O-N 3.11Å; S315-Y319 PolarHBondContact O-N 3.22Å
316I77Confident73.5Confident117 Ų117115.7 Ų115.760%0.658%0.578SS**Hα-helixtrans-66.1-44.4173.2-66.3166.3000111.1N312 L313 T318 Y319 G320N312-I316 VanDerWaalsContact O-CG1 3.31Å; N312-I316 WeakPolarHBondContact O-CG1 3.32Å; N312-I316 PolarHBondContact O-N 2.7Å; L313-I316 PolarHBondContact O-N 3Å; I316-T318 VanDerWaalsContact C-N 3.29Å; I316-T318 PolarHBondContact O-N 2.76Å; I316-Y319 PolarHBondContact O-N 3.46Å; I316-G320 PolarHBondContact O-N 3.37Å
317E71.3Confident71.8Confident125 Ų125122.6 Ų122.658%0.58461%0.607SS**Hα-helixtrans-59.8-39.8175.7-75.4176173.800111.9L313 Q321L313-E317 PolarHBondContact O-N 3.22Å; E317-Q321 WeakPolarHBondContact O-CG 3.34Å; E317-Q321 PolarHBondContact O-N 2.99Å; E317-Q321 VanDerWaalsContact O-N 3.08Å
318T71.5Confident70.8Confident83 Ų83121.5 Ų121.551%0.50961%0.606SS.*Hα-helixtrans-67-39176.6-47.50000111.6S314 S315 I316 Q321 T322S314-T318 PolarHBondContact O-N 3.38Å; S314-T318 VanDerWaalsContact O-N 3.08Å; S314-T318 PolarHBondContact O-OG1 3.38Å; S315-T318 PolarHBondContact O-N 3.11Å; I316-T318 VanDerWaalsContact C-N 3.29Å; I316-T318 PolarHBondContact O-N 2.76Å; T318-Q321 PolarHBondContact O-N 3.23Å; T318-T322 PolarHBondContact O-N 3.21Å; T318-T322 VanDerWaalsContact O-N 3.11Å; T318-T322 PolarHBondContact O-OG1 3.07Å
319Y64.9Low70Confident165 Ų165126.4 Ų126.465%0.64762%0.623SS**Hα-helixtrans-67-43.8177.3-141.4-91.7000111.7S315 I316 Q321 T322 E323S315-Y319 PolarHBondContact O-N 3.22Å; I316-Y319 PolarHBondContact O-N 3.46Å; Y319-Q321 VanDerWaalsContact C-N 3.31Å; Y319-Q321 PolarHBondContact O-N 3.49Å; Y319-T322 PolarHBondContact O-N 2.97Å; Y319-E323 PolarHBondContact O-N 3Å; Y319-E323 VanDerWaalsContact O-N 3.08Å
320G64.4Low69.3Low42 Ų42124.3 Ų124.343%0.43362%0.617SS.*Hα-helixtrans-63.6-32.7176.300000113.7I316 Y324I316-G320 PolarHBondContact O-N 3.37Å; G320-Y324 PolarHBondContact O-N 3.45Å
321Q65.8Low68.4Low139 Ų139122.1 Ų122.165%0.6561%0.612SS**Hα-helixtrans-71-32.6171.4-77.2-176.4-17.600113E317 T318 Y319 I325E317-Q321 WeakPolarHBondContact O-CG 3.34Å; E317-Q321 PolarHBondContact O-N 2.99Å; E317-Q321 VanDerWaalsContact O-N 3.08Å; T318-Q321 PolarHBondContact O-N 3.23Å; Y319-Q321 VanDerWaalsContact C-N 3.31Å; Y319-Q321 PolarHBondContact O-N 3.49Å; Q321-I325 WeakPolarHBondContact O-CG1 3.48Å
322T65.2Low67.6Low79 Ų79121.5 Ų121.549%0.48561%0.612SS.*Hα-helixtrans-72-37.9179.9-47.50000111.3T318 Y319 I325T318-T322 PolarHBondContact O-N 3.21Å; T318-T322 VanDerWaalsContact O-N 3.11Å; T318-T322 PolarHBondContact O-OG1 3.07Å; Y319-T322 PolarHBondContact O-N 2.97Å; T322-I325 PolarHBondContact O-N 3.26Å
323E58.2Low66.8Low118 Ų118122.5 Ų122.555%0.55162%0.615SS**Hα-helixtrans-68.2-34.3174.4-76.2-176.6165.800112.7Y319 I325 Q326Y319-E323 PolarHBondContact O-N 3Å; Y319-E323 VanDerWaalsContact O-N 3.08Å; E323-I325 VanDerWaalsContact C-N 3.26Å; E323-I325 PolarHBondContact O-N 3.39Å; E323-Q326 PolarHBondContact O-N 3.11Å
324Y57.4Low65.9Low201 Ų201124 Ų12479%0.78862%0.621SS**Hα-helixtrans-69.6-20.8179.1-156.5-94000113.6G320 Q326G320-Y324 PolarHBondContact O-N 3.45Å; Y324-Q326 VanDerWaalsContact C-N 3.32Å
325I61.5Low64.9Low146 Ų146129.2 Ų129.275%0.74964%0.638SS**THydrogen-bonded Turntrans-82.7-11.2178-64.8167.2000111.7Q321 T322 E323Q321-I325 WeakPolarHBondContact O-CG1 3.48Å; T322-I325 PolarHBondContact O-N 3.26Å; E323-I325 VanDerWaalsContact C-N 3.26Å; E323-I325 PolarHBondContact O-N 3.39Å
326Q56.5Low63.9Low160 Ų160134.8 Ų134.875%0.74866%0.655SS**THydrogen-bonded Turntrans-96.53.9-177.8-72.4-171.2-36.400115.1E323 Y324E323-Q326 PolarHBondContact O-N 3.11Å; Y324-Q326 VanDerWaalsContact C-N 3.32Å
327H53.3Low62.7Low242 Ų242136.4 Ų136.4100%1.1266%0.66SS**  trans-116.90175.5-82.7-63.5000112.1

Retrieved 327 of 327 residues in 845.7 ms (Link to these results)

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