A0A3B3VYA5_9TELE Loading...

Potassium channel subfamily K member

AlphaFold DB , UniProt , Accession A0A3B3VYA5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 400 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M68.7Low86.3Confident183 Ų18389.5 Ų89.590%0.90145%0.447SS*.  01360-155.2-178.4-82.400107.7N5 V6M1-N5 HydrophobicContact CG-CB 4.07Å; M1-V6 HydrophobicContact CB-CG2 3.88Å; M1-V6 HydrophobicContact CG-CG2 4.12Å; M1-V6 HydrophobicContact SD-CG2 4Å
2K82.7Confident87.1Confident107 Ų10788.6 Ų88.647%0.46544%0.443SS..  trans-60144.1-179.2-69.9-176179.6179.10110.4Q4 N5 V6K2-Q4 PolarHBondContact O-N 2.77Å; K2-N5 HydrophobicContact CB-CB 4.5Å; K2-N5 PolarHBondContact O-N 2.96Å; K2-V6 PolarHBondContact O-N 3.2Å
3R81.9Confident87.9Confident203 Ų20389 Ų8977%0.76645%0.446SS*.Hα-helixtrans-55.6-34.8-179.9-169177.3-179.9-178-0.1112.4R7R3-R7 WeakPolarHBondContact O-CB 3.36Å; R3-R7 PolarHBondContact O-N 3.32Å
4Q79.1Confident88.6Confident18 Ų1888.5 Ų88.58%0.08445%0.454CS..Hα-helixtrans-62.3-51172.6-71.8144.37.300112.4K2 V6 R7 T8 D253 E254 D257K2-Q4 PolarHBondContact O-N 2.77Å; Q4-V6 VanDerWaalsContact C-N 3.26Å; Q4-V6 PolarHBondContact O-N 2.97Å; Q4-R7 PolarHBondContact O-N 2.81Å; Q4-R7 VanDerWaalsContact O-N 3.11Å; Q4-T8 PolarHBondContact O-N 3.05Å; Q4-T8 PolarHBondContact O-OG1 3.43Å; Q4-T8 VanDerWaalsContact O-OG1 3.11Å; Q4-D253 HydrophobicContact CG-CB 4.5Å; Q4-D253 VanDerWaalsContact NE2-C 3.28Å; Q4-D253 PolarHBondContact NE2-O 3.35Å; Q4-E254 HydrophobicContact CG-CG 4.44Å; Q4-E254 VanDerWaalsContact NE2-CA 3.28Å; Q4-D257 PolarHBondContact NE2-OD2 3.37Å
5N88.3Confident89.1Confident88 Ų8888 Ų8847%0.47146%0.456SS..Hα-helixtrans-60.5-39.2179.7-63.65000111.1M1 K2 L9M1-N5 HydrophobicContact CG-CB 4.07Å; K2-N5 HydrophobicContact CB-CB 4.5Å; K2-N5 PolarHBondContact O-N 2.96Å; N5-L9 VanDerWaalsContact O-CB 3.25Å; N5-L9 WeakPolarHBondContact O-CB 3.49Å; N5-L9 PolarHBondContact O-N 3.34Å
6V90.8Very high89.6Confident75 Ų7590.7 Ų90.746%0.45546%0.464SS..Hα-helixtrans-63.9-46.1174.8177.50000110.9M1 K2 Q4 L9 A10M1-V6 HydrophobicContact CB-CG2 3.88Å; M1-V6 HydrophobicContact CG-CG2 4.12Å; M1-V6 HydrophobicContact SD-CG2 4Å; K2-V6 PolarHBondContact O-N 3.2Å; Q4-V6 VanDerWaalsContact C-N 3.26Å; Q4-V6 PolarHBondContact O-N 2.97Å; V6-L9 PolarHBondContact O-N 3.29Å; V6-A10 VanDerWaalsContact O-CB 3.25Å; V6-A10 WeakPolarHBondContact O-CB 3.44Å; V6-A10 PolarHBondContact O-N 3.45Å
7R88.1Confident90.1Very high38 Ų3889.7 Ų89.714%0.14346%0.463CS..Hα-helixtrans-62-45176.8178.6176.255.7-154-9.8112.1R3 Q4 A10 L11 N250 D253R3-R7 WeakPolarHBondContact O-CB 3.36Å; R3-R7 PolarHBondContact O-N 3.32Å; Q4-R7 PolarHBondContact O-N 2.81Å; Q4-R7 VanDerWaalsContact O-N 3.11Å; R7-A10 PolarHBondContact O-N 3Å; R7-L11 HydrophobicContact CG-CD1 4.24Å; R7-L11 WeakPolarHBondContact O-CG 3.32Å; R7-L11 PolarHBondContact O-N 3.08Å; R7-N250 VanDerWaalsContact CZ-CG 3.44Å; R7-N250 PolarHBondContact NE-OD1 3.4Å; R7-N250 PolarHBondContact NH1-OD1 2.88Å; R7-N250 PolarHBondContact NH2-OD1 2.95Å; R7-D253 IonicContact CZ-OD2 3.39Å; R7-D253 IonicContact NH1-OD2 3.36Å; R7-D253 PolarHBondContact NH1-OD2 3.33Å; R7-D253 IonicContact NH2-OD2 3.16Å; R7-D253 PolarHBondContact NH2-OD2 2.92Å; R7-D253 VanDerWaalsContact NH2-OD2 3.16Å
8T89.3Confident90.5Very high69 Ų6995.2 Ų95.242%0.42348%0.478SS..Hα-helixtrans-64.2-46.1178.6-58.40000111.1Q4 A10 L11 I12Q4-T8 PolarHBondContact O-N 3.05Å; Q4-T8 PolarHBondContact O-OG1 3.43Å; Q4-T8 VanDerWaalsContact O-OG1 3.11Å; T8-A10 VanDerWaalsContact C-N 3.33Å; T8-A10 PolarHBondContact O-N 3.48Å; T8-L11 PolarHBondContact O-N 3.4Å; T8-I12 HydrophobicContact CG2-CD1 4.06Å; T8-I12 VanDerWaalsContact O-CG1 3.32Å; T8-I12 WeakPolarHBondContact O-CG1 3.36Å; T8-I12 PolarHBondContact O-N 3.41Å
9L93.8Very high90.9Very high86 Ų8695.8 Ų95.845%0.4548%0.483SS..Hα-helixtrans-62-42176.3-175.365.3000111.5N5 V6 I12 I13N5-L9 VanDerWaalsContact O-CB 3.25Å; N5-L9 WeakPolarHBondContact O-CB 3.49Å; N5-L9 PolarHBondContact O-N 3.34Å; V6-L9 PolarHBondContact O-N 3.29Å; L9-I12 PolarHBondContact O-N 3.42Å; L9-I13 HydrophobicContact CD1-CD1 4.27Å; L9-I13 HydrophobicContact CG-CD1 3.93Å; L9-I13 WeakPolarHBondContact O-CG1 3.31Å; L9-I13 PolarHBondContact O-N 3.27Å
10A94.1Very high91.3Very high45 Ų4597 Ų9737%0.37249%0.489SS..Hα-helixtrans-60.9-44.2175.100000111.9V6 R7 T8 I12 I13 C14V6-A10 VanDerWaalsContact O-CB 3.25Å; V6-A10 WeakPolarHBondContact O-CB 3.44Å; V6-A10 PolarHBondContact O-N 3.45Å; R7-A10 PolarHBondContact O-N 3Å; T8-A10 VanDerWaalsContact C-N 3.33Å; T8-A10 PolarHBondContact O-N 3.48Å; A10-I12 VanDerWaalsContact C-N 3.35Å; A10-I12 PolarHBondContact O-N 3.01Å; A10-I13 PolarHBondContact O-N 3.05Å; A10-C14 VanDerWaalsContact O-CB 3.32Å; A10-C14 WeakPolarHBondContact O-CB 3.46Å; A10-C14 PolarHBondContact O-N 3.06Å; A10-C14 PolarHBondContact O-SG 2.83Å
11L92.8Very high91.7Very high73 Ų7396.1 Ų96.138%0.38249%0.489SS..Hα-helixtrans-62.1-40.8175.7-73.4169.5000112.2R7 T8 T15 F246R7-L11 HydrophobicContact CG-CD1 4.24Å; R7-L11 WeakPolarHBondContact O-CG 3.32Å; R7-L11 PolarHBondContact O-N 3.08Å; T8-L11 PolarHBondContact O-N 3.4Å; L11-T15 WeakPolarHBondContact O-CB 3.44Å; L11-T15 PolarHBondContact O-N 3.47Å; L11-T15 PolarHBondContact O-OG1 2.86Å; L11-F246 HydrophobicContact CD1-CE1 4.08Å; L11-F246 HydrophobicContact CD1-CZ 4.43Å; L11-F246 HydrophobicContact CD2-CE1 4.33Å; L11-F246 HydrophobicContact CD2-CZ 4.41Å
12I95.6Very high93Very high78 Ų7888.4 Ų88.440%0.446%0.456SS..Hα-helixtrans-61.9-51.3176.4-69.4166.8000110T8 L9 A10 C14 T15 F16T8-I12 HydrophobicContact CG2-CD1 4.06Å; T8-I12 VanDerWaalsContact O-CG1 3.32Å; T8-I12 WeakPolarHBondContact O-CG1 3.36Å; T8-I12 PolarHBondContact O-N 3.41Å; L9-I12 PolarHBondContact O-N 3.42Å; A10-I12 VanDerWaalsContact C-N 3.35Å; A10-I12 PolarHBondContact O-N 3.01Å; I12-C14 PolarHBondContact O-N 3.49Å; I12-T15 PolarHBondContact O-N 3.02Å; I12-F16 HydrophobicContact CG2-CD2 3.65Å; I12-F16 HydrophobicContact CG2-CE2 3.63Å; I12-F16 VanDerWaalsContact O-CD2 3.3Å; I12-F16 WeakPolarHBondContact O-CD2 3.32Å; I12-F16 PolarHBondContact O-N 3.14Å
13I97.6Very high93.8Very high94 Ų9486.2 Ų86.248%0.48246%0.458SS..Hα-helixtrans-60.9-47.3179.9-68168.6000110.7L9 A10 T15 F16 T17L9-I13 HydrophobicContact CD1-CD1 4.27Å; L9-I13 HydrophobicContact CG-CD1 3.93Å; L9-I13 WeakPolarHBondContact O-CG1 3.31Å; L9-I13 PolarHBondContact O-N 3.27Å; A10-I13 PolarHBondContact O-N 3.05Å; I13-T15 VanDerWaalsContact C-N 3.31Å; I13-T15 PolarHBondContact O-N 2.78Å; I13-F16 PolarHBondContact O-N 3.48Å; I13-T17 WeakPolarHBondContact O-CB 3.45Å; I13-T17 PolarHBondContact O-N 2.88Å; I13-T17 PolarHBondContact O-OG1 3.44Å
14C97.1Very high94.6Very high82 Ų8279.4 Ų79.455%0.55445%0.445SS*.Hα-helixtrans-58.3-42.7176.8-72.30000111.8A10 I12 T17 Y18A10-C14 VanDerWaalsContact O-CB 3.32Å; A10-C14 WeakPolarHBondContact O-CB 3.46Å; A10-C14 PolarHBondContact O-N 3.06Å; A10-C14 PolarHBondContact O-SG 2.83Å; I12-C14 PolarHBondContact O-N 3.49Å; C14-T17 PolarHBondContact O-N 3.48Å; C14-Y18 VanDerWaalsContact O-CB 3.31Å; C14-Y18 WeakPolarHBondContact O-CB 3.47Å; C14-Y18 PolarHBondContact O-N 2.92Å
15T96.1Very high95.5Very high81 Ų8182.9 Ų82.950%0.49746%0.463SS..Hα-helixtrans-66.3-45.3179.6-54.30000111.5L11 I12 I13 T17 Y18 L19L11-T15 WeakPolarHBondContact O-CB 3.44Å; L11-T15 PolarHBondContact O-N 3.47Å; L11-T15 PolarHBondContact O-OG1 2.86Å; I12-T15 PolarHBondContact O-N 3.02Å; I13-T15 VanDerWaalsContact C-N 3.31Å; I13-T15 PolarHBondContact O-N 2.78Å; T15-T17 VanDerWaalsContact C-N 3.33Å; T15-T17 PolarHBondContact O-N 3.18Å; T15-Y18 WeakPolarHBondContact O-CB 3.23Å; T15-Y18 PolarHBondContact O-N 3.41Å; T15-L19 WeakPolarHBondContact O-CG 3.46Å; T15-L19 PolarHBondContact O-N 3.22Å
16F97.9Very high95.9Very high131 Ų13185.5 Ų85.558%0.57547%0.47SS*.Hα-helixtrans-61.8-42.3175.2-84.7-69.4000112I12 I13 Y18 L19 I20I12-F16 HydrophobicContact CG2-CD2 3.65Å; I12-F16 HydrophobicContact CG2-CE2 3.63Å; I12-F16 VanDerWaalsContact O-CD2 3.3Å; I12-F16 WeakPolarHBondContact O-CD2 3.32Å; I12-F16 PolarHBondContact O-N 3.14Å; I13-F16 PolarHBondContact O-N 3.48Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 2.86Å; F16-L19 PolarHBondContact O-N 2.87Å; F16-I20 WeakPolarHBondContact O-CG1 3.35Å; F16-I20 PolarHBondContact O-N 3.22Å
17T98.2Very high96.3Very high74 Ų7486.8 Ų86.845%0.45448%0.475SS..Hα-helixtrans-63.8-41.3177.4-45.30000110.9I13 C14 T15 L19 I20 V21I13-T17 WeakPolarHBondContact O-CB 3.45Å; I13-T17 PolarHBondContact O-N 2.88Å; I13-T17 PolarHBondContact O-OG1 3.44Å; C14-T17 PolarHBondContact O-N 3.48Å; T15-T17 VanDerWaalsContact C-N 3.33Å; T15-T17 PolarHBondContact O-N 3.18Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3Å; T17-I20 PolarHBondContact O-N 2.81Å; T17-V21 WeakPolarHBondContact O-CG2 3.4Å; T17-V21 PolarHBondContact O-N 3.01Å
18Y97.6Very high96.8Very high188 Ų18888.9 Ų88.974%0.73750%0.5SS*.Hα-helixtrans-61.1-40.8175.1-172.5-95.3000112.2C14 T15 F16 G22C14-Y18 VanDerWaalsContact O-CB 3.31Å; C14-Y18 WeakPolarHBondContact O-CB 3.47Å; C14-Y18 PolarHBondContact O-N 2.92Å; T15-Y18 WeakPolarHBondContact O-CB 3.23Å; T15-Y18 PolarHBondContact O-N 3.41Å; F16-Y18 VanDerWaalsContact C-N 3.33Å; F16-Y18 PolarHBondContact O-N 2.86Å; Y18-G22 PolarHBondContact O-N 3.42Å
19L98.3Very high97.1Very high107 Ų10791.1 Ų91.156%0.5651%0.509SS*.Hα-helixtrans-64.4-43.3174.6-71.8171.8000112.4T15 F16 T17 G22 A23T15-L19 WeakPolarHBondContact O-CG 3.46Å; T15-L19 PolarHBondContact O-N 3.22Å; F16-L19 PolarHBondContact O-N 2.87Å; T17-L19 VanDerWaalsContact C-N 3.34Å; T17-L19 PolarHBondContact O-N 3Å; L19-G22 PolarHBondContact O-N 3.06Å; L19-A23 WeakPolarHBondContact O-CB 3.46Å; L19-A23 PolarHBondContact O-N 3.37Å
20I98.4Very high97.3Very high119 Ų11992.4 Ų92.461%0.6151%0.513SS*.Hα-helixtrans-63.7-46178.6-68.1165.9000110.7F16 T17 A23 A24F16-I20 WeakPolarHBondContact O-CG1 3.35Å; F16-I20 PolarHBondContact O-N 3.22Å; T17-I20 PolarHBondContact O-N 2.81Å; I20-A23 PolarHBondContact O-N 3.31Å; I20-A24 PolarHBondContact O-N 2.96Å
21V98.4Very high97.4Very high80 Ų8092.4 Ų92.449%0.48551%0.51SS..Hα-helixtrans-62.2-44.5176.6172.30000110.7T17 A24 I25T17-V21 WeakPolarHBondContact O-CG2 3.4Å; T17-V21 PolarHBondContact O-N 3.01Å; V21-A24 PolarHBondContact O-N 2.95Å; V21-I25 HydrophobicContact CG1-CD1 3.82Å; V21-I25 WeakPolarHBondContact O-CG1 3.4Å; V21-I25 PolarHBondContact O-N 3.41Å
22G97.9Very high97.6Very high20 Ų2096.5 Ų96.521%0.20653%0.527CS..Hα-helixtrans-59-46.7175.700000112.5Y18 L19 A24 I25 F26Y18-G22 PolarHBondContact O-N 3.42Å; L19-G22 PolarHBondContact O-N 3.06Å; G22-A24 PolarHBondContact O-N 3.39Å; G22-I25 PolarHBondContact O-N 3.32Å; G22-F26 WeakPolarHBondContact O-CD2 3.3Å; G22-F26 PolarHBondContact O-N 2.63Å
23A98.3Very high97.5Very high61 Ų6198.5 Ų98.550%0.50454%0.535SS..Hα-helixtrans-60.3-44178.100000112.2L19 I20 I25 F26 D27L19-A23 WeakPolarHBondContact O-CB 3.46Å; L19-A23 PolarHBondContact O-N 3.37Å; I20-A23 PolarHBondContact O-N 3.31Å; A23-I25 VanDerWaalsContact C-N 3.34Å; A23-I25 PolarHBondContact O-N 3.1Å; A23-F26 PolarHBondContact O-N 3.12Å; A23-D27 WeakPolarHBondContact O-CB 3.45Å; A23-D27 PolarHBondContact O-N 3.41Å
24A98.3Very high97.4Very high60 Ų60100.4 Ų100.450%0.49654%0.542SS..Hα-helixtrans-64.1-38.5177.300000112.6I20 V21 G22 A28I20-A24 PolarHBondContact O-N 2.96Å; V21-A24 PolarHBondContact O-N 2.95Å; G22-A24 PolarHBondContact O-N 3.39Å; A24-A28 WeakPolarHBondContact O-CB 3.34Å; A24-A28 PolarHBondContact O-N 3.44Å
25I98.3Very high97.4Very high91 Ų9199.9 Ų99.947%0.46754%0.536SS..Hα-helixtrans-69.1-45.2176.9-67.7169.3000110.8V21 G22 A23 A28 L29V21-I25 HydrophobicContact CG1-CD1 3.82Å; V21-I25 WeakPolarHBondContact O-CG1 3.4Å; V21-I25 PolarHBondContact O-N 3.41Å; G22-I25 PolarHBondContact O-N 3.32Å; A23-I25 VanDerWaalsContact C-N 3.34Å; A23-I25 PolarHBondContact O-N 3.1Å; I25-A28 PolarHBondContact O-N 3.02Å; I25-L29 HydrophobicContact CG2-CD1 3.67Å; I25-L29 HydrophobicContact CG2-CG 4.29Å; I25-L29 WeakPolarHBondContact O-CB 3.38Å; I25-L29 VanDerWaalsContact O-CG 3.27Å; I25-L29 WeakPolarHBondContact O-CG 3.36Å; I25-L29 PolarHBondContact O-N 3.28Å
26F98.1Very high97.4Very high143 Ų14399 Ų9963%0.62753%0.531SS*.Hα-helixtrans-64.5-41178.1-75.3-58.5000112.4G22 A23 A28 L29 E30G22-F26 WeakPolarHBondContact O-CD2 3.3Å; G22-F26 PolarHBondContact O-N 2.63Å; A23-F26 PolarHBondContact O-N 3.12Å; F26-A28 VanDerWaalsContact C-N 3.34Å; F26-A28 PolarHBondContact O-N 3.26Å; F26-L29 PolarHBondContact O-N 3.23Å; F26-E30 WeakPolarHBondContact O-CB 2.92Å; F26-E30 PolarHBondContact O-N 3.22Å
27D98.1Very high97.2Very high103 Ų10398.4 Ų98.455%0.55153%0.53SS*.Hα-helixtrans-59.3-46173.1-177.135.3000110.9A23 L29 S31A23-D27 WeakPolarHBondContact O-CB 3.45Å; A23-D27 PolarHBondContact O-N 3.41Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 3.4Å; D27-S31 WeakPolarHBondContact O-CB 3.18Å; D27-S31 PolarHBondContact O-N 3.06Å; D27-S31 VanDerWaalsContact O-N 3.17Å; D27-S31 WeakPolarHBondContact OD1-CB 3.44Å; D27-S31 PolarHBondContact OD1-OG 3.28Å
28A97.8Very high97.1Very high82 Ų82101.1 Ų101.168%0.67854%0.535SS*.Hα-helixtrans-64.8-28.1178.700000114.3A24 I25 F26A24-A28 WeakPolarHBondContact O-CB 3.34Å; A24-A28 PolarHBondContact O-N 3.44Å; I25-A28 PolarHBondContact O-N 3.02Å; F26-A28 VanDerWaalsContact C-N 3.34Å; F26-A28 PolarHBondContact O-N 3.26Å
29L96.9Very high97Very high116 Ų11697.8 Ų97.861%0.60753%0.527SS*.Hα-helixtrans-93.6-38.2-176.7-67.7176.1000113.4I25 F26 D27I25-L29 HydrophobicContact CG2-CD1 3.67Å; I25-L29 HydrophobicContact CG2-CG 4.29Å; I25-L29 WeakPolarHBondContact O-CB 3.38Å; I25-L29 VanDerWaalsContact O-CG 3.27Å; I25-L29 WeakPolarHBondContact O-CG 3.36Å; I25-L29 PolarHBondContact O-N 3.28Å; F26-L29 PolarHBondContact O-N 3.23Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 3.4Å
30E97Very high96.9Very high113 Ų11395 Ų9553%0.52851%0.514SS..Hα-helixtrans-107.6-25.3-167.7-58.7-66.1158.600113.5F26 Q32 E33 E34F26-E30 WeakPolarHBondContact O-CB 2.92Å; F26-E30 PolarHBondContact O-N 3.22Å; E30-Q32 PolarHBondContact O-N 3.48Å; E30-E33 PolarHBondContact O-N 2.87Å; E30-E34 WeakPolarHBondContact O-CB 3.43Å; E30-E34 PolarHBondContact O-N 3.42Å
31S96.7Very high96.8Very high45 Ų4593.8 Ų93.832%0.31551%0.508SS..Hα-helixtrans-63.4-40-170.4-171.30000113.4D27 T35D27-S31 WeakPolarHBondContact O-CB 3.18Å; D27-S31 PolarHBondContact O-N 3.06Å; D27-S31 VanDerWaalsContact O-N 3.17Å; D27-S31 WeakPolarHBondContact OD1-CB 3.44Å; D27-S31 PolarHBondContact OD1-OG 3.28Å; S31-T35 PolarHBondContact O-N 3Å; S31-T35 PolarHBondContact O-OG1 3.44Å
32Q96.1Very high96.6Very high158 Ų15894 Ų9474%0.73851%0.507SS*.Hα-helixtrans-70.1-41.3177.5-1731762500111.8E30 T35 T36E30-Q32 PolarHBondContact O-N 3.48Å; Q32-T35 PolarHBondContact O-N 3.35Å; Q32-T36 WeakPolarHBondContact O-CB 3.36Å; Q32-T36 PolarHBondContact O-N 3.17Å; Q32-T36 PolarHBondContact O-OG1 3.47Å
33E94.4Very high96.4Very high121 Ų12199 Ų9957%0.56553%0.526SS*.Hα-helixtrans-67.8-44.3-179.6-165.964.5-158.200110.5E30 T35 T36 E37E30-E33 PolarHBondContact O-N 2.87Å; E33-T35 PolarHBondContact O-N 2.89Å; E33-T36 PolarHBondContact O-N 2.78Å; E33-E37 WeakPolarHBondContact O-CB 3.4Å; E33-E37 PolarHBondContact O-N 3.25Å
34E95.4Very high96.2Very high134 Ų134103.3 Ų103.363%0.62653%0.529SS*.Hα-helixtrans-57.7-46.2175.8-176.7-173.5-173.200111.6E30 T36 E37 K38E30-E34 WeakPolarHBondContact O-CB 3.43Å; E30-E34 PolarHBondContact O-N 3.42Å; E34-T36 VanDerWaalsContact C-N 3.35Å; E34-T36 PolarHBondContact O-N 3Å; E34-E37 PolarHBondContact O-N 3.38Å; E34-K38 VanDerWaalsContact O-CB 3.23Å; E34-K38 WeakPolarHBondContact O-CB 3.47Å; E34-K38 PolarHBondContact O-N 2.93Å
35T96.4Very high96Very high70 Ų70103.1 Ų103.143%0.42952%0.517SS..Hα-helixtrans-63.6-43.3179.8-56.70000110.9S31 Q32 E33 K38 E39S31-T35 PolarHBondContact O-N 3Å; S31-T35 PolarHBondContact O-OG1 3.44Å; Q32-T35 PolarHBondContact O-N 3.35Å; E33-T35 PolarHBondContact O-N 2.89Å; T35-K38 PolarHBondContact O-N 2.91Å; T35-E39 WeakPolarHBondContact O-CG 3.34Å; T35-E39 PolarHBondContact O-N 3.42Å
36T96.3Very high95.7Very high64 Ų64104.2 Ų104.239%0.39352%0.521SS..Hα-helixtrans-67.6-42.5-180-54.50000111.9Q32 E33 E34 E39 T40Q32-T36 WeakPolarHBondContact O-CB 3.36Å; Q32-T36 PolarHBondContact O-N 3.17Å; Q32-T36 PolarHBondContact O-OG1 3.47Å; E33-T36 PolarHBondContact O-N 2.78Å; E34-T36 VanDerWaalsContact C-N 3.35Å; E34-T36 PolarHBondContact O-N 3Å; T36-E39 PolarHBondContact O-N 3.15Å; T36-T40 WeakPolarHBondContact O-CB 3.44Å; T36-T40 PolarHBondContact O-N 2.94Å; T36-T40 PolarHBondContact O-OG1 3.05Å
37E95Very high95.6Very high118 Ų118103.2 Ų103.255%0.55152%0.518SS*.Hα-helixtrans-63.9-43.8176.6-174.3174.9-161.800110.6E33 E34 T40 L41E33-E37 WeakPolarHBondContact O-CB 3.4Å; E33-E37 PolarHBondContact O-N 3.25Å; E34-E37 PolarHBondContact O-N 3.38Å; E37-T40 WeakPolarHBondContact O-CB 3.12Å; E37-T40 PolarHBondContact O-N 3.45Å; E37-L41 HydrophobicContact CG-CD1 4.13Å; E37-L41 HydrophobicContact CG-CG 4.43Å; E37-L41 WeakPolarHBondContact O-CG 3.27Å; E37-L41 PolarHBondContact O-N 3.36Å
38K95.1Very high95.4Very high131 Ų131102.1 Ų102.157%0.5751%0.511SS*.Hα-helixtrans-59.5-48.7176.4-178.2178.7178.6-179.50112.1E34 T35 T40 L41 D42E34-K38 VanDerWaalsContact O-CB 3.23Å; E34-K38 WeakPolarHBondContact O-CB 3.47Å; E34-K38 PolarHBondContact O-N 2.93Å; T35-K38 PolarHBondContact O-N 2.91Å; K38-T40 VanDerWaalsContact C-N 3.28Å; K38-T40 PolarHBondContact O-N 3.03Å; K38-L41 PolarHBondContact O-N 3.29Å; K38-D42 WeakPolarHBondContact O-CB 3.36Å; K38-D42 PolarHBondContact O-N 2.98Å
39E96.4Very high95.2Very high118 Ų11899 Ų9955%0.55148%0.484SS*.Hα-helixtrans-58.9-41.4176.6-74.1177.7179.100111.5T35 T36 D42 M43T35-E39 WeakPolarHBondContact O-CG 3.34Å; T35-E39 PolarHBondContact O-N 3.42Å; T36-E39 PolarHBondContact O-N 3.15Å; E39-D42 PolarHBondContact O-N 3.36Å; E39-M43 WeakPolarHBondContact O-CG 3.36Å; E39-M43 PolarHBondContact O-N 3.48Å
40T96.3Very high95Very high49 Ų4997.7 Ų97.730%0.30148%0.484SS..Hα-helixtrans-63.5-42.9176.8-59.10000112.1T36 E37 K38 R44T36-T40 WeakPolarHBondContact O-CB 3.44Å; T36-T40 PolarHBondContact O-N 2.94Å; T36-T40 PolarHBondContact O-OG1 3.05Å; E37-T40 WeakPolarHBondContact O-CB 3.12Å; E37-T40 PolarHBondContact O-N 3.45Å; K38-T40 VanDerWaalsContact C-N 3.28Å; K38-T40 PolarHBondContact O-N 3.03Å; T40-R44 WeakPolarHBondContact O-CG 3.28Å; T40-R44 PolarHBondContact O-N 2.97Å
41L94.8Very high95Very high93 Ų9396.7 Ų96.749%0.48749%0.486SS..Hα-helixtrans-68.4-39.5177.6-71.5175.3000111.9E37 K38 R44 K45E37-L41 HydrophobicContact CG-CD1 4.13Å; E37-L41 HydrophobicContact CG-CG 4.43Å; E37-L41 WeakPolarHBondContact O-CG 3.27Å; E37-L41 PolarHBondContact O-N 3.36Å; K38-L41 PolarHBondContact O-N 3.29Å; L41-R44 PolarHBondContact O-N 3.26Å; L41-K45 WeakPolarHBondContact O-CB 3.38Å; L41-K45 PolarHBondContact O-N 2.86Å
42D94.3Very high94.8Very high84 Ų84101.1 Ų101.145%0.44950%0.5SS..Hα-helixtrans-64.7-40.8176.1-79.3-23.6000111.3K38 E39 K45 Q46K38-D42 WeakPolarHBondContact O-CB 3.36Å; K38-D42 PolarHBondContact O-N 2.98Å; E39-D42 PolarHBondContact O-N 3.36Å; D42-K45 WeakPolarHBondContact O-CB 3.37Å; D42-K45 PolarHBondContact O-N 2.86Å; D42-Q46 WeakPolarHBondContact O-CG 3.3Å; D42-Q46 PolarHBondContact O-N 3.17Å
43M95.2Very high94.8Very high125 Ų125100.9 Ų100.962%0.61650%0.503SS*.Hα-helixtrans-60.7-47.5172.6-74.7-169.1-65.200111.9E39 K45 Q46 E47E39-M43 WeakPolarHBondContact O-CG 3.36Å; E39-M43 PolarHBondContact O-N 3.48Å; M43-K45 VanDerWaalsContact C-N 3.32Å; M43-K45 PolarHBondContact O-N 2.91Å; M43-Q46 PolarHBondContact O-N 3.01Å; M43-E47 PolarHBondContact O-N 3.43Å
44R93.9Very high94.7Very high151 Ų15197.9 Ų97.957%0.5749%0.491SS*.Hα-helixtrans-63.4-36.5176.5-75.1-178.1177.7155.22.7112.4T40 L41 Q46 E47 L48T40-R44 WeakPolarHBondContact O-CG 3.28Å; T40-R44 PolarHBondContact O-N 2.97Å; L41-R44 PolarHBondContact O-N 3.26Å; R44-Q46 VanDerWaalsContact C-N 3.34Å; R44-E47 PolarHBondContact O-N 3.3Å; R44-L48 VanDerWaalsContact O-CG 3.3Å; R44-L48 WeakPolarHBondContact O-CG 3.32Å; R44-L48 PolarHBondContact O-N 3.27Å
45K93.1Very high94.6Very high57 Ų5793.9 Ų93.925%0.24848%0.478CS..Hα-helixtrans-59-46.2173.7175.1167.8179.3160.60110.5L41 D42 M43 L48 L49 F59 D60 E63L41-K45 WeakPolarHBondContact O-CB 3.38Å; L41-K45 PolarHBondContact O-N 2.86Å; D42-K45 WeakPolarHBondContact O-CB 3.37Å; D42-K45 PolarHBondContact O-N 2.86Å; M43-K45 VanDerWaalsContact C-N 3.32Å; M43-K45 PolarHBondContact O-N 2.91Å; K45-L48 PolarHBondContact O-N 3.47Å; K45-L49 HydrophobicContact CG-CD1 4.3Å; K45-L49 WeakPolarHBondContact O-CG 3.49Å; K45-L49 PolarHBondContact O-N 2.91Å; K45-F59 HydrophobicContact CB-CZ 4.47Å; K45-F59 HydrophobicContact CD-CD1 4.31Å; K45-F59 HydrophobicContact CD-CE1 3.67Å; K45-F59 HydrophobicContact CD-CZ 4.07Å; K45-F59 VanDerWaalsContact CE-CD1 3.49Å; K45-F59 HydrophobicContact CG-CD1 4.49Å; K45-F59 HydrophobicContact CG-CE1 3.86Å; K45-F59 HydrophobicContact CG-CE2 4.36Å; K45-F59 HydrophobicContact CG-CZ 3.78Å; K45-D60 IonicContact NZ-OD1 2.63Å; K45-E63 IonicContact NZ-OE2 3.64Å; K45-E63 PolarHBondContact NZ-OE2 3.42Å
46Q93.1Very high94.4Very high114 Ų11497.8 Ų97.853%0.53349%0.489SS..Hα-helixtrans-65.3-41.3176.7-64.5-56.2-34.500112.7D42 M43 R44 L48 L49 S50D42-Q46 WeakPolarHBondContact O-CG 3.3Å; D42-Q46 PolarHBondContact O-N 3.17Å; M43-Q46 PolarHBondContact O-N 3.01Å; R44-Q46 VanDerWaalsContact C-N 3.34Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.05Å; Q46-L49 PolarHBondContact O-N 3.41Å; Q46-S50 PolarHBondContact O-N 3.32Å; Q46-S50 PolarHBondContact O-OG 3.17Å
47E94.6Very high94.2Very high122 Ų122100.9 Ų100.957%0.5750%0.503SS*.Hα-helixtrans-58.6-46.3176-174.1-180-169.700111.2M43 R44 S50 T51M43-E47 PolarHBondContact O-N 3.43Å; R44-E47 PolarHBondContact O-N 3.3Å; E47-S50 PolarHBondContact O-N 2.86Å; E47-S50 PolarHBondContact O-OG 3.35Å; E47-T51 WeakPolarHBondContact O-CB 3.47Å; E47-T51 PolarHBondContact O-N 3.48Å; E47-T51 PolarHBondContact O-OG1 2.69Å
48L94.2Very high94.1Very high79 Ų7999.5 Ų99.541%0.41450%0.499SS..Hα-helixtrans-63.2-43.3176.4-70.5172.4000112.6R44 K45 Q46 S50 T51 F52R44-L48 VanDerWaalsContact O-CG 3.3Å; R44-L48 WeakPolarHBondContact O-CG 3.32Å; R44-L48 PolarHBondContact O-N 3.27Å; K45-L48 PolarHBondContact O-N 3.47Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.05Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 3.26Å; L48-T51 PolarHBondContact O-N 3.29Å; L48-F52 HydrophobicContact CD2-CD2 4.15Å; L48-F52 HydrophobicContact CD2-CE2 3.74Å; L48-F52 WeakPolarHBondContact O-CD2 3.39Å; L48-F52 PolarHBondContact O-N 3.46Å; L48-F52 VanDerWaalsContact O-N 3.08Å
49L93.5Very high94Very high18 Ų1894.7 Ų94.79%0.09448%0.478CS..Hα-helixtrans-57.5-45.2176.1-74.8170.7000111.4K45 Q46 N53 L54 F59K45-L49 HydrophobicContact CG-CD1 4.3Å; K45-L49 WeakPolarHBondContact O-CG 3.49Å; K45-L49 PolarHBondContact O-N 2.91Å; Q46-L49 PolarHBondContact O-N 3.41Å; L49-N53 VanDerWaalsContact O-CA 3.31Å; L49-N53 WeakPolarHBondContact O-CA 3.31Å; L49-N53 PolarHBondContact O-N 3.36Å; L49-L54 HydrophobicContact CD2-CB 3.86Å; L49-L54 PolarHBondContact O-N 2.96Å; L49-F59 HydrophobicContact CD2-CB 3.56Å; L49-F59 HydrophobicContact CD2-CD2 3.81Å; L49-F59 HydrophobicContact CD2-CG 3.82Å; L49-F59 HydrophobicContact CG-CD2 4.26Å
50S93.8Very high93.8Very high88 Ų8893 Ų9362%0.61547%0.473SS*.Hα-helixtrans-70.8-41.5178.969.70000113.4Q46 E47 L48 F52 N53Q46-S50 PolarHBondContact O-N 3.32Å; Q46-S50 PolarHBondContact O-OG 3.17Å; E47-S50 PolarHBondContact O-N 2.86Å; E47-S50 PolarHBondContact O-OG 3.35Å; L48-S50 VanDerWaalsContact C-N 3.31Å; L48-S50 PolarHBondContact O-N 3.26Å; S50-F52 PolarHBondContact O-N 2.91Å; S50-N53 PolarHBondContact O-N 2.95Å
51T95.6Very high93.6Very high92 Ų9295.8 Ų95.856%0.56449%0.485SS*.Hα-helixtrans-67.9-39-175-59.30000111.5E47 L48E47-T51 WeakPolarHBondContact O-CB 3.47Å; E47-T51 PolarHBondContact O-N 3.48Å; E47-T51 PolarHBondContact O-OG1 2.69Å; L48-T51 PolarHBondContact O-N 3.29Å
52F94.1Very high93.6Very high138 Ų13895.5 Ų95.561%0.60548%0.484SS*.THydrogen-bonded Turntrans-99.83.6-179.2-64.7-73.6000113.5L48 S50 L54L48-F52 HydrophobicContact CD2-CD2 4.15Å; L48-F52 HydrophobicContact CD2-CE2 3.74Å; L48-F52 WeakPolarHBondContact O-CD2 3.39Å; L48-F52 PolarHBondContact O-N 3.46Å; L48-F52 VanDerWaalsContact O-N 3.08Å; S50-F52 PolarHBondContact O-N 2.91Å; F52-L54 HydrophobicContact CB-CD1 3.88Å; F52-L54 HydrophobicContact CB-CG 3.83Å; F52-L54 PolarHBondContact O-N 3.38Å
53N94.4Very high93.5Very high153 Ų15395.5 Ų95.582%0.81848%0.481SS*.THydrogen-bonded Turntrans49.644-178-160.931.8000112.6L49 S50L49-N53 VanDerWaalsContact O-CA 3.31Å; L49-N53 WeakPolarHBondContact O-CA 3.31Å; L49-N53 PolarHBondContact O-N 3.36Å; S50-N53 PolarHBondContact O-N 2.95Å
54L93.5Very high93.3Very high58 Ų5895.6 Ų95.630%0.30448%0.478SS..  trans-83.9139.3-177.2-71.4167000110.6L49 F52 D58 F59L49-L54 HydrophobicContact CD2-CB 3.86Å; L49-L54 PolarHBondContact O-N 2.96Å; F52-L54 HydrophobicContact CB-CD1 3.88Å; F52-L54 HydrophobicContact CB-CG 3.83Å; F52-L54 PolarHBondContact O-N 3.38Å; L54-D58 HydrophobicContact CD2-CB 4.45Å; L54-F59 HydrophobicContact CD1-CD2 4.26Å
55S93.4Very high93.3Very high50 Ų5091.4 Ų91.435%0.3547%0.469SS..  trans-71.1158.716681.20000110.3D57 D58 F59S55-D57 VanDerWaalsContact C-N 3.29Å; S55-D57 PolarHBondContact O-N 3.46Å; S55-D58 WeakPolarHBondContact CB-OD2 3.49Å; S55-D58 PolarHBondContact O-N 3.22Å; S55-D58 WeakPolarHBondContact OG-CB 3.44Å; S55-D58 PolarHBondContact OG-N 3.15Å; S55-D58 VanDerWaalsContact OG-N 3.12Å; S55-D58 PolarHBondContact OG-OD2 3.18Å; S55-F59 PolarHBondContact O-N 3.21Å; S55-F59 VanDerWaalsContact O-N 3.1Å
56K90.9Very high93.2Very high152 Ų15292 Ų9266%0.66148%0.478SS*.Hα-helixtrans-60.7-41.3176.1-69.9-176.6179.7-179.90111.6F59 D60K56-F59 PolarHBondContact O-N 2.95Å; K56-D60 VanDerWaalsContact O-CG 3.31Å; K56-D60 PolarHBondContact O-N 3.44Å
57D92.4Very high93.1Very high129 Ų12991.7 Ų91.769%0.6948%0.479SS*.Hα-helixtrans-66.1-39.9-179-61.5-28.5000111.8S55 D60 L61S55-D57 VanDerWaalsContact C-N 3.29Å; S55-D57 PolarHBondContact O-N 3.46Å; D57-D60 PolarHBondContact O-N 3.18Å; D57-L61 PolarHBondContact O-N 2.98Å
58D92.7Very high92.7Very high89 Ų8991.8 Ų91.848%0.47648%0.48SS..Hα-helixtrans-67-38.6176.8-65-42.3000111.7L54 S55 L61 L62L54-D58 HydrophobicContact CD2-CB 4.45Å; S55-D58 WeakPolarHBondContact CB-OD2 3.49Å; S55-D58 PolarHBondContact O-N 3.22Å; S55-D58 WeakPolarHBondContact OG-CB 3.44Å; S55-D58 PolarHBondContact OG-N 3.15Å; S55-D58 VanDerWaalsContact OG-N 3.12Å; S55-D58 PolarHBondContact OG-OD2 3.18Å; D58-L61 PolarHBondContact O-N 2.69Å; D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.21Å
59F93.3Very high92.4Very high30 Ų3092.2 Ų92.213%0.13248%0.482CS..Hα-helixtrans-65.9-43.1175.4-173.3-82.2000111.6K45 L49 L54 S55 K56 L61 L62 E63K45-F59 HydrophobicContact CB-CZ 4.47Å; K45-F59 HydrophobicContact CD-CD1 4.31Å; K45-F59 HydrophobicContact CD-CE1 3.67Å; K45-F59 HydrophobicContact CD-CZ 4.07Å; K45-F59 VanDerWaalsContact CE-CD1 3.49Å; K45-F59 HydrophobicContact CG-CD1 4.49Å; K45-F59 HydrophobicContact CG-CE1 3.86Å; K45-F59 HydrophobicContact CG-CE2 4.36Å; K45-F59 HydrophobicContact CG-CZ 3.78Å; L49-F59 HydrophobicContact CD2-CB 3.56Å; L49-F59 HydrophobicContact CD2-CD2 3.81Å; L49-F59 HydrophobicContact CD2-CG 3.82Å; L49-F59 HydrophobicContact CG-CD2 4.26Å; L54-F59 HydrophobicContact CD1-CD2 4.26Å; S55-F59 PolarHBondContact O-N 3.21Å; S55-F59 VanDerWaalsContact O-N 3.1Å; K56-F59 PolarHBondContact O-N 2.95Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.38Å; F59-L62 WeakPolarHBondContact O-CB 3.45Å; F59-L62 PolarHBondContact O-N 2.84Å; F59-L62 VanDerWaalsContact O-N 3.15Å; F59-E63 HydrophobicContact CE1-CB 4.37Å; F59-E63 WeakPolarHBondContact O-CB 3.4Å; F59-E63 PolarHBondContact O-N 3.4Å
60D92.3Very high91.9Very high81 Ų8198.8 Ų98.843%0.43351%0.51SS..Hα-helixtrans-65.3-35.2178.4-70.4-10.8000111.3K45 K56 D57 K64K45-D60 IonicContact NZ-OD1 2.63Å; K56-D60 VanDerWaalsContact O-CG 3.31Å; K56-D60 PolarHBondContact O-N 3.44Å; D57-D60 PolarHBondContact O-N 3.18Å; D60-K64 WeakPolarHBondContact O-CB 3.5Å; D60-K64 PolarHBondContact O-N 3.14Å
61L93.2Very high91.2Very high108 Ų10897.5 Ų97.557%0.56550%0.499SS*.Hα-helixtrans-63.9-46.1170.6-179.763.5000111.6D57 D58 F59 K64 V65D57-L61 PolarHBondContact O-N 2.98Å; D58-L61 PolarHBondContact O-N 2.69Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.38Å; L61-K64 WeakPolarHBondContact O-CB 3.42Å; L61-K64 PolarHBondContact O-N 3.21Å; L61-V65 WeakPolarHBondContact O-CG2 3.31Å; L61-V65 PolarHBondContact O-N 3.12Å
62L93.4Very high90.5Very high88 Ų8899.7 Ų99.746%0.46150%0.503SS..Hα-helixtrans-60.7-46.1176.8179.363.8000111.2D58 F59 K64 V65 V66D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.21Å; F59-L62 WeakPolarHBondContact O-CB 3.45Å; F59-L62 PolarHBondContact O-N 2.84Å; F59-L62 VanDerWaalsContact O-N 3.15Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 3.33Å; L62-V65 PolarHBondContact O-N 2.93Å; L62-V65 VanDerWaalsContact O-N 3.17Å; L62-V66 HydrophobicContact CD1-CG2 4.28Å; L62-V66 HydrophobicContact CG-CG2 4.42Å; L62-V66 VanDerWaalsContact O-CG2 3.3Å; L62-V66 WeakPolarHBondContact O-CG2 3.32Å; L62-V66 PolarHBondContact O-N 3.48Å
63E92.2Very high89.6Confident84 Ų84100.9 Ų100.939%0.39351%0.507SS..Hα-helixtrans-56.3-47.1176.6-175.8172.3176.700110.5K45 F59 V65 V66 L67K45-E63 IonicContact NZ-OE2 3.64Å; K45-E63 PolarHBondContact NZ-OE2 3.42Å; F59-E63 HydrophobicContact CE1-CB 4.37Å; F59-E63 WeakPolarHBondContact O-CB 3.4Å; F59-E63 PolarHBondContact O-N 3.4Å; E63-V65 PolarHBondContact O-N 2.86Å; E63-V66 PolarHBondContact O-N 3.38Å; E63-L67 HydrophobicContact CG-CD1 4.19Å; E63-L67 WeakPolarHBondContact O-CB 3.31Å; E63-L67 VanDerWaalsContact O-CG 3.28Å; E63-L67 WeakPolarHBondContact O-CG 3.46Å; E63-L67 PolarHBondContact O-N 3.46Å
64K92.3Very high88.6Confident127 Ų12794.5 Ų94.555%0.55248%0.476SS*.Hα-helixtrans-60.1-43.4176.2-172.3175.6-176.1174.70112.7D60 L61 L62 L67 Q68D60-K64 WeakPolarHBondContact O-CB 3.5Å; D60-K64 PolarHBondContact O-N 3.14Å; L61-K64 WeakPolarHBondContact O-CB 3.42Å; L61-K64 PolarHBondContact O-N 3.21Å; L62-K64 VanDerWaalsContact C-N 3.31Å; L62-K64 PolarHBondContact O-N 3.33Å; K64-L67 PolarHBondContact O-N 3.29Å; K64-Q68 WeakPolarHBondContact O-CG 3.1Å; K64-Q68 PolarHBondContact O-N 3.32Å
65V93.4Very high88Confident63 Ų6392.6 Ų92.638%0.38247%0.47SS..Hα-helixtrans-64.8-44.6177.1172.10000110.7L61 L62 E63 L67 Q68 L69L61-V65 WeakPolarHBondContact O-CG2 3.31Å; L61-V65 PolarHBondContact O-N 3.12Å; L62-V65 PolarHBondContact O-N 2.93Å; L62-V65 VanDerWaalsContact O-N 3.17Å; E63-V65 PolarHBondContact O-N 2.86Å; V65-L67 VanDerWaalsContact C-N 3.34Å; V65-L67 PolarHBondContact O-N 2.97Å; V65-Q68 PolarHBondContact O-N 3.26Å; V65-L69 HydrophobicContact CG1-CD1 3.82Å; V65-L69 HydrophobicContact CG1-CG 4.34Å; V65-L69 WeakPolarHBondContact O-CB 3.47Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.31Å; V65-L69 PolarHBondContact O-N 3.38Å
66V92Very high87.4Confident69 Ų6993.9 Ų93.942%0.41848%0.476SS..Hα-helixtrans-61.1-42.6178.3170.60000111.3L62 E63 L69 K70L62-V66 HydrophobicContact CD1-CG2 4.28Å; L62-V66 HydrophobicContact CG-CG2 4.42Å; L62-V66 VanDerWaalsContact O-CG2 3.3Å; L62-V66 WeakPolarHBondContact O-CG2 3.32Å; L62-V66 PolarHBondContact O-N 3.48Å; E63-V66 PolarHBondContact O-N 3.38Å; V66-L69 PolarHBondContact O-N 2.93Å; V66-K70 PolarHBondContact O-N 3.46Å; V66-K70 VanDerWaalsContact O-N 3.17Å
67L89.1Confident87.1Confident108 Ų10887.4 Ų87.457%0.56545%0.448SS*.Hα-helixtrans-63.1-41.5175.9-71.4171.9000111.9E63 K64 V65 L69 K70E63-L67 HydrophobicContact CG-CD1 4.19Å; E63-L67 WeakPolarHBondContact O-CB 3.31Å; E63-L67 VanDerWaalsContact O-CG 3.28Å; E63-L67 WeakPolarHBondContact O-CG 3.46Å; E63-L67 PolarHBondContact O-N 3.46Å; K64-L67 PolarHBondContact O-N 3.29Å; V65-L67 VanDerWaalsContact C-N 3.34Å; V65-L67 PolarHBondContact O-N 2.97Å; L67-L69 VanDerWaalsContact C-N 3.32Å; L67-L69 PolarHBondContact O-N 2.92Å; L67-K70 WeakPolarHBondContact O-CB 3.25Å; L67-K70 PolarHBondContact O-N 2.88Å
68Q87.5Confident87Confident124 Ų12487 Ų8758%0.57944%0.437SS*.Hα-helixtrans-68.5-29176.5-72.7-180-14.600113.4K64 V65 P71 H72K64-Q68 WeakPolarHBondContact O-CG 3.1Å; K64-Q68 PolarHBondContact O-N 3.32Å; V65-Q68 PolarHBondContact O-N 3.26Å; Q68-P71 WeakPolarHBondContact O-CD 3.36Å; Q68-H72 PolarHBondContact O-ND1 3.25Å; Q68-H72 VanDerWaalsContact O-ND1 3.11Å
69L86.5Confident86.9Confident88 Ų8888.1 Ų88.146%0.46144%0.438SS..Hα-helixtrans-78.2-21.3176.7-72.6172.2000113.1V65 V66 L67 H72 K73V65-L69 HydrophobicContact CG1-CD1 3.82Å; V65-L69 HydrophobicContact CG1-CG 4.34Å; V65-L69 WeakPolarHBondContact O-CB 3.47Å; V65-L69 VanDerWaalsContact O-CG 3.31Å; V65-L69 WeakPolarHBondContact O-CG 3.31Å; V65-L69 PolarHBondContact O-N 3.38Å; V66-L69 PolarHBondContact O-N 2.93Å; L67-L69 VanDerWaalsContact C-N 3.32Å; L67-L69 PolarHBondContact O-N 2.92Å; L69-H72 WeakPolarHBondContact O-CA 3.3Å; L69-H72 WeakPolarHBondContact O-CB 3.47Å; L69-H72 PolarHBondContact O-N 2.94Å; L69-K73 PolarHBondContact O-N 3.11Å; L69-K73 VanDerWaalsContact O-N 3.12Å
70K84.6Confident86.8Confident156 Ų15695 Ų9568%0.67847%0.468SS*.G310 helixtrans-50-48.4-175.5-174.2179.3-179.2179.30113.7V66 L67 H72 K73V66-K70 PolarHBondContact O-N 3.46Å; V66-K70 VanDerWaalsContact O-N 3.17Å; L67-K70 WeakPolarHBondContact O-CB 3.25Å; L67-K70 PolarHBondContact O-N 2.88Å; K70-H72 VanDerWaalsContact C-N 3.26Å; K70-H72 PolarHBondContact O-N 2.71Å; K70-K73 PolarHBondContact O-N 3.22Å
71P78.4Confident86.8Confident61 Ų6192.1 Ų92.140%0.39646%0.456SS..G310 helixtrans-68.1-24.3178.7-19.233.7000113.9Q68Q68-P71 WeakPolarHBondContact O-CD 3.36Å
72H80.5Confident86.7Confident138 Ų13887.2 Ų87.264%0.63943%0.431SS*.G310 helixtrans-84.3-18.4-178.8-58.889.5000112.4Q68 L69 K70 A74 G75Q68-H72 PolarHBondContact O-ND1 3.25Å; Q68-H72 VanDerWaalsContact O-ND1 3.11Å; L69-H72 WeakPolarHBondContact O-CA 3.3Å; L69-H72 WeakPolarHBondContact O-CB 3.47Å; L69-H72 PolarHBondContact O-N 2.94Å; K70-H72 VanDerWaalsContact C-N 3.26Å; K70-H72 PolarHBondContact O-N 2.71Å; H72-A74 VanDerWaalsContact C-N 3.25Å; H72-A74 PolarHBondContact O-N 2.91Å; H72-G75 PolarHBondContact O-N 2.98Å
73K76.3Confident86.8Confident162 Ų16285 Ų8570%0.70442%0.423SS*.THydrogen-bonded Turntrans-64.9-28.2176.7-73.2-172.2177.4-177.30113.2L69 K70 G75L69-K73 PolarHBondContact O-N 3.11Å; L69-K73 VanDerWaalsContact O-N 3.12Å; K70-K73 PolarHBondContact O-N 3.22Å; K73-G75 PolarHBondContact O-N 3.47Å
74A72.8Confident86.9Confident19 Ų1985.4 Ų85.416%0.15742%0.423CS..THydrogen-bonded Turntrans-81.44.1177.900000113.4H72 Q77 Q209H72-A74 VanDerWaalsContact C-N 3.25Å; H72-A74 PolarHBondContact O-N 2.91Å; A74-Q77 PolarHBondContact O-NE2 2.87Å; A74-Q209 HydrophobicContact CB-CB 4.13Å; A74-Q209 WeakPolarHBondContact CB-O 3.2Å
75G79.8Confident87.1Confident18 Ų1879.4 Ų79.419%0.18640%0.397CS..  trans94.8-164178.200000114.4H72 K73 Q77 D212H72-G75 PolarHBondContact O-N 2.98Å; K73-G75 PolarHBondContact O-N 3.47Å; G75-Q77 PolarHBondContact O-N 3.38Å; G75-Q77 VanDerWaalsContact O-N 3.14Å; G75-D212 WeakPolarHBondContact CA-OD1 3.44Å
76V82.3Confident87.2Confident77 Ų7777.9 Ų77.947%0.46739%0.385SS..  trans-77.3100.4-177.1-175.20000111K79V76-K79 HydrophobicContact CG1-CD 4.2Å; V76-K79 HydrophobicContact CG1-CG 3.86Å
77Q85Confident87.4Confident16 Ų1675.6 Ų75.68%0.07537%0.374CS..THydrogen-bonded Turntrans-77.8-25.5-178.2-58-58.9-32.900114.5A74 G75 G82 A99 Q209A74-Q77 PolarHBondContact O-NE2 2.87Å; G75-Q77 PolarHBondContact O-N 3.38Å; G75-Q77 VanDerWaalsContact O-N 3.14Å; Q77-G82 CarbonylContact O-C 3.41Å; Q77-G82 VanDerWaalsContact O-CA 3.25Å; Q77-G82 WeakPolarHBondContact O-CA 3.25Å; Q77-A99 HydrophobicContact CB-CB 4.27Å; Q77-Q209 VanDerWaalsContact OE1-NE2 3.13Å
78W89.9Confident87.8Confident121 Ų12170.7 Ų70.746%0.45835%0.348SS..THydrogen-bonded Turntrans-103.531.1-169.9-68.5108.8000115.3F86 A99W78-F86 HydrophobicContact CH2-CB 4.38Å; W78-F86 AromaticContact CH2-CD1 3.72Å; W78-F86 HydrophobicContact CH2-CD1 3.72Å; W78-F86 AromaticContact CH2-CD2 3.92Å; W78-F86 HydrophobicContact CH2-CD2 3.92Å; W78-F86 AromaticContact CH2-CE1 3.93Å; W78-F86 HydrophobicContact CH2-CE1 3.93Å; W78-F86 HydrophobicContact CH2-CE2 4.12Å; W78-F86 AromaticContact CH2-CG 3.72Å; W78-F86 HydrophobicContact CH2-CG 3.72Å; W78-F86 HydrophobicContact CH2-CZ 4.13Å; W78-F86 HydrophobicContact CZ3-CB 4.29Å; W78-F86 AromaticContact CZ3-CD1 3.79Å; W78-F86 HydrophobicContact CZ3-CD1 3.79Å; W78-F86 HydrophobicContact CZ3-CE1 4.31Å; W78-F86 AromaticContact CZ3-CG 3.96Å; W78-F86 HydrophobicContact CZ3-CG 3.96Å; W78-A99 HydrophobicContact CZ2-CB 4.39Å
79K90.9Very high88.2Confident113 Ų11365 Ų6549%0.49132%0.322SS..SBendtrans-90.2169.8163.5-78.4-175.3176.7-175.40110.4V76 A81 G82 S83 Q215V76-K79 HydrophobicContact CG1-CD 4.2Å; V76-K79 HydrophobicContact CG1-CG 3.86Å; K79-A81 VanDerWaalsContact C-N 3.32Å; K79-A81 PolarHBondContact O-N 3.24Å; K79-A81 VanDerWaalsContact O-N 3.12Å; K79-G82 PolarHBondContact O-N 2.85Å; K79-S83 PolarHBondContact O-N 2.97Å; K79-S83 PolarHBondContact O-OG 3.48Å; K79-Q215 VanDerWaalsContact CD-OE1 3.23Å
80F91.3Very high88.7Confident173 Ų17361.7 Ų61.776%0.75931%0.305SS*.Hα-helixtrans-47-48.5-173.3-177.4-98.3000114.4G82 S83 F84F80-G82 PolarHBondContact O-N 3.46Å; F80-S83 PolarHBondContact O-N 3.2Å; F80-F84 VanDerWaalsContact O-CB 3.27Å; F80-F84 WeakPolarHBondContact O-CB 3.32Å; F80-F84 PolarHBondContact O-N 3.15Å
81A90.8Very high89.3Confident22 Ų2255.9 Ų55.918%0.18228%0.281CS..Hα-helixtrans-60.4-44.617900000113K79 F84 Y85 V221K79-A81 VanDerWaalsContact C-N 3.32Å; K79-A81 PolarHBondContact O-N 3.24Å; K79-A81 VanDerWaalsContact O-N 3.12Å; A81-F84 PolarHBondContact O-N 3.39Å; A81-Y85 PolarHBondContact O-N 3.35Å; A81-V221 HydrophobicContact CB-CG1 4.42Å
82G92Very high90.2Very high4 Ų453.2 Ų53.24%0.04126%0.264CS..Hα-helixtrans-73.3-36.9177.900000113.3Q77 K79 F80 F84 Y85 F86 L214Q77-G82 CarbonylContact O-C 3.41Å; Q77-G82 VanDerWaalsContact O-CA 3.25Å; Q77-G82 WeakPolarHBondContact O-CA 3.25Å; K79-G82 PolarHBondContact O-N 2.85Å; F80-G82 PolarHBondContact O-N 3.46Å; G82-F84 VanDerWaalsContact C-N 3.31Å; G82-F84 PolarHBondContact O-N 2.89Å; G82-Y85 PolarHBondContact O-N 3.4Å; G82-F86 WeakPolarHBondContact O-CB 3.44Å; G82-F86 PolarHBondContact O-N 2.9Å; G82-L214 VanDerWaalsContact CA-CD2 3.42Å
83S95.3Very high91Very high42 Ų4249.8 Ų49.829%0.29425%0.253SS..Hα-helixtrans-63-37171.3-600000112.1K79 F80 A87K79-S83 PolarHBondContact O-N 2.97Å; K79-S83 PolarHBondContact O-OG 3.48Å; F80-S83 PolarHBondContact O-N 3.2Å; S83-A87 WeakPolarHBondContact O-CB 3.36Å; S83-A87 PolarHBondContact O-N 2.74Å
84F95Very high92Very high93 Ų9342.3 Ų42.341%0.40822%0.221SC..Hα-helixtrans-70.2-41.4174.9-172.1-96.5000111.5F80 A81 G82 A87 I88 F225F80-F84 VanDerWaalsContact O-CB 3.27Å; F80-F84 WeakPolarHBondContact O-CB 3.32Å; F80-F84 PolarHBondContact O-N 3.15Å; A81-F84 PolarHBondContact O-N 3.39Å; G82-F84 VanDerWaalsContact C-N 3.31Å; G82-F84 PolarHBondContact O-N 2.89Å; F84-A87 WeakPolarHBondContact O-CB 3.47Å; F84-A87 PolarHBondContact O-N 3.01Å; F84-I88 HydrophobicContact CD1-CD1 3.79Å; F84-I88 HydrophobicContact CD1-CG1 4.37Å; F84-I88 HydrophobicContact CE1-CD1 3.52Å; F84-I88 HydrophobicContact CE1-CG1 4.17Å; F84-I88 HydrophobicContact CZ-CD1 4.36Å; F84-I88 WeakPolarHBondContact O-CG1 3.29Å; F84-I88 PolarHBondContact O-N 3.25Å; F84-F225 AromaticContact CD1-CD2 3.6Å; F84-F225 HydrophobicContact CD1-CD2 3.6Å; F84-F225 AromaticContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CE2 3.41Å; F84-F225 VanDerWaalsContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CG 4.37Å; F84-F225 HydrophobicContact CD1-CZ 4.04Å; F84-F225 AromaticContact CE1-CD2 3.67Å; F84-F225 HydrophobicContact CE1-CD2 3.67Å; F84-F225 AromaticContact CE1-CE2 3.99Å; F84-F225 HydrophobicContact CE1-CE2 3.99Å; F84-F225 HydrophobicContact CE1-CG 4.29Å; F84-F225 HydrophobicContact CG-CE2 4.44Å
85Y94.8Very high93.1Very high1 Ų143.7 Ų43.70%0.00424%0.236CC..Hα-helixtrans-59.3-48172.8-174.4-142.2000111.4A81 G82 A87 I88 T89 Y96 H98 V206 F225 I228A81-Y85 PolarHBondContact O-N 3.35Å; G82-Y85 PolarHBondContact O-N 3.4Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; Y85-A87 PolarHBondContact O-N 3.23Å; Y85-I88 WeakPolarHBondContact O-CB 3.27Å; Y85-I88 PolarHBondContact O-N 2.98Å; Y85-T89 HydrophobicContact CD2-CG2 4.36Å; Y85-T89 HydrophobicContact CE2-CG2 4.22Å; Y85-T89 WeakPolarHBondContact O-CG2 3.37Å; Y85-T89 PolarHBondContact O-N 2.84Å; Y85-Y96 HydrophobicContact CE2-CE2 4.23Å; Y85-Y96 AromaticContact CZ-CE2 3.81Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.29Å; Y85-H98 AromaticContact CD1-CE1 3.86Å; Y85-H98 AromaticContact CD1-NE2 3.6Å; Y85-H98 AromaticContact CE1-CE1 3.47Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.47Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.43Å; Y85-H98 AromaticContact CE1-NE2 3.51Å; Y85-V206 HydrophobicContact CE1-CG1 4.05Å; Y85-F225 HydrophobicContact CD2-CD1 4.06Å; Y85-F225 AromaticContact CD2-CE1 3.49Å; Y85-F225 HydrophobicContact CD2-CE1 3.49Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.49Å; Y85-F225 HydrophobicContact CD2-CZ 4.5Å; Y85-F225 HydrophobicContact CE2-CE1 4.4Å; Y85-F225 AromaticContact CG-CE1 3.78Å; Y85-F225 HydrophobicContact CG-CE1 3.78Å; Y85-F225 HydrophobicContact CG-CZ 4.43Å; Y85-I228 HydrophobicContact CE2-CD1 3.88Å
86F96Very high93.8Very high30 Ų3043.2 Ų43.213%0.13223%0.229CC..Hα-helixtrans-56.4-47173.7175.4-99.3000111.5W78 G82 I88 T89 V90 A99 P101W78-F86 HydrophobicContact CH2-CB 4.38Å; W78-F86 AromaticContact CH2-CD1 3.72Å; W78-F86 HydrophobicContact CH2-CD1 3.72Å; W78-F86 AromaticContact CH2-CD2 3.92Å; W78-F86 HydrophobicContact CH2-CD2 3.92Å; W78-F86 AromaticContact CH2-CE1 3.93Å; W78-F86 HydrophobicContact CH2-CE1 3.93Å; W78-F86 HydrophobicContact CH2-CE2 4.12Å; W78-F86 AromaticContact CH2-CG 3.72Å; W78-F86 HydrophobicContact CH2-CG 3.72Å; W78-F86 HydrophobicContact CH2-CZ 4.13Å; W78-F86 HydrophobicContact CZ3-CB 4.29Å; W78-F86 AromaticContact CZ3-CD1 3.79Å; W78-F86 HydrophobicContact CZ3-CD1 3.79Å; W78-F86 HydrophobicContact CZ3-CE1 4.31Å; W78-F86 AromaticContact CZ3-CG 3.96Å; W78-F86 HydrophobicContact CZ3-CG 3.96Å; G82-F86 WeakPolarHBondContact O-CB 3.44Å; G82-F86 PolarHBondContact O-N 2.9Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 3.41Å; F86-T89 PolarHBondContact O-N 3.16Å; F86-T89 PolarHBondContact O-OG1 2.66Å; F86-V90 HydrophobicContact CD1-CG2 4.22Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.71Å; F86-V90 HydrophobicContact CE2-CG2 3.95Å; F86-V90 HydrophobicContact CZ-CG2 3.55Å; F86-V90 WeakPolarHBondContact O-CG2 3.16Å; F86-V90 PolarHBondContact O-N 3.4Å; F86-A99 WeakPolarHBondContact CD2-O 3.5Å; F86-A99 WeakPolarHBondContact CE2-O 3.32Å; F86-P101 HydrophobicContact CZ-CG 4.34Å
87A97.5Very high94.2Very high21 Ų2142.3 Ų42.317%0.17424%0.235CC..Hα-helixtrans-58.2-43.1177.500000112.5S83 F84 Y85 V90 I91 Y113S83-A87 WeakPolarHBondContact O-CB 3.36Å; S83-A87 PolarHBondContact O-N 2.74Å; F84-A87 WeakPolarHBondContact O-CB 3.47Å; F84-A87 PolarHBondContact O-N 3.01Å; Y85-A87 VanDerWaalsContact C-N 3.34Å; Y85-A87 PolarHBondContact O-N 3.23Å; A87-V90 PolarHBondContact O-N 3.42Å; A87-I91 WeakPolarHBondContact O-CG1 3.5Å; A87-I91 PolarHBondContact O-N 3.32Å; A87-I91 VanDerWaalsContact O-N 3.08Å; A87-Y113 HydrophobicContact CB-CE1 4.1Å
88I96.2Very high94.4Very high5 Ų543 Ų433%0.02624%0.238CC..Hα-helixtrans-56.6-52.1172.2-68.9168.6000109.6F84 Y85 F86 V90 I91 T92 F225 I228F84-I88 HydrophobicContact CD1-CD1 3.79Å; F84-I88 HydrophobicContact CD1-CG1 4.37Å; F84-I88 HydrophobicContact CE1-CD1 3.52Å; F84-I88 HydrophobicContact CE1-CG1 4.17Å; F84-I88 HydrophobicContact CZ-CD1 4.36Å; F84-I88 WeakPolarHBondContact O-CG1 3.29Å; F84-I88 PolarHBondContact O-N 3.25Å; Y85-I88 WeakPolarHBondContact O-CB 3.27Å; Y85-I88 PolarHBondContact O-N 2.98Å; F86-I88 VanDerWaalsContact C-N 3.34Å; F86-I88 PolarHBondContact O-N 3.41Å; I88-V90 PolarHBondContact O-N 2.99Å; I88-I91 PolarHBondContact O-N 2.89Å; I88-T92 HydrophobicContact CG2-CG2 3.98Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.5Å; I88-T92 WeakPolarHBondContact O-CG2 3.35Å; I88-T92 PolarHBondContact O-N 3.09Å; I88-T92 PolarHBondContact O-OG1 3.02Å; I88-F225 HydrophobicContact CD1-CB 4.03Å; I88-F225 HydrophobicContact CD1-CD1 3.82Å; I88-F225 HydrophobicContact CD1-CD2 4.36Å; I88-F225 HydrophobicContact CD1-CE1 4.4Å; I88-F225 HydrophobicContact CD1-CG 3.81Å; I88-I228 HydrophobicContact CG2-CG2 4.08Å
89T96.6Very high94.4Very high4 Ų437.9 Ų37.93%0.02522%0.222CC..Hα-helixtrans-60.8-30.9-176.365.50000113.3Y85 F86 T93 I94 G95 Y96Y85-T89 HydrophobicContact CD2-CG2 4.36Å; Y85-T89 HydrophobicContact CE2-CG2 4.22Å; Y85-T89 WeakPolarHBondContact O-CG2 3.37Å; Y85-T89 PolarHBondContact O-N 2.84Å; F86-T89 PolarHBondContact O-N 3.16Å; F86-T89 PolarHBondContact O-OG1 2.66Å; T89-T93 PolarHBondContact O-N 2.63Å; T89-I94 PolarHBondContact O-N 3.2Å; T89-G95 PolarHBondContact O-N 3.41Å; T89-G95 VanDerWaalsContact O-N 3.09Å; T89-Y96 HydrophobicContact CG2-CD2 3.66Å; T89-Y96 HydrophobicContact CG2-CE2 3.92Å
90V97.8Very high94.5Very high19 Ų1935.4 Ų35.412%0.11522%0.223CC..Hα-helixtrans-73.4-53.5176.9173.10000111.3F86 A87 I88 T92 T93 Y113 A114F86-V90 HydrophobicContact CD1-CG2 4.22Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.71Å; F86-V90 HydrophobicContact CE2-CG2 3.95Å; F86-V90 HydrophobicContact CZ-CG2 3.55Å; F86-V90 WeakPolarHBondContact O-CG2 3.16Å; F86-V90 PolarHBondContact O-N 3.4Å; A87-V90 PolarHBondContact O-N 3.42Å; I88-V90 PolarHBondContact O-N 2.99Å; V90-T92 VanDerWaalsContact C-N 3.31Å; V90-T92 PolarHBondContact O-N 3.36Å; V90-T93 PolarHBondContact O-N 3.37Å; V90-Y113 HydrophobicContact CB-CD1 4.44Å; V90-Y113 HydrophobicContact CB-CE1 4.47Å; V90-Y113 HydrophobicContact CG1-CD1 3.92Å; V90-Y113 HydrophobicContact CG1-CE1 4.36Å; V90-A114 HydrophobicContact CG1-CB 3.79Å
91I97.3Very high94.7Very high34 Ų3428.4 Ų28.417%0.17419%0.194CC..Hα-helixtrans-72.4-26.3-174.868.3-175.9000113A87 I88 T93 Y113 T121A87-I91 WeakPolarHBondContact O-CG1 3.5Å; A87-I91 PolarHBondContact O-N 3.32Å; A87-I91 VanDerWaalsContact O-N 3.08Å; I88-I91 PolarHBondContact O-N 2.89Å; I91-T93 VanDerWaalsContact C-N 3.32Å; I91-Y113 HydrophobicContact CG2-CD1 4.13Å; I91-Y113 HydrophobicContact CG2-CE1 3.33Å; I91-T121 WeakPolarHBondContact CB-OG1 3.47Å; I91-T121 WeakPolarHBondContact O-CB 3.38Å
92T96.1Very high94.7Very high6 Ų632.1 Ų32.14%0.03722%0.219CC..THydrogen-bonded Turntrans-88.90.8175.860.60000113.3I88 V90 I94 T121 F125 T199 L232I88-T92 HydrophobicContact CG2-CG2 3.98Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.5Å; I88-T92 WeakPolarHBondContact O-CG2 3.35Å; I88-T92 PolarHBondContact O-N 3.09Å; I88-T92 PolarHBondContact O-OG1 3.02Å; V90-T92 VanDerWaalsContact C-N 3.31Å; V90-T92 PolarHBondContact O-N 3.36Å; T92-I94 PolarHBondContact O-N 3.37Å; T92-I94 VanDerWaalsContact O-N 3.13Å; T92-I94 VanDerWaalsContact OG1-CD1 3.31Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.31Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.49Å; T92-T121 HydrophobicContact CG2-CG2 4.32Å; T92-F125 HydrophobicContact CG2-CE2 4.26Å; T92-F125 HydrophobicContact CG2-CZ 4.42Å; T92-T199 WeakPolarHBondContact O-CG2 3.23Å; T92-L232 HydrophobicContact CG2-CD1 3.52Å
93T97Very high94.9Very high66 Ų6636 Ų3641%0.40524%0.242SC..THydrogen-bonded Turntrans55.923.7-178.867.90000115T89 V90 I91 I118T89-T93 PolarHBondContact O-N 2.63Å; V90-T93 PolarHBondContact O-N 3.37Å; I91-T93 VanDerWaalsContact C-N 3.32Å; T93-I118 HydrophobicContact CG2-CB 4.4Å; T93-I118 HydrophobicContact CG2-CD1 3.66Å; T93-I118 HydrophobicContact CG2-CG1 3.69Å; T93-I118 HydrophobicContact CG2-CG2 3.82Å
94I97.3Very high95Very high5 Ų541.8 Ų41.83%0.02626%0.264CS..  trans-72.8-52.8174-61.7167.7000109.9T89 T92 Y96 T196 T199 G201 I228 L232T89-I94 PolarHBondContact O-N 3.2Å; T92-I94 PolarHBondContact O-N 3.37Å; T92-I94 VanDerWaalsContact O-N 3.13Å; T92-I94 VanDerWaalsContact OG1-CD1 3.31Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.31Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.49Å; I94-Y96 HydrophobicContact CG2-CD1 3.86Å; I94-Y96 HydrophobicContact CG2-CD2 4.07Å; I94-Y96 HydrophobicContact CG2-CE1 3.56Å; I94-Y96 HydrophobicContact CG2-CE2 3.79Å; I94-Y96 HydrophobicContact CG2-CG 4.11Å; I94-Y96 PolarHBondContact O-N 3.2Å; I94-T196 HydrophobicContact CD1-CG2 4.1Å; I94-T199 HydrophobicContact CG1-CG2 4.15Å; I94-G201 WeakPolarHBondContact O-CA 3.48Å; I94-I228 HydrophobicContact CD1-CG2 3.79Å; I94-L232 HydrophobicContact CD1-CD1 4.26Å
95G95.8Very high95.1Very high47 Ų4739.9 Ų39.949%0.48527%0.271SS..  trans57.744.8169.900000117.8T89 G97T89-G95 PolarHBondContact O-N 3.41Å; T89-G95 VanDerWaalsContact O-N 3.09Å; G95-G97 PolarHBondContact O-N 3.31Å
96Y94.6Very high95.3Very high9 Ų940.9 Ų40.94%0.03528%0.281CS..  trans-48.6-23.1-178.9-62.9-61.1000117.4Y85 T89 I94 H98 Y192 T196 G201 G203 V206Y85-Y96 HydrophobicContact CE2-CE2 4.23Å; Y85-Y96 AromaticContact CZ-CE2 3.81Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.29Å; T89-Y96 HydrophobicContact CG2-CD2 3.66Å; T89-Y96 HydrophobicContact CG2-CE2 3.92Å; I94-Y96 HydrophobicContact CG2-CD1 3.86Å; I94-Y96 HydrophobicContact CG2-CD2 4.07Å; I94-Y96 HydrophobicContact CG2-CE1 3.56Å; I94-Y96 HydrophobicContact CG2-CE2 3.79Å; I94-Y96 HydrophobicContact CG2-CG 4.11Å; I94-Y96 PolarHBondContact O-N 3.2Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.16Å; Y96-H98 AromaticContact CD2-CE1 3.96Å; Y96-H98 AromaticContact CD2-ND1 3.92Å; Y96-H98 PolarHBondContact O-N 3.08Å; Y96-H98 VanDerWaalsContact O-N 3.08Å; Y96-Y192 HydrophobicContact CE1-CE2 4.14Å; Y96-Y192 AromaticContact CZ-CE2 3.95Å; Y96-Y192 WeakPolarHBondContact OH-CE2 3.48Å; Y96-Y192 PolarHBondContact OH-OH 2.96Å; Y96-T196 WeakPolarHBondContact OH-CB 3.35Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.49Å; Y96-T196 PolarHBondContact OH-OG1 3.37Å; Y96-G201 VanDerWaalsContact CA-O 3.32Å; Y96-G201 WeakPolarHBondContact CA-O 3.48Å; Y96-G203 VanDerWaalsContact O-CA 3.31Å; Y96-G203 WeakPolarHBondContact O-CA 3.45Å; Y96-V206 HydrophobicContact CD1-CG2 4.15Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CE2-CG1 4.5Å; Y96-V206 HydrophobicContact CG-CG1 4.39Å; Y96-V206 HydrophobicContact CG-CG2 4.01Å
97G91.8Very high95.4Very high58 Ų5844.6 Ų44.660%0.59830%0.297SS*.  trans73.5-2.7-179.900000116.5G95 A99G95-G97 PolarHBondContact O-N 3.31Å; G97-A99 PolarHBondContact O-N 3.14Å
98H88.6Confident95.4Very high29 Ų2947.3 Ų47.313%0.13431%0.312CS..SBendtrans-58.8-31.117467.7-83.7000113.1Y85 Y96 V206 Q209Y85-H98 AromaticContact CD1-CE1 3.86Å; Y85-H98 AromaticContact CD1-NE2 3.6Å; Y85-H98 AromaticContact CE1-CE1 3.47Å; Y85-H98 VanDerWaalsContact CE1-CE1 3.47Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.43Å; Y85-H98 AromaticContact CE1-NE2 3.51Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.16Å; Y96-H98 AromaticContact CD2-CE1 3.96Å; Y96-H98 AromaticContact CD2-ND1 3.92Å; Y96-H98 PolarHBondContact O-N 3.08Å; Y96-H98 VanDerWaalsContact O-N 3.08Å; H98-V206 HydrophobicContact CB-CG1 4.38Å; H98-V206 HydrophobicContact CB-CG2 4.21Å; H98-Q209 PolarHBondContact CD2-NE2 3.18Å; H98-Q209 VanDerWaalsContact CD2-NE2 3.31Å
99A89.6Confident95.5Very high14 Ų1453.5 Ų53.512%0.11634%0.339CS..SBendtrans-132.3130.5170.800000109.5Q77 W78 F86 G97Q77-A99 HydrophobicContact CB-CB 4.27Å; W78-A99 HydrophobicContact CZ2-CB 4.39Å; F86-A99 WeakPolarHBondContact CD2-O 3.5Å; F86-A99 WeakPolarHBondContact CE2-O 3.32Å; G97-A99 PolarHBondContact O-N 3.14Å
100A93.2Very high95.5Very high62 Ų6254.6 Ų54.651%0.51235%0.346SS..  trans-138.3146.6178.400000110.5S102A100-S102 PolarHBondContact O-N 2.88Å; A100-S102 VanDerWaalsContact O-N 3.12Å
101P94.8Very high95.6Very high25 Ų2559.7 Ų59.716%0.16237%0.37CS..  trans-64.7115.2-179.824.8-32.4000110.3F86 K107 C110F86-P101 HydrophobicContact CZ-CG 4.34Å; P101-K107 HydrophobicContact CB-CG 4.25Å; P101-K107 HydrophobicContact CG-CG 4.05Å; P101-K107 WeakPolarHBondContact O-CE 3.38Å; P101-K107 WeakPolarHBondContact O-CG 3.18Å; P101-C110 HydrophobicContact CG-CB 4.17Å
102S92.2Very high95.6Very high100 Ų10063 Ų6370%0.69939%0.388SS*.  trans-80.1-28.1178.656.30000112.6A100A100-S102 PolarHBondContact O-N 2.88Å; A100-S102 VanDerWaalsContact O-N 3.12Å
103T96Very high95.7Very high85 Ų8566.7 Ų66.752%0.52140%0.401SS..SBendtrans-84.3148-176.866.60000112.3G105 G106 K107T103-G105 VanDerWaalsContact C-N 3.33Å; T103-G105 PolarHBondContact O-N 3.17Å; T103-G106 PolarHBondContact O-N 3.05Å; T103-G106 PolarHBondContact OG1-N 2.96Å; T103-K107 WeakPolarHBondContact O-CG 3.26Å; T103-K107 PolarHBondContact O-N 3Å
104H96.9Very high95.7Very high165 Ų16564.5 Ų64.576%0.76439%0.39SS*.Hα-helixtrans-57-45.4175.1-68.487.2000111.8G106 K107 V108H104-G106 PolarHBondContact O-N 3.33Å; H104-K107 PolarHBondContact O-N 3.11Å; H104-V108 WeakPolarHBondContact O-CG2 3.28Å; H104-V108 PolarHBondContact O-N 3.12Å
105G98.1Very high95.7Very high53 Ų5370 Ų7055%0.54642%0.419SS..Hα-helixtrans-61.8-41.9176.500000113.1T103 K107 V108 F109T103-G105 VanDerWaalsContact C-N 3.33Å; T103-G105 PolarHBondContact O-N 3.17Å; G105-K107 PolarHBondContact O-N 2.82Å; G105-V108 PolarHBondContact O-N 3.11Å; G105-F109 WeakPolarHBondContact O-CB 3.37Å; G105-F109 PolarHBondContact O-N 3.23Å
106G97.3Very high95.7Very high21 Ų2174 Ų7422%0.21643%0.429CS..Hα-helixtrans-63.2-39.8176.300000112.9T103 H104 C110T103-G106 PolarHBondContact O-N 3.05Å; T103-G106 PolarHBondContact OG1-N 2.96Å; H104-G106 PolarHBondContact O-N 3.33Å; G106-C110 VanDerWaalsContact O-CB 3.26Å; G106-C110 WeakPolarHBondContact O-CB 3.42Å; G106-C110 PolarHBondContact O-N 3.41Å
107K98.1Very high95.9Very high108 Ų10874 Ų7447%0.4743%0.431SS..Hα-helixtrans-64.4-46.1175.3-69.9175.9-177.7-1790111.8P101 T103 H104 G105 C110 M111P101-K107 HydrophobicContact CB-CG 4.25Å; P101-K107 HydrophobicContact CG-CG 4.05Å; P101-K107 WeakPolarHBondContact O-CE 3.38Å; P101-K107 WeakPolarHBondContact O-CG 3.18Å; T103-K107 WeakPolarHBondContact O-CG 3.26Å; T103-K107 PolarHBondContact O-N 3Å; H104-K107 PolarHBondContact O-N 3.11Å; G105-K107 PolarHBondContact O-N 2.82Å; K107-C110 PolarHBondContact O-N 3Å; K107-M111 WeakPolarHBondContact O-CG 3.41Å; K107-M111 PolarHBondContact O-N 3.34Å
108V98.3Very high96.1Very high79 Ų7973.6 Ų73.648%0.47942%0.415SS..Hα-helixtrans-61-47.1176.7173.20000111.2H104 G105 C110 M111 L112H104-V108 WeakPolarHBondContact O-CG2 3.28Å; H104-V108 PolarHBondContact O-N 3.12Å; G105-V108 PolarHBondContact O-N 3.11Å; V108-C110 VanDerWaalsContact C-N 3.35Å; V108-C110 PolarHBondContact O-N 3.31Å; V108-M111 HydrophobicContact CB-CE 4.42Å; V108-M111 HydrophobicContact CG2-CE 4.09Å; V108-M111 PolarHBondContact O-N 3.36Å; V108-L112 HydrophobicContact CG1-CD1 4.39Å; V108-L112 PolarHBondContact O-N 3.33Å
109F98.1Very high96.5Very high135 Ų13575.6 Ų75.659%0.59243%0.43SS*.Hα-helixtrans-59.8-44.8175.8177.8-100.5000111.8G105 M111 L112 Y113G105-F109 WeakPolarHBondContact O-CB 3.37Å; G105-F109 PolarHBondContact O-N 3.23Å; F109-M111 VanDerWaalsContact C-N 3.32Å; F109-M111 PolarHBondContact O-N 3.18Å; F109-L112 PolarHBondContact O-N 3.35Å; F109-Y113 HydrophobicContact CE1-CG 4.36Å; F109-Y113 HydrophobicContact CZ-CD2 4.28Å; F109-Y113 HydrophobicContact CZ-CG 4.5Å; F109-Y113 WeakPolarHBondContact O-CB 3.35Å; F109-Y113 PolarHBondContact O-N 3.48Å
110C98.1Very high96.7Very high26 Ų2680.9 Ų80.918%0.17646%0.456CS..Hα-helixtrans-59-41178.2-171.80000112.4P101 G106 K107 V108 Y113 A114P101-C110 HydrophobicContact CG-CB 4.17Å; G106-C110 VanDerWaalsContact O-CB 3.26Å; G106-C110 WeakPolarHBondContact O-CB 3.42Å; G106-C110 PolarHBondContact O-N 3.41Å; K107-C110 PolarHBondContact O-N 3Å; V108-C110 VanDerWaalsContact C-N 3.35Å; V108-C110 PolarHBondContact O-N 3.31Å; C110-Y113 PolarHBondContact O-N 2.96Å; C110-A114 VanDerWaalsContact O-CB 3.31Å; C110-A114 WeakPolarHBondContact O-CB 3.35Å; C110-A114 PolarHBondContact O-N 3.41Å
111M98.1Very high96.8Very high126 Ų12678.6 Ų78.662%0.62144%0.436SS*.Hα-helixtrans-62.2-46.6176.6-70.8-175.7-73.400111.9K107 V108 F109 L115K107-M111 WeakPolarHBondContact O-CG 3.41Å; K107-M111 PolarHBondContact O-N 3.34Å; V108-M111 HydrophobicContact CB-CE 4.42Å; V108-M111 HydrophobicContact CG2-CE 4.09Å; V108-M111 PolarHBondContact O-N 3.36Å; F109-M111 VanDerWaalsContact C-N 3.32Å; F109-M111 PolarHBondContact O-N 3.18Å; M111-L115 WeakPolarHBondContact O-CB 3.32Å; M111-L115 PolarHBondContact O-N 2.99Å; M111-L115 VanDerWaalsContact O-N 3.11Å
112L98.1Very high96.6Very high105 Ų10582.3 Ų82.355%0.5545%0.453SS..Hα-helixtrans-68-38.8178.1-65.6174.4000112.3V108 F109 L115 L116V108-L112 HydrophobicContact CG1-CD1 4.39Å; V108-L112 PolarHBondContact O-N 3.33Å; F109-L112 PolarHBondContact O-N 3.35Å; L112-L115 PolarHBondContact O-N 2.85Å; L112-L116 PolarHBondContact O-N 3.43Å
113Y98.1Very high96.6Very high82 Ų8281.7 Ų81.732%0.32245%0.446SS..Hα-helixtrans-64.7-45178-177.1-110.1000111.5A87 V90 I91 F109 C110 G117A87-Y113 HydrophobicContact CB-CE1 4.1Å; V90-Y113 HydrophobicContact CB-CD1 4.44Å; V90-Y113 HydrophobicContact CB-CE1 4.47Å; V90-Y113 HydrophobicContact CG1-CD1 3.92Å; V90-Y113 HydrophobicContact CG1-CE1 4.36Å; I91-Y113 HydrophobicContact CG2-CD1 4.13Å; I91-Y113 HydrophobicContact CG2-CE1 3.33Å; F109-Y113 HydrophobicContact CE1-CG 4.36Å; F109-Y113 HydrophobicContact CZ-CD2 4.28Å; F109-Y113 HydrophobicContact CZ-CG 4.5Å; F109-Y113 WeakPolarHBondContact O-CB 3.35Å; F109-Y113 PolarHBondContact O-N 3.48Å; C110-Y113 PolarHBondContact O-N 2.96Å; Y113-G117 WeakPolarHBondContact O-CA 3.45Å; Y113-G117 PolarHBondContact O-N 3.06Å
114A97.7Very high96.5Very high20 Ų2081.6 Ų81.617%0.16544%0.44CS..Hα-helixtrans-63.3-41.417600000112.1V90 C110 L116 G117 I118V90-A114 HydrophobicContact CG1-CB 3.79Å; C110-A114 VanDerWaalsContact O-CB 3.31Å; C110-A114 WeakPolarHBondContact O-CB 3.35Å; C110-A114 PolarHBondContact O-N 3.41Å; A114-L116 VanDerWaalsContact C-N 3.29Å; A114-L116 PolarHBondContact O-N 3.47Å; A114-G117 PolarHBondContact O-N 3.32Å; A114-I118 HydrophobicContact CB-CD1 3.97Å; A114-I118 WeakPolarHBondContact O-CB 3.45Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.47Å; A114-I118 PolarHBondContact O-N 2.89Å
115L97.1Very high96.2Very high120 Ų12074.8 Ų74.863%0.62841%0.408SS*.Hα-helixtrans-55.9-41.1-179.4-179.964.3000112.9M111 L112 P119M111-L115 WeakPolarHBondContact O-CB 3.32Å; M111-L115 PolarHBondContact O-N 2.99Å; M111-L115 VanDerWaalsContact O-N 3.11Å; L112-L115 PolarHBondContact O-N 2.85Å; L115-P119 WeakPolarHBondContact O-CD 3.37Å; L115-P119 WeakPolarHBondContact O-CG 3.08Å
116L96.1Very high95.8Very high133 Ų13375.4 Ų75.470%0.69640%0.397SS*.Hα-helixtrans-91.7-35.6178.7-61.6178.1000112.7L112 A114 L120L112-L116 PolarHBondContact O-N 3.43Å; A114-L116 VanDerWaalsContact C-N 3.29Å; A114-L116 PolarHBondContact O-N 3.47Å; L116-L120 WeakPolarHBondContact O-CB 3.43Å; L116-L120 PolarHBondContact O-N 3.11Å
117G97.1Very high95.5Very high9 Ų976.9 Ų76.99%0.09340%0.404CS..Hα-helixtrans-71.1-39.8-174.300000113.7Y113 A114 L120 T121Y113-G117 WeakPolarHBondContact O-CA 3.45Å; Y113-G117 PolarHBondContact O-N 3.06Å; A114-G117 PolarHBondContact O-N 3.32Å; G117-L120 PolarHBondContact O-N 3.1Å; G117-T121 VanDerWaalsContact O-CB 3.28Å; G117-T121 WeakPolarHBondContact O-CB 3.42Å; G117-T121 PolarHBondContact O-N 3.42Å; G117-T121 PolarHBondContact O-OG1 2.93Å
118I96.9Very high95.2Very high49 Ų4974.5 Ų74.525%0.25140%0.399SS..Hα-helixtrans-64.9-51.4-178.7-63165.8000111.1T93 A114 L120 T121 L122T93-I118 HydrophobicContact CG2-CB 4.4Å; T93-I118 HydrophobicContact CG2-CD1 3.66Å; T93-I118 HydrophobicContact CG2-CG1 3.69Å; T93-I118 HydrophobicContact CG2-CG2 3.82Å; A114-I118 HydrophobicContact CB-CD1 3.97Å; A114-I118 WeakPolarHBondContact O-CB 3.45Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.47Å; A114-I118 PolarHBondContact O-N 2.89Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 2.84Å; I118-T121 PolarHBondContact O-N 2.96Å; I118-L122 HydrophobicContact CG2-CD1 4.05Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.28Å; I118-L122 PolarHBondContact O-N 2.74Å
119P96.4Very high94.9Very high70 Ų7070.8 Ų70.846%0.45538%0.376SS..Hα-helixtrans-58.6-42.8176.5-24.934.6000113.2L115 T121 L122 V123L115-P119 WeakPolarHBondContact O-CD 3.37Å; L115-P119 WeakPolarHBondContact O-CG 3.08Å; P119-T121 VanDerWaalsContact C-N 3.33Å; P119-T121 PolarHBondContact O-N 3.29Å; P119-L122 PolarHBondContact O-N 3.02Å; P119-V123 WeakPolarHBondContact O-CG2 3.49Å; P119-V123 PolarHBondContact O-N 3.42Å
120L94.9Very high94.6Very high126 Ų12668 Ų6866%0.6636%0.364SS*.Hα-helixtrans-59.7-44.8177.3179.164.3000111.4L116 G117 I118 V123 M124L116-L120 WeakPolarHBondContact O-CB 3.43Å; L116-L120 PolarHBondContact O-N 3.11Å; G117-L120 PolarHBondContact O-N 3.1Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 2.84Å; L120-V123 PolarHBondContact O-N 2.8Å; L120-M124 WeakPolarHBondContact O-CB 3.46Å; L120-M124 PolarHBondContact O-N 2.91Å
121T93.8Very high94.4Very high13 Ų1375.5 Ų75.58%0.0839%0.389CS..Hα-helixtrans-67.2-41.6-179.4-59.30000111.6I91 T92 G117 I118 P119 M124 F125I91-T121 WeakPolarHBondContact CB-OG1 3.47Å; I91-T121 WeakPolarHBondContact O-CB 3.38Å; T92-T121 HydrophobicContact CG2-CG2 4.32Å; G117-T121 VanDerWaalsContact O-CB 3.28Å; G117-T121 WeakPolarHBondContact O-CB 3.42Å; G117-T121 PolarHBondContact O-N 3.42Å; G117-T121 PolarHBondContact O-OG1 2.93Å; I118-T121 PolarHBondContact O-N 2.96Å; P119-T121 VanDerWaalsContact C-N 3.33Å; P119-T121 PolarHBondContact O-N 3.29Å; T121-M124 PolarHBondContact O-N 2.95Å; T121-F125 HydrophobicContact CG2-CD2 3.63Å; T121-F125 HydrophobicContact CG2-CE2 3.34Å; T121-F125 HydrophobicContact CG2-CZ 4.26Å; T121-F125 WeakPolarHBondContact O-CD2 3.14Å; T121-F125 PolarHBondContact O-N 3.05Å
122L91.6Very high94.1Very high103 Ų10372.2 Ų72.254%0.53937%0.374SS..Hα-helixtrans-61.3-46.2175.3-71.5175.1000111.8I118 P119 M124 F125 Q126I118-L122 HydrophobicContact CG2-CD1 4.05Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 WeakPolarHBondContact O-CG 3.28Å; I118-L122 PolarHBondContact O-N 2.74Å; P119-L122 PolarHBondContact O-N 3.02Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.08Å; L122-F125 PolarHBondContact O-N 3.34Å; L122-Q126 WeakPolarHBondContact O-CB 3.13Å; L122-Q126 VanDerWaalsContact O-CG 3.23Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å; L122-Q126 PolarHBondContact O-N 3.02Å
123V92.2Very high93.9Very high88 Ų8868.5 Ų68.553%0.53335%0.354SS..Hα-helixtrans-63-40.8176.7172.30000111.2P119 L120 Q126 S127P119-V123 WeakPolarHBondContact O-CG2 3.49Å; P119-V123 PolarHBondContact O-N 3.42Å; L120-V123 PolarHBondContact O-N 2.8Å; V123-Q126 PolarHBondContact O-N 2.91Å; V123-S127 WeakPolarHBondContact O-CB 3.42Å; V123-S127 PolarHBondContact O-N 3.06Å; V123-S127 PolarHBondContact O-OG 3.19Å
124M92.9Very high93.6Very high82 Ų8268.5 Ų68.540%0.40436%0.363SS..Hα-helixtrans-61.2-50.2176.3-177.6-139.563.300111.1L120 T121 L122 Q126 S127 V128L120-M124 WeakPolarHBondContact O-CB 3.46Å; L120-M124 PolarHBondContact O-N 2.91Å; T121-M124 PolarHBondContact O-N 2.95Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.08Å; M124-Q126 PolarHBondContact O-N 2.7Å; M124-S127 PolarHBondContact O-N 2.88Å; M124-V128 HydrophobicContact CG-CG2 4.43Å; M124-V128 WeakPolarHBondContact O-CB 3.39Å; M124-V128 VanDerWaalsContact O-CG2 3.31Å; M124-V128 WeakPolarHBondContact O-CG2 3.47Å; M124-V128 PolarHBondContact O-N 3.09Å
125F91Very high93.4Very high22 Ų2273.6 Ų73.610%0.09638%0.382CS..Hα-helixtrans-64.4-37.1178.7-77.1-49000112.9T92 T121 L122 G129 L232 A233T92-F125 HydrophobicContact CG2-CE2 4.26Å; T92-F125 HydrophobicContact CG2-CZ 4.42Å; T121-F125 HydrophobicContact CG2-CD2 3.63Å; T121-F125 HydrophobicContact CG2-CE2 3.34Å; T121-F125 HydrophobicContact CG2-CZ 4.26Å; T121-F125 WeakPolarHBondContact O-CD2 3.14Å; T121-F125 PolarHBondContact O-N 3.05Å; L122-F125 PolarHBondContact O-N 3.34Å; F125-G129 WeakPolarHBondContact O-CA 3.27Å; F125-G129 PolarHBondContact O-N 3.07Å; F125-L232 HydrophobicContact CD1-CB 4.42Å; F125-L232 HydrophobicContact CE1-CB 3.66Å; F125-L232 HydrophobicContact CE2-CB 3.98Å; F125-L232 HydrophobicContact CE2-CD1 4.01Å; F125-L232 HydrophobicContact CZ-CB 3.41Å; F125-L232 VanDerWaalsContact CZ-CB 3.41Å; F125-L232 HydrophobicContact CZ-CD1 3.74Å; F125-L232 HydrophobicContact CZ-CG 4.24Å; F125-A233 HydrophobicContact CD1-CB 4.12Å; F125-A233 HydrophobicContact CE1-CB 4.24Å
126Q89.5Confident93.1Very high66 Ų6669.7 Ų69.731%0.30836%0.363SS..Hα-helixtrans-61.8-47.2173.7-72.8-68-25.100111.4L122 V123 M124 G129 E130 N240L122-Q126 WeakPolarHBondContact O-CB 3.13Å; L122-Q126 VanDerWaalsContact O-CG 3.23Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å; L122-Q126 PolarHBondContact O-N 3.02Å; V123-Q126 PolarHBondContact O-N 2.91Å; M124-Q126 PolarHBondContact O-N 2.7Å; Q126-G129 PolarHBondContact O-N 3.04Å; Q126-E130 PolarHBondContact O-N 3.21Å; Q126-N240 VanDerWaalsContact OE1-CG 3.23Å; Q126-N240 PolarHBondContact OE1-OD1 3.49Å
127S91.4Very high92.8Very high52 Ų5269 Ų6936%0.36435%0.351SS..Hα-helixtrans-63.8-46.2179.7-58.20000111.8V123 M124 R131V123-S127 WeakPolarHBondContact O-CB 3.42Å; V123-S127 PolarHBondContact O-N 3.06Å; V123-S127 PolarHBondContact O-OG 3.19Å; M124-S127 PolarHBondContact O-N 2.88Å; S127-R131 VanDerWaalsContact O-CG 3.31Å; S127-R131 WeakPolarHBondContact O-CG 3.28Å; S127-R131 PolarHBondContact O-N 3.42Å
128V92.9Very high92.6Very high59 Ų5974.8 Ų74.836%0.35837%0.371SS..Hα-helixtrans-64.5-44.1176.7171.50000110.5M124 E130 R131 I132 A233M124-V128 HydrophobicContact CG-CG2 4.43Å; M124-V128 WeakPolarHBondContact O-CB 3.39Å; M124-V128 VanDerWaalsContact O-CG2 3.31Å; M124-V128 WeakPolarHBondContact O-CG2 3.47Å; M124-V128 PolarHBondContact O-N 3.09Å; V128-E130 PolarHBondContact O-N 3.13Å; V128-R131 WeakPolarHBondContact O-CB 3.41Å; V128-R131 PolarHBondContact O-N 3.01Å; V128-R131 VanDerWaalsContact O-N 3.15Å; V128-I132 HydrophobicContact CG1-CD1 3.74Å; V128-I132 HydrophobicContact CG1-CG1 4.27Å; V128-I132 WeakPolarHBondContact O-CG1 3.43Å; V128-I132 PolarHBondContact O-N 3.2Å; V128-A233 HydrophobicContact CG1-CB 3.98Å
129G91.1Very high92.3Very high0 Ų076.1 Ų76.10%038%0.378CS..Hα-helixtrans-62-39.5-18000000113.3F125 Q126 I132 N133F125-G129 WeakPolarHBondContact O-CA 3.27Å; F125-G129 PolarHBondContact O-N 3.07Å; Q126-G129 PolarHBondContact O-N 3.04Å; G129-I132 PolarHBondContact O-N 3.33Å; G129-N133 WeakPolarHBondContact O-CB 3.13Å; G129-N133 VanDerWaalsContact O-CG 3.28Å; G129-N133 PolarHBondContact O-N 3.37Å; G129-N133 PolarHBondContact O-ND2 3.37Å
130E90.9Very high92Very high76 Ų7674.2 Ų74.236%0.35536%0.364SS..Hα-helixtrans-63.5-41.3173.8-172.9-178.8-165.600112Q126 V128 N133 T134 W326Q126-E130 PolarHBondContact O-N 3.21Å; V128-E130 PolarHBondContact O-N 3.13Å; E130-N133 PolarHBondContact O-N 3.11Å; E130-T134 WeakPolarHBondContact O-CB 3.39Å; E130-T134 PolarHBondContact O-N 3.3Å; E130-T134 PolarHBondContact O-OG1 3.36Å; E130-W326 WeakPolarHBondContact OE2-CH2 3.47Å; E130-W326 WeakPolarHBondContact OE2-CZ3 3.42Å
131R93.9Very high91.8Very high184 Ų18472 Ų7269%0.69435%0.35SS*.Hα-helixtrans-64.4-43.8176.2-64.9-67-177-172.1-0.8111.5S127 V128 T134 F135S127-R131 VanDerWaalsContact O-CG 3.31Å; S127-R131 WeakPolarHBondContact O-CG 3.28Å; S127-R131 PolarHBondContact O-N 3.42Å; V128-R131 WeakPolarHBondContact O-CB 3.41Å; V128-R131 PolarHBondContact O-N 3.01Å; V128-R131 VanDerWaalsContact O-N 3.15Å; R131-T134 PolarHBondContact O-N 3.03Å; R131-F135 WeakPolarHBondContact O-CB 3.19Å; R131-F135 PolarHBondContact O-N 2.92Å
132I93.4Very high91.6Very high58 Ų5878.1 Ų78.130%0.29737%0.371SS..Hα-helixtrans-59-49.9174.5-69.1170.4000110.1V128 G129 T134 F135 V136 A233 A237V128-I132 HydrophobicContact CG1-CD1 3.74Å; V128-I132 HydrophobicContact CG1-CG1 4.27Å; V128-I132 WeakPolarHBondContact O-CG1 3.43Å; V128-I132 PolarHBondContact O-N 3.2Å; G129-I132 PolarHBondContact O-N 3.33Å; I132-T134 VanDerWaalsContact C-N 3.31Å; I132-T134 PolarHBondContact O-N 2.69Å; I132-F135 WeakPolarHBondContact O-CB 3.02Å; I132-F135 PolarHBondContact O-N 3.07Å; I132-F135 VanDerWaalsContact O-N 3.17Å; I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.45Å; I132-V136 PolarHBondContact O-N 3.46Å; I132-A233 HydrophobicContact CD1-CB 4.16Å; I132-A237 HydrophobicContact CB-CB 4.32Å; I132-A237 HydrophobicContact CG2-CB 4.22Å
133N92.4Very high91.5Very high26 Ų2677.4 Ų77.414%0.13937%0.368CS..Hα-helixtrans-60.6-39.8179.3-75.2-28.1000112.4G129 E130 R137 M159 A237G129-N133 WeakPolarHBondContact O-CB 3.13Å; G129-N133 VanDerWaalsContact O-CG 3.28Å; G129-N133 PolarHBondContact O-N 3.37Å; G129-N133 PolarHBondContact O-ND2 3.37Å; E130-N133 PolarHBondContact O-N 3.11Å; N133-R137 WeakPolarHBondContact O-CB 3.21Å; N133-R137 PolarHBondContact O-N 2.92Å; N133-M159 HydrophobicContact CB-CE 4.29Å; N133-M159 VanDerWaalsContact O-CE 3.25Å; N133-M159 WeakPolarHBondContact O-CE 3.3Å; N133-A237 PolarHBondContact ND2-O 3Å
134T92Very high91.3Very high82 Ų8274.5 Ų74.550%0.50335%0.348SS..Hα-helixtrans-65.4-43.3175.9-57.60000111.3E130 R131 I132 R137 Y138E130-T134 WeakPolarHBondContact O-CB 3.39Å; E130-T134 PolarHBondContact O-N 3.3Å; E130-T134 PolarHBondContact O-OG1 3.36Å; R131-T134 PolarHBondContact O-N 3.03Å; I132-T134 VanDerWaalsContact C-N 3.31Å; I132-T134 PolarHBondContact O-N 2.69Å; T134-R137 PolarHBondContact O-N 3.48Å; T134-Y138 PolarHBondContact O-N 3.38Å
135F92.9Very high91.1Very high128 Ų12877.9 Ų77.956%0.56136%0.36SS*.Hα-helixtrans-63.5-45.7176.8179.1-103.6000111.9R131 I132 R137 Y138 L139R131-F135 WeakPolarHBondContact O-CB 3.19Å; R131-F135 PolarHBondContact O-N 2.92Å; I132-F135 WeakPolarHBondContact O-CB 3.02Å; I132-F135 PolarHBondContact O-N 3.07Å; I132-F135 VanDerWaalsContact O-N 3.17Å; F135-R137 VanDerWaalsContact C-N 3.33Å; F135-R137 PolarHBondContact O-N 3.31Å; F135-Y138 WeakPolarHBondContact O-CB 3.31Å; F135-Y138 PolarHBondContact O-N 3.06Å; F135-L139 HydrophobicContact CE1-CD2 4.49Å; F135-L139 WeakPolarHBondContact O-CB 3.37Å; F135-L139 PolarHBondContact O-N 3.49Å
136V91.4Very high91Very high38 Ų3881.7 Ų81.723%0.2339%0.389CS..Hα-helixtrans-60.5-43.1175.5169.80000110.9I132 Y138 L139 L140 M159 I162I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.45Å; I132-V136 PolarHBondContact O-N 3.46Å; V136-Y138 PolarHBondContact O-N 3.29Å; V136-L139 PolarHBondContact O-N 2.88Å; V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 PolarHBondContact O-N 3.45Å; V136-M159 HydrophobicContact CB-CE 4.43Å; V136-M159 HydrophobicContact CG1-CE 4.23Å; V136-M159 HydrophobicContact CG1-SD 4.44Å; V136-I162 HydrophobicContact CG1-CG2 3.73Å
137R90.6Very high91Very high117 Ų11784.7 Ų84.744%0.44241%0.406SS..Hα-helixtrans-60.6-45.1175.6179.3177.5-75-124.6-2111.7N133 T134 F135 H141 V154 M159N133-R137 WeakPolarHBondContact O-CB 3.21Å; N133-R137 PolarHBondContact O-N 2.92Å; T134-R137 PolarHBondContact O-N 3.48Å; F135-R137 VanDerWaalsContact C-N 3.33Å; F135-R137 PolarHBondContact O-N 3.31Å; R137-H141 WeakPolarHBondContact O-CB 3.47Å; R137-H141 PolarHBondContact O-N 3.26Å; R137-V154 HydrophobicContact CG-CB 4.12Å; R137-V154 HydrophobicContact CG-CG1 4.05Å; R137-V154 HydrophobicContact CG-CG2 4.29Å; R137-M159 HydrophobicContact CB-CE 4.08Å; R137-M159 HydrophobicContact CB-SD 3.86Å; R137-M159 HydrophobicContact CG-SD 4.43Å
138Y91.8Very high90.7Very high132 Ų13285.3 Ų85.352%0.51842%0.421SS..Hα-helixtrans-61.6-47.1176.2170.9-96000111.7T134 F135 V136 L140 H141 R142T134-Y138 PolarHBondContact O-N 3.38Å; F135-Y138 WeakPolarHBondContact O-CB 3.31Å; F135-Y138 PolarHBondContact O-N 3.06Å; V136-Y138 PolarHBondContact O-N 3.29Å; Y138-L140 PolarHBondContact O-N 3.04Å; Y138-H141 PolarHBondContact O-N 3.37Å; Y138-R142 PolarHBondContact O-N 3.33Å
139L91.8Very high90.3Very high77 Ų7787 Ų8740%0.40343%0.426SS..Hα-helixtrans-62.3-44.7179.3-17562.2000111.2F135 V136 H141 R142 L143F135-L139 HydrophobicContact CE1-CD2 4.49Å; F135-L139 WeakPolarHBondContact O-CB 3.37Å; F135-L139 PolarHBondContact O-N 3.49Å; V136-L139 PolarHBondContact O-N 2.88Å; L139-H141 PolarHBondContact O-N 2.98Å; L139-R142 PolarHBondContact O-N 3.35Å; L139-L143 HydrophobicContact CG-CD1 4.14Å; L139-L143 WeakPolarHBondContact O-CB 3.38Å; L139-L143 VanDerWaalsContact O-CG 3.31Å; L139-L143 WeakPolarHBondContact O-CG 3.31Å; L139-L143 PolarHBondContact O-N 2.71Å
140L89.9Confident89.5Confident29 Ų2999.1 Ų99.115%0.15247%0.471CS..Hα-helixtrans-63.3-42.2177.2-172.768.1000111.8V136 Y138 R142 L143 K144 V154 N158 I162V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 PolarHBondContact O-N 3.45Å; Y138-L140 PolarHBondContact O-N 3.04Å; L140-R142 VanDerWaalsContact C-N 3.32Å; L140-R142 PolarHBondContact O-N 2.97Å; L140-L143 PolarHBondContact O-N 2.9Å; L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 WeakPolarHBondContact O-CG 3.45Å; L140-K144 PolarHBondContact O-N 3.44Å; L140-V154 HydrophobicContact CB-CG2 4.46Å; L140-V154 HydrophobicContact CD2-CB 4.48Å; L140-V154 HydrophobicContact CD2-CG1 3.76Å; L140-V154 HydrophobicContact CD2-CG2 4.04Å; L140-V154 HydrophobicContact CG-CG2 4.39Å; L140-N158 HydrophobicContact CD2-CB 4.1Å; L140-I162 HydrophobicContact CB-CD1 4.47Å; L140-I162 HydrophobicContact CD1-CD1 3.69Å; L140-I162 HydrophobicContact CD2-CD1 3.48Å; L140-I162 VanDerWaalsContact CD2-CD1 3.48Å; L140-I162 HydrophobicContact CG-CD1 4.06Å
141H89.3Confident88.8Confident79 Ų79105.9 Ų105.937%0.36649%0.494SS..Hα-helixtrans-61-43.6175.8-176.577.5000111.2R137 Y138 L139 K144 K145 T152 V154R137-H141 WeakPolarHBondContact O-CB 3.47Å; R137-H141 PolarHBondContact O-N 3.26Å; Y138-H141 PolarHBondContact O-N 3.37Å; L139-H141 PolarHBondContact O-N 2.98Å; H141-K144 PolarHBondContact O-N 3Å; H141-K145 WeakPolarHBondContact O-CB 3.42Å; H141-K145 PolarHBondContact O-N 3.33Å; H141-T152 PolarHBondContact CE1-OG1 2.94Å; H141-T152 PolarHBondContact ND1-O 2.85Å; H141-V154 HydrophobicContact CB-CG2 4.19Å
142R90.2Very high87.9Confident142 Ų14299.3 Ų99.354%0.53647%0.474SS..Hα-helixtrans-63.8-43.7176-170.7171.9-179.8171-3.3111.9Y138 L139 L140 K145 C146Y138-R142 PolarHBondContact O-N 3.33Å; L139-R142 PolarHBondContact O-N 3.35Å; L140-R142 VanDerWaalsContact C-N 3.32Å; L140-R142 PolarHBondContact O-N 2.97Å; R142-K145 PolarHBondContact O-N 3.4Å; R142-C146 WeakPolarHBondContact O-CB 3.26Å; R142-C146 PolarHBondContact O-N 2.82Å; R142-C146 PolarHBondContact O-SG 3.24Å
143L89.6Confident87.3Confident88 Ų88104.5 Ų104.546%0.46150%0.497SS..Hα-helixtrans-61.5-48176.2-74.1171000111.8L139 L140 K145 C146 L147L139-L143 HydrophobicContact CG-CD1 4.14Å; L139-L143 WeakPolarHBondContact O-CB 3.38Å; L139-L143 VanDerWaalsContact O-CG 3.31Å; L139-L143 WeakPolarHBondContact O-CG 3.31Å; L139-L143 PolarHBondContact O-N 2.71Å; L140-L143 PolarHBondContact O-N 2.9Å; L143-K145 VanDerWaalsContact C-N 3.27Å; L143-K145 PolarHBondContact O-N 3.3Å; L143-C146 PolarHBondContact O-N 2.87Å; L143-L147 WeakPolarHBondContact O-CB 3.41Å; L143-L147 VanDerWaalsContact O-CG 3.27Å; L143-L147 WeakPolarHBondContact O-CG 3.43Å; L143-L147 PolarHBondContact O-N 3.28Å
144K89.3Confident87Confident27 Ų27104.1 Ų104.112%0.11750%0.496CS..Hα-helixtrans-59.6-38.5176.2-72.5-169.8178.7-170.80112.3L140 H141 L147 G148 M149 T152 E153 N158L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 WeakPolarHBondContact O-CG 3.45Å; L140-K144 PolarHBondContact O-N 3.44Å; H141-K144 PolarHBondContact O-N 3Å; K144-L147 PolarHBondContact O-N 2.93Å; K144-G148 PolarHBondContact O-N 2.98Å; K144-M149 HydrophobicContact CB-CB 4.41Å; K144-M149 HydrophobicContact CB-SD 4.09Å; K144-M149 HydrophobicContact CD-SD 4.26Å; K144-M149 HydrophobicContact CG-SD 3.74Å; K144-M149 WeakPolarHBondContact O-CB 3.31Å; K144-M149 PolarHBondContact O-N 2.89Å; K144-T152 HydrophobicContact CB-CG2 4.49Å; K144-E153 PolarHBondContact NZ-O 3.04Å; K144-E153 VanDerWaalsContact NZ-O 3.11Å; K144-N158 PolarHBondContact NZ-ND2 2.94Å; K144-N158 VanDerWaalsContact NZ-ND2 3.13Å
145K87.6Confident86.8Confident153 Ų153103.4 Ų103.467%0.66549%0.494SS*.Hα-helixtrans-67-43.8175.7-171.9176.5-178.6177.60111.7H141 R142 L143 L147 G148 T152H141-K145 WeakPolarHBondContact O-CB 3.42Å; H141-K145 PolarHBondContact O-N 3.33Å; R142-K145 PolarHBondContact O-N 3.4Å; L143-K145 VanDerWaalsContact C-N 3.27Å; L143-K145 PolarHBondContact O-N 3.3Å; K145-L147 VanDerWaalsContact C-N 3.31Å; K145-L147 PolarHBondContact O-N 3.42Å; K145-G148 PolarHBondContact O-N 3.45Å; K145-G148 VanDerWaalsContact O-N 3.16Å; K145-T152 HydrophobicContact CB-CG2 4.45Å
146C89.2Confident86.5Confident102 Ų102102.1 Ų102.169%0.68949%0.493SS*.Hα-helixtrans-64.6-34.7175.8-71.50000112.5R142 L143 G148R142-C146 WeakPolarHBondContact O-CB 3.26Å; R142-C146 PolarHBondContact O-N 2.82Å; R142-C146 PolarHBondContact O-SG 3.24Å; L143-C146 PolarHBondContact O-N 2.87Å; C146-G148 PolarHBondContact O-N 3.28Å
147L89.6Confident86.3Confident130 Ų130103.1 Ų103.168%0.68151%0.505SS*.THydrogen-bonded Turntrans-77.92.7175.4-67.4168000113.5L143 K144 K145 M149L143-L147 WeakPolarHBondContact O-CB 3.41Å; L143-L147 VanDerWaalsContact O-CG 3.27Å; L143-L147 WeakPolarHBondContact O-CG 3.43Å; L143-L147 PolarHBondContact O-N 3.28Å; K144-L147 PolarHBondContact O-N 2.93Å; K145-L147 VanDerWaalsContact C-N 3.31Å; K145-L147 PolarHBondContact O-N 3.42Å; L147-M149 VanDerWaalsContact C-N 3.28Å; L147-M149 HydrophobicContact CB-CG 4.21Å; L147-M149 PolarHBondContact O-N 3.33Å
148G84.8Confident86.3Confident65 Ų65100.2 Ų100.267%0.6750%0.498SS*.THydrogen-bonded Turntrans68.920.317700000114.6K144 K145 C146 R150K144-G148 PolarHBondContact O-N 2.98Å; K145-G148 PolarHBondContact O-N 3.45Å; K145-G148 VanDerWaalsContact O-N 3.16Å; C146-G148 PolarHBondContact O-N 3.28Å; G148-R150 PolarHBondContact O-N 3.14Å
149M84.8Confident86.3Confident93 Ų9394.2 Ų94.246%0.45848%0.475SS..  trans-70.1127.9-176.8-63.5-176.875.200111.4K144 L147 R151 T152K144-M149 HydrophobicContact CB-CB 4.41Å; K144-M149 HydrophobicContact CB-SD 4.09Å; K144-M149 HydrophobicContact CD-SD 4.26Å; K144-M149 HydrophobicContact CG-SD 3.74Å; K144-M149 WeakPolarHBondContact O-CB 3.31Å; K144-M149 PolarHBondContact O-N 2.89Å; L147-M149 VanDerWaalsContact C-N 3.28Å; L147-M149 HydrophobicContact CB-CG 4.21Å; L147-M149 PolarHBondContact O-N 3.33Å; M149-R151 PolarHBondContact O-N 2.94Å; M149-T152 WeakPolarHBondContact O-CG2 3.3Å
150R74.8Confident86.3Confident255 Ų25593 Ų9396%0.96247%0.471SS*.SBendtrans-64.8-20.4-178.9-159173177.5-177.5-0.7114.1G148G148-R150 PolarHBondContact O-N 3.14Å
151R75.1Confident86.4Confident218 Ų21895.4 Ų95.482%0.82349%0.486SS*.  trans-116.799.3173.4-71.7-174.6-178.9173.50.5110.5M149M149-R151 PolarHBondContact O-N 2.94Å
152T75.8Confident86.6Confident46 Ų4694.1 Ų94.128%0.28248%0.482SS..  trans-910.8-179.755.90000113.8H141 K144 K145 M149 V154H141-T152 PolarHBondContact CE1-OG1 2.94Å; H141-T152 PolarHBondContact ND1-O 2.85Å; K144-T152 HydrophobicContact CB-CG2 4.49Å; K145-T152 HydrophobicContact CB-CG2 4.45Å; M149-T152 WeakPolarHBondContact O-CG2 3.3Å; T152-V154 PolarHBondContact O-N 3.41Å
153E80.5Confident86.8Confident167 Ų16788 Ų8878%0.7846%0.462SS*.  trans-65.4134.3176.8-66.6-173.6177.500111.7K144 S155K144-E153 PolarHBondContact NZ-O 3.04Å; K144-E153 VanDerWaalsContact NZ-O 3.11Å; E153-S155 PolarHBondContact O-N 3.24Å
154V85.1Confident87Confident19 Ų1989 Ų8912%0.11546%0.463CS..  trans-96.893179.3178.80000108.5R137 L140 H141 T152 M159R137-V154 HydrophobicContact CG-CB 4.12Å; R137-V154 HydrophobicContact CG-CG1 4.05Å; R137-V154 HydrophobicContact CG-CG2 4.29Å; L140-V154 HydrophobicContact CB-CG2 4.46Å; L140-V154 HydrophobicContact CD2-CB 4.48Å; L140-V154 HydrophobicContact CD2-CG1 3.76Å; L140-V154 HydrophobicContact CD2-CG2 4.04Å; L140-V154 HydrophobicContact CG-CG2 4.39Å; H141-V154 HydrophobicContact CB-CG2 4.19Å; T152-V154 PolarHBondContact O-N 3.41Å; V154-M159 HydrophobicContact CG1-CG 3.67Å; V154-M159 HydrophobicContact CG1-SD 3.59Å; V154-M159 VanDerWaalsContact CG1-SD 3.59Å
155S88Confident87.3Confident66 Ų6692.3 Ų92.346%0.46248%0.481SS..  trans-61.2151.6171.9177.60000112.1E153 A157 N158 M159E153-S155 PolarHBondContact O-N 3.24Å; S155-A157 PolarHBondContact O-N 3.14Å; S155-A157 PolarHBondContact OG-N 3.41Å; S155-N158 WeakPolarHBondContact O-CB 3.43Å; S155-N158 PolarHBondContact O-N 3.02Å; S155-N158 VanDerWaalsContact O-N 3.17Å; S155-M159 PolarHBondContact O-N 3.45Å
156L86.9Confident87.7Confident102 Ų10287.4 Ų87.453%0.53447%0.466SS..Hα-helixtrans-54.9-40.1172.3179.263000111.7N158 M159 V160 L241L156-N158 VanDerWaalsContact C-N 3.32Å; L156-N158 PolarHBondContact O-N 3.44Å; L156-M159 WeakPolarHBondContact O-CB 3.49Å; L156-M159 PolarHBondContact O-N 3.44Å; L156-M159 VanDerWaalsContact O-N 3.1Å; L156-V160 HydrophobicContact CD1-CG2 4.23Å; L156-V160 HydrophobicContact CG-CG2 4.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.37Å; L156-V160 PolarHBondContact O-N 2.86Å; L156-L241 HydrophobicContact CD1-CD1 3.73Å; L156-L241 HydrophobicContact CD1-CG 4.29Å
157A88.1Confident88.1Confident58 Ų5883 Ų8348%0.47944%0.436SS..Hα-helixtrans-57.3-44.8177.900000111.6S155 M159 V160 T161S155-A157 PolarHBondContact O-N 3.14Å; S155-A157 PolarHBondContact OG-N 3.41Å; A157-M159 VanDerWaalsContact C-N 3.31Å; A157-M159 PolarHBondContact O-N 3.17Å; A157-V160 PolarHBondContact O-N 3.27Å; A157-T161 PolarHBondContact O-N 3.46Å; A157-T161 PolarHBondContact O-OG1 2.77Å
158N90.2Very high88.4Confident57 Ų5779.9 Ų79.931%0.30542%0.419SS..Hα-helixtrans-61.7-40.1177.4-60.9-30.7000111.7L140 K144 S155 L156 I162L140-N158 HydrophobicContact CD2-CB 4.1Å; K144-N158 PolarHBondContact NZ-ND2 2.94Å; K144-N158 VanDerWaalsContact NZ-ND2 3.13Å; S155-N158 WeakPolarHBondContact O-CB 3.43Å; S155-N158 PolarHBondContact O-N 3.02Å; S155-N158 VanDerWaalsContact O-N 3.17Å; L156-N158 VanDerWaalsContact C-N 3.32Å; L156-N158 PolarHBondContact O-N 3.44Å; N158-I162 WeakPolarHBondContact O-CB 3.32Å; N158-I162 WeakPolarHBondContact O-CD1 3.43Å; N158-I162 VanDerWaalsContact O-CG1 3.23Å; N158-I162 WeakPolarHBondContact O-CG1 3.5Å; N158-I162 PolarHBondContact O-N 2.9Å
159M91.4Very high89Confident6 Ų679.7 Ų79.73%0.0341%0.407CS..Hα-helixtrans-66.1-43.1178-68.1-65.8-60.100111.6N133 V136 R137 V154 S155 L156 A157 I162 G163 L241N133-M159 HydrophobicContact CB-CE 4.29Å; N133-M159 VanDerWaalsContact O-CE 3.25Å; N133-M159 WeakPolarHBondContact O-CE 3.3Å; V136-M159 HydrophobicContact CB-CE 4.43Å; V136-M159 HydrophobicContact CG1-CE 4.23Å; V136-M159 HydrophobicContact CG1-SD 4.44Å; R137-M159 HydrophobicContact CB-CE 4.08Å; R137-M159 HydrophobicContact CB-SD 3.86Å; R137-M159 HydrophobicContact CG-SD 4.43Å; V154-M159 HydrophobicContact CG1-CG 3.67Å; V154-M159 HydrophobicContact CG1-SD 3.59Å; V154-M159 VanDerWaalsContact CG1-SD 3.59Å; S155-M159 PolarHBondContact O-N 3.45Å; L156-M159 WeakPolarHBondContact O-CB 3.49Å; L156-M159 PolarHBondContact O-N 3.44Å; L156-M159 VanDerWaalsContact O-N 3.1Å; A157-M159 VanDerWaalsContact C-N 3.31Å; A157-M159 PolarHBondContact O-N 3.17Å; M159-I162 PolarHBondContact O-N 3.15Å; M159-G163 PolarHBondContact O-N 2.93Å; M159-L241 HydrophobicContact CB-CD1 4.43Å; M159-L241 HydrophobicContact CB-CD2 3.7Å
160V92Very high89.6Confident52 Ų5276.5 Ų76.532%0.31539%0.393SS..Hα-helixtrans-64.4-43.8177.3173.30000110.5L156 A157 G163 F164 F238 L241L156-V160 HydrophobicContact CD1-CG2 4.23Å; L156-V160 HydrophobicContact CG-CG2 4.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.37Å; L156-V160 PolarHBondContact O-N 2.86Å; A157-V160 PolarHBondContact O-N 3.27Å; V160-G163 PolarHBondContact O-N 3.17Å; V160-F164 WeakPolarHBondContact O-CB 3.43Å; V160-F164 PolarHBondContact O-N 3.06Å; V160-F238 HydrophobicContact CG1-CE2 4.28Å; V160-L241 HydrophobicContact CG2-CD2 3.92Å; V160-L241 HydrophobicContact CG2-CG 4.32Å
161T92.2Very high90.7Very high79 Ų7964.7 Ų64.749%0.48535%0.349SS..Hα-helixtrans-60.9-46.7176.2-55.90000111.9A157 F164 I165A157-T161 PolarHBondContact O-N 3.46Å; A157-T161 PolarHBondContact O-OG1 2.77Å; T161-F164 PolarHBondContact O-N 3.46Å; T161-I165 HydrophobicContact CG2-CD1 3.98Å; T161-I165 VanDerWaalsContact O-CG1 3.3Å; T161-I165 WeakPolarHBondContact O-CG1 3.43Å; T161-I165 PolarHBondContact O-N 2.92Å
162I93.9Very high91.8Very high52 Ų5256.8 Ų56.827%0.26733%0.327SS..Hα-helixtrans-65.3-41.4177.8-67.9163.8000110.9V136 L140 N158 M159 F164 I165 S166V136-I162 HydrophobicContact CG1-CG2 3.73Å; L140-I162 HydrophobicContact CB-CD1 4.47Å; L140-I162 HydrophobicContact CD1-CD1 3.69Å; L140-I162 HydrophobicContact CD2-CD1 3.48Å; L140-I162 VanDerWaalsContact CD2-CD1 3.48Å; L140-I162 HydrophobicContact CG-CD1 4.06Å; N158-I162 WeakPolarHBondContact O-CB 3.32Å; N158-I162 WeakPolarHBondContact O-CD1 3.43Å; N158-I162 VanDerWaalsContact O-CG1 3.23Å; N158-I162 WeakPolarHBondContact O-CG1 3.5Å; N158-I162 PolarHBondContact O-N 2.9Å; M159-I162 PolarHBondContact O-N 3.15Å; I162-F164 VanDerWaalsContact C-N 3.33Å; I162-F164 PolarHBondContact O-N 3.42Å; I162-I165 PolarHBondContact O-N 3.11Å; I162-S166 WeakPolarHBondContact O-CB 3.42Å; I162-S166 PolarHBondContact O-N 3.47Å
163G93.9Very high92.8Very high12 Ų1259 Ų5912%0.12434%0.34CS..Hα-helixtrans-59.8-44176.100000112M159 V160 S166 C167M159-G163 PolarHBondContact O-N 2.93Å; V160-G163 PolarHBondContact O-N 3.17Å; G163-S166 WeakPolarHBondContact O-CB 3.48Å; G163-S166 PolarHBondContact O-N 3.5Å; G163-C167 PolarHBondContact O-N 3.38Å; G163-C167 PolarHBondContact O-SG 3.06Å
164F94.4Very high93.6Very high111 Ų11151.1 Ų51.149%0.48730%0.303SS..Hα-helixtrans-62.6-46.9175.7-176.4-98.9000112.1V160 T161 I162 S166 C167 M168 F238V160-F164 WeakPolarHBondContact O-CB 3.43Å; V160-F164 PolarHBondContact O-N 3.06Å; T161-F164 PolarHBondContact O-N 3.46Å; I162-F164 VanDerWaalsContact C-N 3.33Å; I162-F164 PolarHBondContact O-N 3.42Å; F164-S166 VanDerWaalsContact C-N 3.3Å; F164-S166 PolarHBondContact O-N 2.77Å; F164-C167 PolarHBondContact O-N 3.25Å; F164-M168 HydrophobicContact CD1-CG 4.33Å; F164-M168 HydrophobicContact CE1-CG 3.96Å; F164-M168 HydrophobicContact CE2-CE 3.74Å; F164-M168 HydrophobicContact CZ-CE 3.78Å; F164-M168 HydrophobicContact CZ-CG 4.09Å; F164-M168 HydrophobicContact CZ-SD 4.46Å; F164-M168 WeakPolarHBondContact O-CG 3.37Å; F164-M168 PolarHBondContact O-N 3.43Å; F164-F238 HydrophobicContact CB-CE2 4.28Å
165I95.6Very high94.2Very high95 Ų9550.2 Ų50.249%0.48730%0.297SS..Hα-helixtrans-60.2-41.2175.5-67.6166.6000110.9T161 I162 M168 S169T161-I165 HydrophobicContact CG2-CD1 3.98Å; T161-I165 VanDerWaalsContact O-CG1 3.3Å; T161-I165 WeakPolarHBondContact O-CG1 3.43Å; T161-I165 PolarHBondContact O-N 2.92Å; I162-I165 PolarHBondContact O-N 3.11Å; I165-M168 PolarHBondContact O-N 3.15Å; I165-S169 VanDerWaalsContact O-CB 3.32Å; I165-S169 WeakPolarHBondContact O-CB 3.47Å; I165-S169 PolarHBondContact O-N 3.38Å; I165-S169 PolarHBondContact O-OG 3.23Å
166S95.8Very high94.6Very high50 Ų5053.4 Ų53.435%0.3531%0.307SS..Hα-helixtrans-61.7-45.5176.6-170.50000111.5I162 G163 F164 S169 T170 V234I162-S166 WeakPolarHBondContact O-CB 3.42Å; I162-S166 PolarHBondContact O-N 3.47Å; G163-S166 WeakPolarHBondContact O-CB 3.48Å; G163-S166 PolarHBondContact O-N 3.5Å; F164-S166 VanDerWaalsContact C-N 3.3Å; F164-S166 PolarHBondContact O-N 2.77Å; S166-S169 PolarHBondContact O-N 3.45Å; S166-T170 PolarHBondContact O-N 3.48Å; S166-T170 PolarHBondContact O-OG1 2.99Å; S166-V234 WeakPolarHBondContact OG-CG1 3.45Å
167C96.3Very high95.1Very high9 Ų949.4 Ų49.46%0.06129%0.288CS..Hα-helixtrans-61.1-48177.5-64.10000111.3G163 F164 S169 T170 L171 I235G163-C167 PolarHBondContact O-N 3.38Å; G163-C167 PolarHBondContact O-SG 3.06Å; F164-C167 PolarHBondContact O-N 3.25Å; C167-S169 VanDerWaalsContact C-N 3.32Å; C167-S169 PolarHBondContact O-N 3Å; C167-T170 PolarHBondContact O-N 3.3Å; C167-L171 WeakPolarHBondContact O-CG 3.46Å; C167-L171 PolarHBondContact O-N 2.81Å; C167-I235 HydrophobicContact CB-CD1 3.8Å
168M96.9Very high95.4Very high66 Ų6646.6 Ų46.633%0.32527%0.266SS..Hα-helixtrans-61.3-41177.5-68.7-63.4142.100112F164 I165 L171 C172 Y190F164-M168 HydrophobicContact CD1-CG 4.33Å; F164-M168 HydrophobicContact CE1-CG 3.96Å; F164-M168 HydrophobicContact CE2-CE 3.74Å; F164-M168 HydrophobicContact CZ-CE 3.78Å; F164-M168 HydrophobicContact CZ-CG 4.09Å; F164-M168 HydrophobicContact CZ-SD 4.46Å; F164-M168 WeakPolarHBondContact O-CG 3.37Å; F164-M168 PolarHBondContact O-N 3.43Å; I165-M168 PolarHBondContact O-N 3.15Å; M168-L171 HydrophobicContact CE-CD1 4.49Å; M168-L171 PolarHBondContact O-N 2.87Å; M168-L171 HydrophobicContact SD-CD1 4.47Å; M168-C172 PolarHBondContact O-N 3Å; M168-C172 PolarHBondContact O-SG 3.46Å; M168-Y190 PolarHBondContact SD-OH 3.39Å; M168-Y190 VanDerWaalsContact SD-OH 3.39Å
169S96.8Very high95.7Very high61 Ų6145.2 Ų45.243%0.42726%0.26SS..Hα-helixtrans-63.6-43.5177.3-57.30000111.7I165 S166 C167 L171 C172 V173I165-S169 VanDerWaalsContact O-CB 3.32Å; I165-S169 WeakPolarHBondContact O-CB 3.47Å; I165-S169 PolarHBondContact O-N 3.38Å; I165-S169 PolarHBondContact O-OG 3.23Å; S166-S169 PolarHBondContact O-N 3.45Å; C167-S169 VanDerWaalsContact C-N 3.32Å; C167-S169 PolarHBondContact O-N 3Å; S169-L171 PolarHBondContact O-N 2.58Å; S169-C172 PolarHBondContact O-N 3.2Å; S169-V173 WeakPolarHBondContact O-CB 3.47Å; S169-V173 VanDerWaalsContact O-CG2 3.31Å; S169-V173 WeakPolarHBondContact O-CG2 3.43Å; S169-V173 PolarHBondContact O-N 3.36Å
170T97.2Very high95.8Very high25 Ų2552.1 Ų52.115%0.15329%0.292CS..Hα-helixtrans-59.1-45.6175.6-61.30000111.5S166 C167 V173 G174 L197 Y227S166-T170 PolarHBondContact O-N 3.48Å; S166-T170 PolarHBondContact O-OG1 2.99Å; C167-T170 PolarHBondContact O-N 3.3Å; T170-V173 PolarHBondContact O-N 2.98Å; T170-G174 PolarHBondContact O-N 3.44Å; T170-L197 HydrophobicContact CG2-CD1 3.8Å; T170-Y227 HydrophobicContact CG2-CE2 4.19Å; T170-Y227 PolarHBondContact O-OH 3.16Å
171L98.1Very high95.7Very high7 Ų753.9 Ų53.94%0.03730%0.296CS..Hα-helixtrans-61.8-44.7177-66.2172.5000112C167 M168 S169 G174 A175 Y190 C193 F194 L197C167-L171 WeakPolarHBondContact O-CG 3.46Å; C167-L171 PolarHBondContact O-N 2.81Å; M168-L171 HydrophobicContact CE-CD1 4.49Å; M168-L171 PolarHBondContact O-N 2.87Å; M168-L171 HydrophobicContact SD-CD1 4.47Å; S169-L171 PolarHBondContact O-N 2.58Å; L171-G174 PolarHBondContact O-N 3.41Å; L171-A175 VanDerWaalsContact O-CB 3.28Å; L171-A175 WeakPolarHBondContact O-CB 3.27Å; L171-A175 PolarHBondContact O-N 3.12Å; L171-Y190 HydrophobicContact CB-CD2 4.18Å; L171-Y190 HydrophobicContact CB-CE2 3.55Å; L171-Y190 HydrophobicContact CD1-CE1 4.35Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.45Å; L171-C193 HydrophobicContact CD2-CB 3.92Å; L171-F194 HydrophobicContact CD1-CD2 4.03Å; L171-F194 HydrophobicContact CD2-CB 4.22Å; L171-L197 HydrophobicContact CD2-CD1 4.05Å
172C97.9Very high95.7Very high53 Ų5350.5 Ų50.536%0.35828%0.275SS..Hα-helixtrans-64.7-42.5178.3-69.70000112.9M168 S169 A175 M176M168-C172 PolarHBondContact O-N 3Å; M168-C172 PolarHBondContact O-SG 3.46Å; S169-C172 PolarHBondContact O-N 3.2Å; C172-A175 PolarHBondContact O-N 3.28Å; C172-M176 WeakPolarHBondContact O-CB 3.3Å; C172-M176 PolarHBondContact O-N 2.94Å
173V97.4Very high95.6Very high93 Ų9355.5 Ų55.556%0.56430%0.297SS*.Hα-helixtrans-64.5-43.5177.5170.20000110.6S169 T170 M176 A177S169-V173 WeakPolarHBondContact O-CB 3.47Å; S169-V173 VanDerWaalsContact O-CG2 3.31Å; S169-V173 WeakPolarHBondContact O-CG2 3.43Å; S169-V173 PolarHBondContact O-N 3.36Å; T170-V173 PolarHBondContact O-N 2.98Å; V173-M176 PolarHBondContact O-N 2.63Å; V173-A177 PolarHBondContact O-N 3.26Å; V173-A177 VanDerWaalsContact O-N 3.1Å
174G97.3Very high95.7Very high0 Ų057.1 Ų57.10%030%0.299CS..Hα-helixtrans-60.1-50.2173.500000112.1T170 L171 M176 A177 F178 Y227T170-G174 PolarHBondContact O-N 3.44Å; L171-G174 PolarHBondContact O-N 3.41Å; G174-M176 VanDerWaalsContact C-N 3.3Å; G174-M176 PolarHBondContact O-N 3.16Å; G174-A177 PolarHBondContact O-N 3.34Å; G174-A177 VanDerWaalsContact O-N 3.11Å; G174-F178 WeakPolarHBondContact O-CD2 3.46Å; G174-F178 PolarHBondContact O-N 3.38Å; G174-Y227 WeakPolarHBondContact CA-OH 3.34Å
175A97.7Very high95.8Very high0 Ų054.6 Ų54.60%030%0.295CS..Hα-helixtrans-56.4-44179.400000112L171 C172 S179 F186 A189 Y190L171-A175 VanDerWaalsContact O-CB 3.28Å; L171-A175 WeakPolarHBondContact O-CB 3.27Å; L171-A175 PolarHBondContact O-N 3.12Å; C172-A175 PolarHBondContact O-N 3.28Å; A175-S179 WeakPolarHBondContact O-CB 3.43Å; A175-S179 PolarHBondContact O-N 3.13Å; A175-S179 PolarHBondContact O-OG 2.95Å; A175-F186 HydrophobicContact CB-CD2 3.98Å; A175-F186 HydrophobicContact CB-CE1 4.32Å; A175-F186 HydrophobicContact CB-CE2 3.55Å; A175-F186 HydrophobicContact CB-CZ 3.74Å; A175-A189 HydrophobicContact CB-CB 4.3Å; A175-A189 VanDerWaalsContact O-CB 3.29Å; A175-A189 WeakPolarHBondContact O-CB 3.44Å; A175-Y190 HydrophobicContact CB-CD2 3.99Å; A175-Y190 HydrophobicContact CB-CG 4.36Å
176M97.3Very high95.9Very high133 Ų13355 Ų5566%0.65529%0.293SS*.Hα-helixtrans-60.9-47176.2-173.1-178.2-65.300111.6C172 V173 G174 S179 H180 F186C172-M176 WeakPolarHBondContact O-CB 3.3Å; C172-M176 PolarHBondContact O-N 2.94Å; V173-M176 PolarHBondContact O-N 2.63Å; G174-M176 VanDerWaalsContact C-N 3.3Å; G174-M176 PolarHBondContact O-N 3.16Å; M176-S179 PolarHBondContact O-OG 3.22Å; M176-H180 PolarHBondContact O-N 3Å; M176-F186 HydrophobicContact CB-CE2 4.43Å
177A95.8Very high96Very high18 Ų1859.7 Ų59.715%0.14931%0.308CS..Hα-helixtrans-66.4-49.5179.500000112.5V173 G174 H180 F181 F223V173-A177 PolarHBondContact O-N 3.26Å; V173-A177 VanDerWaalsContact O-N 3.1Å; G174-A177 PolarHBondContact O-N 3.34Å; G174-A177 VanDerWaalsContact O-N 3.11Å; A177-H180 PolarHBondContact O-N 3.19Å; A177-F181 HydrophobicContact CB-CD2 4.39Å; A177-F181 HydrophobicContact CB-CE2 4.42Å; A177-F181 WeakPolarHBondContact O-CD2 3.37Å; A177-F181 PolarHBondContact O-N 3.32Å; A177-F223 HydrophobicContact CB-CE1 3.71Å; A177-F223 HydrophobicContact CB-CE2 4.4Å; A177-F223 HydrophobicContact CB-CZ 3.38Å
178F95.6Very high96.1Very high0 Ų062.5 Ų62.50%032%0.32CS..Hα-helixtrans-69.7-33.2-177.8-71-66.9000112.8G174 H180 F181 E182 A189 Y192 A207 Y220 F223 Y227G174-F178 WeakPolarHBondContact O-CD2 3.46Å; G174-F178 PolarHBondContact O-N 3.38Å; F178-H180 PolarHBondContact O-N 2.96Å; F178-F181 PolarHBondContact O-N 3.08Å; F178-E182 WeakPolarHBondContact O-CB 3.32Å; F178-E182 PolarHBondContact O-N 2.96Å; F178-A189 HydrophobicContact CB-CB 4.12Å; F178-Y192 HydrophobicContact CB-CD1 4.45Å; F178-Y192 AromaticContact CD1-CE1 3.98Å; F178-Y192 HydrophobicContact CD1-CE1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 4.02Å; F178-Y192 AromaticContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CE1-CE1 4.03Å; F178-Y192 HydrophobicContact CE2-CD1 4.47Å; F178-Y192 AromaticContact CE2-CE1 3.79Å; F178-Y192 HydrophobicContact CE2-CE1 3.79Å; F178-Y192 HydrophobicContact CG-CD1 4.1Å; F178-Y192 AromaticContact CG-CE1 3.86Å; F178-Y192 HydrophobicContact CG-CE1 3.86Å; F178-Y192 AromaticContact CZ-CE1 3.94Å; F178-Y192 HydrophobicContact CZ-CE1 3.94Å; F178-A207 HydrophobicContact CD1-CB 3.93Å; F178-A207 HydrophobicContact CE1-CB 3.65Å; F178-Y220 HydrophobicContact CD1-CE2 4.27Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.49Å; F178-Y220 HydrophobicContact CE1-CE2 4.05Å; F178-F223 HydrophobicContact CE1-CE1 4.42Å; F178-F223 HydrophobicContact CE2-CE1 4.46Å; F178-F223 HydrophobicContact CZ-CE1 4.13Å; F178-Y227 AromaticContact CE2-CD1 3.52Å; F178-Y227 HydrophobicContact CE2-CD1 3.52Å; F178-Y227 AromaticContact CE2-CE1 3.64Å; F178-Y227 HydrophobicContact CE2-CE1 3.64Å; F178-Y227 HydrophobicContact CE2-CG 4.06Å; F178-Y227 AromaticContact CZ-CD1 3.93Å; F178-Y227 HydrophobicContact CZ-CD1 3.93Å; F178-Y227 HydrophobicContact CZ-CE1 4.44Å; F178-Y227 HydrophobicContact CZ-CG 4.41Å
179S96.4Very high96.1Very high28 Ų2859.3 Ų59.320%0.19630%0.304CS..Hα-helixtrans-60.1-36.9171.666.90000112A175 M176 E183 W184A175-S179 WeakPolarHBondContact O-CB 3.43Å; A175-S179 PolarHBondContact O-N 3.13Å; A175-S179 PolarHBondContact O-OG 2.95Å; M176-S179 PolarHBondContact O-OG 3.22Å; S179-E183 WeakPolarHBondContact O-CA 3.32Å; S179-E183 PolarHBondContact O-N 3.45Å; S179-W184 WeakPolarHBondContact CA-O 3.25Å; S179-W184 VanDerWaalsContact CB-O 3.29Å; S179-W184 WeakPolarHBondContact CB-O 3.47Å; S179-W184 PolarHBondContact O-N 3.08Å
180H92.8Very high96.2Very high150 Ų15059.1 Ų59.169%0.69430%0.295SS*.Hα-helixtrans-75.1-44.6177.3-172.875.3000112.8M176 A177 F178M176-H180 PolarHBondContact O-N 3Å; A177-H180 PolarHBondContact O-N 3.19Å; F178-H180 PolarHBondContact O-N 2.96Å
181F91.4Very high96.2Very high90 Ų9061.1 Ų61.140%0.39530%0.3SS..Hα-helixtrans-76.1-36.8-175.6-74.9-62.1000114.1A177 F178 Y220 F223A177-F181 HydrophobicContact CB-CD2 4.39Å; A177-F181 HydrophobicContact CB-CE2 4.42Å; A177-F181 WeakPolarHBondContact O-CD2 3.37Å; A177-F181 PolarHBondContact O-N 3.32Å; F178-F181 PolarHBondContact O-N 3.08Å; F181-Y220 HydrophobicContact CB-CD2 4.04Å; F181-Y220 HydrophobicContact CB-CE1 4.3Å; F181-Y220 HydrophobicContact CB-CE2 3.55Å; F181-Y220 AromaticContact CD1-CD2 3.96Å; F181-Y220 HydrophobicContact CD1-CD2 3.96Å; F181-Y220 HydrophobicContact CD1-CE2 4.34Å; F181-Y220 HydrophobicContact CD1-CG 4.32Å; F181-Y220 AromaticContact CD2-CD2 3.73Å; F181-Y220 HydrophobicContact CD2-CD2 3.73Å; F181-Y220 AromaticContact CD2-CE2 3.65Å; F181-Y220 HydrophobicContact CD2-CE2 3.65Å; F181-Y220 HydrophobicContact CE1-CD2 4.34Å; F181-Y220 HydrophobicContact CE2-CD2 4.14Å; F181-Y220 HydrophobicContact CE2-CE2 4.44Å; F181-Y220 AromaticContact CG-CD2 3.65Å; F181-Y220 HydrophobicContact CG-CD2 3.65Å; F181-Y220 AromaticContact CG-CE2 3.6Å; F181-Y220 HydrophobicContact CG-CE2 3.6Å; F181-Y220 HydrophobicContact CG-CG 4.37Å; F181-Y220 HydrophobicContact CZ-CD2 4.43Å; F181-F223 HydrophobicContact CD2-CE1 4.49Å; F181-F223 HydrophobicContact CE2-CD1 4.28Å; F181-F223 HydrophobicContact CE2-CE1 4.34Å
182E91.2Very high96.2Very high8 Ų861 Ų614%0.03730%0.299CS..Hα-helixtrans-102.32.1-175.8-65.7-70.4177.700113.1F178 W184 A207 L208 N210 Y220F178-E182 WeakPolarHBondContact O-CB 3.32Å; F178-E182 PolarHBondContact O-N 2.96Å; E182-W184 HydrophobicContact CB-CD2 3.55Å; E182-W184 VanDerWaalsContact CB-CE2 3.47Å; E182-W184 HydrophobicContact CB-CE3 3.95Å; E182-W184 HydrophobicContact CB-CG 3.94Å; E182-W184 HydrophobicContact CB-CH2 4.21Å; E182-W184 HydrophobicContact CB-CZ2 3.83Å; E182-W184 HydrophobicContact CB-CZ3 4.26Å; E182-W184 HydrophobicContact CG-CD2 4.37Å; E182-W184 HydrophobicContact CG-CE3 4.41Å; E182-W184 HydrophobicContact CG-CH2 4Å; E182-W184 HydrophobicContact CG-CZ2 3.94Å; E182-W184 HydrophobicContact CG-CZ3 4.23Å; E182-W184 PolarHBondContact O-N 3.43Å; E182-W184 PolarHBondContact O-NE1 3.24Å; E182-A207 WeakPolarHBondContact OE1-CA 3.47Å; E182-L208 PolarHBondContact OE1-N 2.91Å; E182-N210 WeakPolarHBondContact OE2-CB 3.45Å; E182-N210 PolarHBondContact OE2-ND2 2.84Å; E182-Y220 VanDerWaalsContact CG-OH 3.31Å; E182-Y220 WeakPolarHBondContact CG-OH 3.31Å; E182-Y220 PolarHBondContact OE1-OH 2.86Å
183E92.6Very high96.2Very high156 Ų15658.4 Ų58.473%0.72928%0.282SS*.  trans58.427.4-178.9-58.3172.9173.900112.9S179S179-E183 WeakPolarHBondContact O-CA 3.32Å; S179-E183 PolarHBondContact O-N 3.45Å
184W95.4Very high96.3Very high47 Ų4758.4 Ų58.418%0.17827%0.274CS..  trans-84.4158.1176.6-62.5-18.9000112S179 E182 H188 A189 Y192 Y205S179-W184 WeakPolarHBondContact CA-O 3.25Å; S179-W184 VanDerWaalsContact CB-O 3.29Å; S179-W184 WeakPolarHBondContact CB-O 3.47Å; S179-W184 PolarHBondContact O-N 3.08Å; E182-W184 HydrophobicContact CB-CD2 3.55Å; E182-W184 VanDerWaalsContact CB-CE2 3.47Å; E182-W184 HydrophobicContact CB-CE3 3.95Å; E182-W184 HydrophobicContact CB-CG 3.94Å; E182-W184 HydrophobicContact CB-CH2 4.21Å; E182-W184 HydrophobicContact CB-CZ2 3.83Å; E182-W184 HydrophobicContact CB-CZ3 4.26Å; E182-W184 HydrophobicContact CG-CD2 4.37Å; E182-W184 HydrophobicContact CG-CE3 4.41Å; E182-W184 HydrophobicContact CG-CH2 4Å; E182-W184 HydrophobicContact CG-CZ2 3.94Å; E182-W184 HydrophobicContact CG-CZ3 4.23Å; E182-W184 PolarHBondContact O-N 3.43Å; E182-W184 PolarHBondContact O-NE1 3.24Å; W184-H188 HydrophobicContact CB-CB 4.34Å; W184-A189 HydrophobicContact CE3-CB 4.45Å; W184-Y192 HydrophobicContact CH2-CD2 4.49Å; W184-Y192 HydrophobicContact CH2-CG 4.43Å; W184-Y192 AromaticContact CZ3-CD1 3.87Å; W184-Y192 HydrophobicContact CZ3-CD1 3.87Å; W184-Y192 HydrophobicContact CZ3-CD2 4.24Å; W184-Y192 HydrophobicContact CZ3-CE1 4.45Å; W184-Y192 AromaticContact CZ3-CG 3.75Å; W184-Y192 HydrophobicContact CZ3-CG 3.75Å; W184-Y205 AromaticContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CE1 4.26Å; W184-Y205 AromaticContact CE2-CD1 3.7Å; W184-Y205 HydrophobicContact CE3-CD1 4.05Å; W184-Y205 HydrophobicContact CG-CD1 4.38Å; W184-Y205 HydrophobicContact CG-CE1 4.37Å; W184-Y205 HydrophobicContact CH2-CD1 4.14Å; W184-Y205 AromaticContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ3-CD1 4.21Å
185S97.3Very high96.3Very high57 Ų5758.9 Ų58.940%0.39928%0.277SS..  trans-62.4150.5166.381.20000110.1F187 H188 A189S185-F187 PolarHBondContact O-N 3.23Å; S185-H188 PolarHBondContact O-N 3.05Å; S185-H188 VanDerWaalsContact O-N 3.15Å; S185-H188 PolarHBondContact OG-CD2 3.48Å; S185-H188 PolarHBondContact OG-N 3.34Å; S185-A189 PolarHBondContact O-N 3.43Å
186F97.4Very high96.3Very high104 Ų10458.9 Ų58.946%0.45628%0.277SS..Hα-helixtrans-55.2-36.9177.1-178.2-91.7000111.8A175 M176 A189 Y190A175-F186 HydrophobicContact CB-CD2 3.98Å; A175-F186 HydrophobicContact CB-CE1 4.32Å; A175-F186 HydrophobicContact CB-CE2 3.55Å; A175-F186 HydrophobicContact CB-CZ 3.74Å; M176-F186 HydrophobicContact CB-CE2 4.43Å; F186-A189 PolarHBondContact O-N 2.83Å; F186-Y190 HydrophobicContact CE1-CD2 4.23Å; F186-Y190 HydrophobicContact CZ-CD2 4.4Å; F186-Y190 VanDerWaalsContact O-CB 3.27Å; F186-Y190 WeakPolarHBondContact O-CB 3.43Å; F186-Y190 PolarHBondContact O-N 3.01Å
187F97.8Very high96.3Very high148 Ų14852.7 Ų52.765%0.64925%0.246SC*.Hα-helixtrans-63.5-48.9177.3179.2-100.2000112.3S185 A189 Y190 Y191S185-F187 PolarHBondContact O-N 3.23Å; F187-A189 VanDerWaalsContact C-N 3.33Å; F187-A189 PolarHBondContact O-N 3.4Å; F187-Y190 PolarHBondContact O-N 2.82Å; F187-Y191 WeakPolarHBondContact O-CB 3.46Å; F187-Y191 PolarHBondContact O-N 3.33Å
188H97.3Very high96.3Very high68 Ų6854.1 Ų54.132%0.31525%0.253SS..Hα-helixtrans-64.1-38.8177.4-68.2-51.6000112W184 S185 Y190 Y191 Y192 Y205W184-H188 HydrophobicContact CB-CB 4.34Å; S185-H188 PolarHBondContact O-N 3.05Å; S185-H188 VanDerWaalsContact O-N 3.15Å; S185-H188 PolarHBondContact OG-CD2 3.48Å; S185-H188 PolarHBondContact OG-N 3.34Å; H188-Y190 VanDerWaalsContact C-N 3.34Å; H188-Y191 PolarHBondContact O-N 3.28Å; H188-Y192 WeakPolarHBondContact O-CB 3.45Å; H188-Y192 PolarHBondContact O-N 3.42Å; H188-Y205 HydrophobicContact CB-CD1 4.39Å; H188-Y205 HydrophobicContact CB-CE1 3.78Å; H188-Y205 PolarHBondContact CE1-OH 2.93Å; H188-Y205 VanDerWaalsContact CE1-OH 3.3Å; H188-Y205 AromaticContact CG-CZ 3.69Å; H188-Y205 AromaticContact ND1-CZ 3.62Å; H188-Y205 PolarHBondContact ND1-OH 3.34Å; H188-Y205 VanDerWaalsContact ND1-OH 3.14Å
189A97.9Very high96.4Very high0 Ų056.7 Ų56.70%027%0.269CS..Hα-helixtrans-65.4-37.7175.100000112.3A175 F178 W184 S185 F186 F187 C193A175-A189 HydrophobicContact CB-CB 4.3Å; A175-A189 VanDerWaalsContact O-CB 3.29Å; A175-A189 WeakPolarHBondContact O-CB 3.44Å; F178-A189 HydrophobicContact CB-CB 4.12Å; W184-A189 HydrophobicContact CE3-CB 4.45Å; S185-A189 PolarHBondContact O-N 3.43Å; F186-A189 PolarHBondContact O-N 2.83Å; F187-A189 VanDerWaalsContact C-N 3.33Å; F187-A189 PolarHBondContact O-N 3.4Å; A189-C193 WeakPolarHBondContact O-CB 3.39Å; A189-C193 PolarHBondContact O-N 2.81Å; A189-C193 PolarHBondContact O-SG 3.37Å
190Y98.3Very high96.5Very high57 Ų5759.1 Ų59.122%0.22428%0.279CS..Hα-helixtrans-66.6-46.1174.4-170.3-82.1000111.7M168 L171 A175 F186 F187 H188 C193 F194M168-Y190 PolarHBondContact SD-OH 3.39Å; M168-Y190 VanDerWaalsContact SD-OH 3.39Å; L171-Y190 HydrophobicContact CB-CD2 4.18Å; L171-Y190 HydrophobicContact CB-CE2 3.55Å; L171-Y190 HydrophobicContact CD1-CE1 4.35Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.45Å; A175-Y190 HydrophobicContact CB-CD2 3.99Å; A175-Y190 HydrophobicContact CB-CG 4.36Å; F186-Y190 HydrophobicContact CE1-CD2 4.23Å; F186-Y190 HydrophobicContact CZ-CD2 4.4Å; F186-Y190 VanDerWaalsContact O-CB 3.27Å; F186-Y190 WeakPolarHBondContact O-CB 3.43Å; F186-Y190 PolarHBondContact O-N 3.01Å; F187-Y190 PolarHBondContact O-N 2.82Å; H188-Y190 VanDerWaalsContact C-N 3.34Å; Y190-C193 PolarHBondContact O-N 2.92Å; Y190-F194 WeakPolarHBondContact O-CB 3.4Å; Y190-F194 PolarHBondContact O-N 3.46Å
191Y98.3Very high96.7Very high67 Ų6752.2 Ų52.226%0.26325%0.248SC..Hα-helixtrans-57.1-48.5173.6166.2-94.9000111.3F187 H188 C193 F194 I195 F202 D204 Y205F187-Y191 WeakPolarHBondContact O-CB 3.46Å; F187-Y191 PolarHBondContact O-N 3.33Å; H188-Y191 PolarHBondContact O-N 3.28Å; Y191-C193 PolarHBondContact O-N 3.31Å; Y191-F194 PolarHBondContact O-N 3.43Å; Y191-F194 VanDerWaalsContact O-N 3.15Å; Y191-I195 HydrophobicContact CD1-CG1 4.48Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.14Å; Y191-I195 HydrophobicContact CE2-CD1 4.02Å; Y191-I195 HydrophobicContact CE2-CG1 3.58Å; Y191-I195 HydrophobicContact CG-CG1 4.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.49Å; Y191-I195 WeakPolarHBondContact O-CG1 3.49Å; Y191-I195 PolarHBondContact O-N 2.82Å; Y191-F202 VanDerWaalsContact OH-CD2 3.31Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.34Å; Y191-D204 WeakPolarHBondContact CE1-OD2 3.38Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.3Å; Y191-D204 PolarHBondContact OH-OD2 2.74Å; Y191-Y205 HydrophobicContact CD1-CD2 4.09Å; Y191-Y205 AromaticContact CE1-CD2 3.97Å; Y191-Y205 HydrophobicContact CE1-CD2 3.97Å; Y191-Y205 HydrophobicContact CE1-CE2 4.49Å
192Y98.1Very high96.9Very high3 Ų354.1 Ų54.11%0.01226%0.257CS..Hα-helixtrans-54-51.1173.6163.8-106.1000111.3Y96 F178 W184 H188 F194 I195 T196 Y205 A207Y96-Y192 HydrophobicContact CE1-CE2 4.14Å; Y96-Y192 AromaticContact CZ-CE2 3.95Å; Y96-Y192 WeakPolarHBondContact OH-CE2 3.48Å; Y96-Y192 PolarHBondContact OH-OH 2.96Å; F178-Y192 HydrophobicContact CB-CD1 4.45Å; F178-Y192 AromaticContact CD1-CE1 3.98Å; F178-Y192 HydrophobicContact CD1-CE1 3.98Å; F178-Y192 HydrophobicContact CD2-CD1 4.02Å; F178-Y192 AromaticContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CD2-CE1 3.74Å; F178-Y192 HydrophobicContact CE1-CE1 4.03Å; F178-Y192 HydrophobicContact CE2-CD1 4.47Å; F178-Y192 AromaticContact CE2-CE1 3.79Å; F178-Y192 HydrophobicContact CE2-CE1 3.79Å; F178-Y192 HydrophobicContact CG-CD1 4.1Å; F178-Y192 AromaticContact CG-CE1 3.86Å; F178-Y192 HydrophobicContact CG-CE1 3.86Å; F178-Y192 AromaticContact CZ-CE1 3.94Å; F178-Y192 HydrophobicContact CZ-CE1 3.94Å; W184-Y192 HydrophobicContact CH2-CD2 4.49Å; W184-Y192 HydrophobicContact CH2-CG 4.43Å; W184-Y192 AromaticContact CZ3-CD1 3.87Å; W184-Y192 HydrophobicContact CZ3-CD1 3.87Å; W184-Y192 HydrophobicContact CZ3-CD2 4.24Å; W184-Y192 HydrophobicContact CZ3-CE1 4.45Å; W184-Y192 AromaticContact CZ3-CG 3.75Å; W184-Y192 HydrophobicContact CZ3-CG 3.75Å; H188-Y192 WeakPolarHBondContact O-CB 3.45Å; H188-Y192 PolarHBondContact O-N 3.42Å; Y192-F194 VanDerWaalsContact C-N 3.3Å; Y192-F194 PolarHBondContact O-N 3.43Å; Y192-I195 PolarHBondContact O-N 3.17Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.28Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.18Å; Y192-T196 WeakPolarHBondContact O-CB 3.44Å; Y192-T196 PolarHBondContact O-N 3.47Å; Y192-T196 PolarHBondContact O-OG1 3.2Å; Y192-Y205 VanDerWaalsContact CD2-O 3.26Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.45Å; Y192-A207 HydrophobicContact CE1-CB 4.14Å; Y192-A207 VanDerWaalsContact OH-CB 3.27Å; Y192-A207 WeakPolarHBondContact OH-CB 3.46Å
193C98.2Very high97Very high0 Ų055 Ų550%027%0.267CS..Hα-helixtrans-59.5-41.6178.9-71.40000112.2L171 A189 Y190 Y191 L197 Y227L171-C193 HydrophobicContact CD2-CB 3.92Å; A189-C193 WeakPolarHBondContact O-CB 3.39Å; A189-C193 PolarHBondContact O-N 2.81Å; A189-C193 PolarHBondContact O-SG 3.37Å; Y190-C193 PolarHBondContact O-N 2.92Å; Y191-C193 PolarHBondContact O-N 3.31Å; C193-L197 WeakPolarHBondContact O-CB 3.41Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.27Å; C193-L197 PolarHBondContact O-N 3.47Å; C193-Y227 WeakPolarHBondContact CB-OH 3.23Å; C193-Y227 PolarHBondContact SG-OH 3.3Å
194F98.3Very high97Very high93 Ų9351.8 Ų51.841%0.40826%0.255SS..Hα-helixtrans-64.7-52.7179-178.9-92.8000111.6L171 Y190 Y191 Y192 T196 L197 T198L171-F194 HydrophobicContact CD1-CD2 4.03Å; L171-F194 HydrophobicContact CD2-CB 4.22Å; Y190-F194 WeakPolarHBondContact O-CB 3.4Å; Y190-F194 PolarHBondContact O-N 3.46Å; Y191-F194 PolarHBondContact O-N 3.43Å; Y191-F194 VanDerWaalsContact O-N 3.15Å; Y192-F194 VanDerWaalsContact C-N 3.3Å; Y192-F194 PolarHBondContact O-N 3.43Å; F194-T196 PolarHBondContact O-N 2.81Å; F194-L197 PolarHBondContact O-N 3.25Å; F194-T198 HydrophobicContact CD1-CG2 4.45Å; F194-T198 HydrophobicContact CD2-CG2 4.37Å; F194-T198 HydrophobicContact CE1-CG2 4.16Å; F194-T198 HydrophobicContact CE2-CG2 4.07Å; F194-T198 HydrophobicContact CZ-CG2 3.95Å; F194-T198 WeakPolarHBondContact O-CB 3.35Å; F194-T198 VanDerWaalsContact O-CG2 3.32Å; F194-T198 WeakPolarHBondContact O-CG2 3.21Å; F194-T198 PolarHBondContact O-N 3.2Å; F194-T198 PolarHBondContact O-OG1 3.31Å
195I98Very high97Very high10 Ų1052.5 Ų52.55%0.05126%0.258CS..Hα-helixtrans-61.8-34178.9-66.6-56.3000111.8Y191 Y192 T198 I200 G201 F202Y191-I195 HydrophobicContact CD1-CG1 4.48Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.14Å; Y191-I195 HydrophobicContact CE2-CD1 4.02Å; Y191-I195 HydrophobicContact CE2-CG1 3.58Å; Y191-I195 HydrophobicContact CG-CG1 4.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.49Å; Y191-I195 WeakPolarHBondContact O-CG1 3.49Å; Y191-I195 PolarHBondContact O-N 2.82Å; Y192-I195 PolarHBondContact O-N 3.17Å; I195-T198 PolarHBondContact O-OG1 2.93Å; I195-I200 HydrophobicContact CD1-CB 4.35Å; I195-I200 HydrophobicContact CD1-CD1 3.91Å; I195-I200 HydrophobicContact CD1-CG2 4.3Å; I195-I200 HydrophobicContact CG2-CB 4.06Å; I195-I200 HydrophobicContact CG2-CG2 4.19Å; I195-I200 PolarHBondContact O-N 3.36Å; I195-G201 PolarHBondContact O-N 2.98Å; I195-G201 VanDerWaalsContact O-N 3.09Å; I195-F202 HydrophobicContact CD1-CD2 3.9Å; I195-F202 HydrophobicContact CD1-CE2 3.59Å; I195-F202 HydrophobicContact CG1-CD2 4.11Å; I195-F202 HydrophobicContact CG1-CE2 4.29Å; I195-F202 HydrophobicContact CG2-CB 4.41Å; I195-F202 HydrophobicContact CG2-CD2 3.79Å; I195-F202 HydrophobicContact CG2-CE2 4.49Å; I195-F202 HydrophobicContact CG2-CG 4.29Å
196T97.9Very high96.9Very high0 Ų050.3 Ų50.30%024%0.243CC..Hα-helixtrans-67.9-54.9175.6-60.20000112I94 Y96 Y192 F194 T198 T199 I228I94-T196 HydrophobicContact CD1-CG2 4.1Å; Y96-T196 WeakPolarHBondContact OH-CB 3.35Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.49Å; Y96-T196 PolarHBondContact OH-OG1 3.37Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.28Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.18Å; Y192-T196 WeakPolarHBondContact O-CB 3.44Å; Y192-T196 PolarHBondContact O-N 3.47Å; Y192-T196 PolarHBondContact O-OG1 3.2Å; F194-T196 PolarHBondContact O-N 2.81Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.34Å; T196-T199 PolarHBondContact O-N 3.45Å; T196-I228 HydrophobicContact CG2-CG1 4.06Å
197L97Very high96.6Very high3 Ų345.4 Ų45.42%0.01622%0.221CC..Hα-helixtrans-77.5-16.9-172.5-62.8-173.7000113.3T170 L171 C193 F194 T199 Y227 L232 I235T170-L197 HydrophobicContact CG2-CD1 3.8Å; L171-L197 HydrophobicContact CD2-CD1 4.05Å; C193-L197 WeakPolarHBondContact O-CB 3.41Å; C193-L197 VanDerWaalsContact O-CG 3.28Å; C193-L197 WeakPolarHBondContact O-CG 3.27Å; C193-L197 PolarHBondContact O-N 3.47Å; F194-L197 PolarHBondContact O-N 3.25Å; L197-T199 VanDerWaalsContact C-N 3.26Å; L197-Y227 HydrophobicContact CD1-CE1 4.43Å; L197-Y227 HydrophobicContact CD2-CE1 4.36Å; L197-L232 HydrophobicContact CD2-CG 4.26Å; L197-L232 WeakPolarHBondContact O-CD2 3.37Å; L197-I235 HydrophobicContact CB-CG1 3.91Å; L197-I235 HydrophobicContact CD1-CG1 4.45Å
198T96.2Very high96.1Very high48 Ų4838.3 Ų38.329%0.29419%0.19SC..THydrogen-bonded Turntrans-86.13.2168.3550000113F194 I195 T196 I200F194-T198 HydrophobicContact CD1-CG2 4.45Å; F194-T198 HydrophobicContact CD2-CG2 4.37Å; F194-T198 HydrophobicContact CE1-CG2 4.16Å; F194-T198 HydrophobicContact CE2-CG2 4.07Å; F194-T198 HydrophobicContact CZ-CG2 3.95Å; F194-T198 WeakPolarHBondContact O-CB 3.35Å; F194-T198 VanDerWaalsContact O-CG2 3.32Å; F194-T198 WeakPolarHBondContact O-CG2 3.21Å; F194-T198 PolarHBondContact O-N 3.2Å; F194-T198 PolarHBondContact O-OG1 3.31Å; I195-T198 PolarHBondContact O-OG1 2.93Å; T196-T198 VanDerWaalsContact C-N 3.3Å; T196-T198 PolarHBondContact O-N 3.34Å; T198-I200 PolarHBondContact O-N 3.1Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.41Å; T198-I200 WeakPolarHBondContact OG1-CG1 3.32Å
199T96.8Very high95.5Very high53 Ų5336.5 Ų36.533%0.32518%0.182SC..THydrogen-bonded Turntrans55.629.8-179.569.30000113.6T92 I94 T196 L197 L232T92-T199 WeakPolarHBondContact O-CG2 3.23Å; I94-T199 HydrophobicContact CG1-CG2 4.15Å; T196-T199 PolarHBondContact O-N 3.45Å; L197-T199 VanDerWaalsContact C-N 3.26Å; T199-L232 HydrophobicContact CG2-CD2 3.57Å
200I97.8Very high94.6Very high79 Ų7940.3 Ų40.341%0.40520%0.202SC..  trans-80.1-49.5173.3-64.6172.1000109.2I195 T198 F202I195-I200 HydrophobicContact CD1-CB 4.35Å; I195-I200 HydrophobicContact CD1-CD1 3.91Å; I195-I200 HydrophobicContact CD1-CG2 4.3Å; I195-I200 HydrophobicContact CG2-CB 4.06Å; I195-I200 HydrophobicContact CG2-CG2 4.19Å; I195-I200 PolarHBondContact O-N 3.36Å; T198-I200 PolarHBondContact O-N 3.1Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.41Å; T198-I200 WeakPolarHBondContact OG1-CG1 3.32Å; I200-F202 HydrophobicContact CG2-CD1 3.87Å; I200-F202 HydrophobicContact CG2-CD2 4Å; I200-F202 HydrophobicContact CG2-CE1 3.54Å; I200-F202 HydrophobicContact CG2-CE2 3.71Å; I200-F202 HydrophobicContact CG2-CG 4.09Å; I200-F202 HydrophobicContact CG2-CZ 3.46Å; I200-F202 VanDerWaalsContact CG2-CZ 3.46Å
201G96.8Very high93.2Very high5 Ų545.3 Ų45.35%0.05223%0.225CC..  trans53.856.1171.100000115.7I94 Y96 I195 G203I94-G201 WeakPolarHBondContact O-CA 3.48Å; Y96-G201 VanDerWaalsContact CA-O 3.32Å; Y96-G201 WeakPolarHBondContact CA-O 3.48Å; I195-G201 PolarHBondContact O-N 2.98Å; I195-G201 VanDerWaalsContact O-N 3.09Å; G201-G203 PolarHBondContact O-N 2.86Å
202F95.9Very high92Very high131 Ų13145.8 Ų45.858%0.57523%0.232SC*.  trans-56.8-34.5178.9-67-53.6000114.2Y191 I195 I200Y191-F202 VanDerWaalsContact OH-CD2 3.31Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.34Å; I195-F202 HydrophobicContact CD1-CD2 3.9Å; I195-F202 HydrophobicContact CD1-CE2 3.59Å; I195-F202 HydrophobicContact CG1-CD2 4.11Å; I195-F202 HydrophobicContact CG1-CE2 4.29Å; I195-F202 HydrophobicContact CG2-CB 4.41Å; I195-F202 HydrophobicContact CG2-CD2 3.79Å; I195-F202 HydrophobicContact CG2-CE2 4.49Å; I195-F202 HydrophobicContact CG2-CG 4.29Å; I200-F202 HydrophobicContact CG2-CD1 3.87Å; I200-F202 HydrophobicContact CG2-CD2 4Å; I200-F202 HydrophobicContact CG2-CE1 3.54Å; I200-F202 HydrophobicContact CG2-CE2 3.71Å; I200-F202 HydrophobicContact CG2-CG 4.09Å; I200-F202 HydrophobicContact CG2-CZ 3.46Å; I200-F202 VanDerWaalsContact CG2-CZ 3.46Å
203G94Very high91.1Very high25 Ų2545.9 Ų45.926%0.25823%0.234SC..SBendtrans84.28178.400000115.2Y96 G201Y96-G203 VanDerWaalsContact O-CA 3.31Å; Y96-G203 WeakPolarHBondContact O-CA 3.45Å; G201-G203 PolarHBondContact O-N 2.86Å
204D93.5Very high90.3Very high90 Ų9046.4 Ų46.448%0.48124%0.236SC..SBendtrans-64.5-40.8167.255-16.2000111.8Y191Y191-D204 WeakPolarHBondContact CE1-OD2 3.38Å; Y191-D204 VanDerWaalsContact CZ-OD2 3.3Å; Y191-D204 PolarHBondContact OH-OD2 2.74Å
205Y94.9Very high89.4Confident61 Ų6145.6 Ų45.624%0.23923%0.234CC..SBendtrans-116.1125168.2-71.6-93.9000110.2W184 H188 Y191 Y192W184-Y205 AromaticContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CE1 4.26Å; W184-Y205 AromaticContact CE2-CD1 3.7Å; W184-Y205 HydrophobicContact CE3-CD1 4.05Å; W184-Y205 HydrophobicContact CG-CD1 4.38Å; W184-Y205 HydrophobicContact CG-CE1 4.37Å; W184-Y205 HydrophobicContact CH2-CD1 4.14Å; W184-Y205 AromaticContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ2-CD1 3.89Å; W184-Y205 HydrophobicContact CZ3-CD1 4.21Å; H188-Y205 HydrophobicContact CB-CD1 4.39Å; H188-Y205 HydrophobicContact CB-CE1 3.78Å; H188-Y205 PolarHBondContact CE1-OH 2.93Å; H188-Y205 VanDerWaalsContact CE1-OH 3.3Å; H188-Y205 AromaticContact CG-CZ 3.69Å; H188-Y205 AromaticContact ND1-CZ 3.62Å; H188-Y205 PolarHBondContact ND1-OH 3.34Å; H188-Y205 VanDerWaalsContact ND1-OH 3.14Å; Y191-Y205 HydrophobicContact CD1-CD2 4.09Å; Y191-Y205 AromaticContact CE1-CD2 3.97Å; Y191-Y205 HydrophobicContact CE1-CD2 3.97Å; Y191-Y205 HydrophobicContact CE1-CE2 4.49Å; Y192-Y205 VanDerWaalsContact CD2-O 3.26Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.45Å
206V93.8Very high88.7Confident12 Ų1249.3 Ų49.37%0.07326%0.257CS..  trans-139.7118.7178.5-174.30000109.4Y85 Y96 H98 Q209Y85-V206 HydrophobicContact CE1-CG1 4.05Å; Y96-V206 HydrophobicContact CD1-CG2 4.15Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CE2-CG1 4.5Å; Y96-V206 HydrophobicContact CG-CG1 4.39Å; Y96-V206 HydrophobicContact CG-CG2 4.01Å; H98-V206 HydrophobicContact CB-CG1 4.38Å; H98-V206 HydrophobicContact CB-CG2 4.21Å; V206-Q209 HydrophobicContact CB-CG 3.81Å; V206-Q209 HydrophobicContact CG1-CG 3.73Å
207A92.3Very high88.2Confident0 Ų054.6 Ų54.60%028%0.28CS..THydrogen-bonded Turntrans-64.3157.717400000111.5F178 E182 Y192 Q209 Y220F178-A207 HydrophobicContact CD1-CB 3.93Å; F178-A207 HydrophobicContact CE1-CB 3.65Å; E182-A207 WeakPolarHBondContact OE1-CA 3.47Å; Y192-A207 HydrophobicContact CE1-CB 4.14Å; Y192-A207 VanDerWaalsContact OH-CB 3.27Å; Y192-A207 WeakPolarHBondContact OH-CB 3.46Å; A207-Q209 PolarHBondContact O-N 2.83Å; A207-Y220 WeakPolarHBondContact CB-OH 3.42Å
208L87.5Confident87.8Confident0 Ų059 Ų590%031%0.309CS..THydrogen-bonded Turntrans69.112.9178.6-48165.6000115.1E182 L214 Y220 V221 F225E182-L208 PolarHBondContact OE1-N 2.91Å; L208-L214 HydrophobicContact CB-CD1 3.41Å; L208-L214 VanDerWaalsContact CB-CD1 3.41Å; L208-L214 HydrophobicContact CD1-CD1 3.93Å; L208-L214 HydrophobicContact CG-CD1 4.23Å; L208-Y220 HydrophobicContact CD2-CD1 3.37Å; L208-Y220 HydrophobicContact CD2-CE1 3.35Å; L208-Y220 HydrophobicContact CD2-CG 3.99Å; L208-Y220 HydrophobicContact CG-CE1 4.22Å; L208-V221 HydrophobicContact CD1-CG2 4.47Å; L208-V221 HydrophobicContact CD2-CB 4.36Å; L208-V221 HydrophobicContact CD2-CG2 3.83Å; L208-F225 HydrophobicContact CD1-CE1 3.99Å
209Q84.3Confident87.5Confident30 Ų3064.9 Ų64.914%0.1433%0.333CS..  trans-93-15.9177.9-65.6-61.7-70.700113.6A74 Q77 H98 V206 A207A74-Q209 HydrophobicContact CB-CB 4.13Å; A74-Q209 WeakPolarHBondContact CB-O 3.2Å; Q77-Q209 VanDerWaalsContact OE1-NE2 3.13Å; H98-Q209 PolarHBondContact CD2-NE2 3.18Å; H98-Q209 VanDerWaalsContact CD2-NE2 3.31Å; V206-Q209 HydrophobicContact CB-CG 3.81Å; V206-Q209 HydrophobicContact CG1-CG 3.73Å; A207-Q209 PolarHBondContact O-N 2.83Å
210N79.3Confident87.3Confident79 Ų7962.9 Ų62.942%0.42232%0.319SS..SBendtrans-84.3135.8-178.3-80.1-32.2000112.9E182 D212 A213E182-N210 WeakPolarHBondContact OE2-CB 3.45Å; E182-N210 PolarHBondContact OE2-ND2 2.84Å; N210-D212 PolarHBondContact O-N 3.45Å; N210-A213 WeakPolarHBondContact O-CB 3.49Å; N210-A213 PolarHBondContact O-N 3.44Å
211K68.8Low87Confident163 Ų16359.6 Ų59.671%0.70930%0.303SS*.THydrogen-bonded Turntrans5244.1164.9-57.5172.4-177162.50114.9A213K211-A213 PolarHBondContact O-N 2.93Å; K211-A213 VanDerWaalsContact O-N 3.08Å
212D73Confident86.8Confident76 Ų7661.5 Ų61.541%0.40632%0.318SS..THydrogen-bonded Turntrans53.628.3-177.5-65.7-60.9000113.8G75 N210 L214 Q215 T216G75-D212 WeakPolarHBondContact CA-OD1 3.44Å; N210-D212 PolarHBondContact O-N 3.45Å; D212-L214 PolarHBondContact O-N 3.5Å; D212-Q215 PolarHBondContact O-N 3.32Å; D212-T216 HydrophobicContact CB-CG2 4.22Å; D212-T216 PolarHBondContact O-N 3.44Å; D212-T216 PolarHBondContact O-OG1 3.42Å
213A79.6Confident86.8Confident6 Ų658.5 Ų58.55%0.0531%0.305CS..Hα-helixtrans-53.4-33.2-177.300000112.9N210 K211 Q215 T216 K217 Y220N210-A213 WeakPolarHBondContact O-CB 3.49Å; N210-A213 PolarHBondContact O-N 3.44Å; K211-A213 PolarHBondContact O-N 2.93Å; K211-A213 VanDerWaalsContact O-N 3.08Å; A213-Q215 PolarHBondContact O-N 2.99Å; A213-Q215 VanDerWaalsContact O-N 3.15Å; A213-T216 WeakPolarHBondContact CA-OG1 3.43Å; A213-T216 PolarHBondContact O-N 3.34Å; A213-K217 PolarHBondContact O-N 2.94Å; A213-Y220 HydrophobicContact CB-CD1 4.38Å
214L80.6Confident86.8Confident10 Ų1057.4 Ų57.45%0.05229%0.293CS..Hα-helixtrans-55.2-28.6175.7-135.368.9000113.7G82 L208 D212G82-L214 VanDerWaalsContact CA-CD2 3.42Å; L208-L214 HydrophobicContact CB-CD1 3.41Å; L208-L214 VanDerWaalsContact CB-CD1 3.41Å; L208-L214 HydrophobicContact CD1-CD1 3.93Å; L208-L214 HydrophobicContact CG-CD1 4.23Å; D212-L214 PolarHBondContact O-N 3.5Å
215Q79.4Confident86.9Confident76 Ų7654.1 Ų54.136%0.35528%0.275SS..Hα-helixtrans-107.9-33-179.6-57-56.6-52.600112.6K79 D212 A213K79-Q215 VanDerWaalsContact CD-OE1 3.23Å; D212-Q215 PolarHBondContact O-N 3.32Å; A213-Q215 PolarHBondContact O-N 2.99Å; A213-Q215 VanDerWaalsContact O-N 3.15Å
216T83.1Confident86.9Confident88 Ų8856.3 Ų56.354%0.5429%0.29SS..Hα-helixtrans-91.9-24.6-170.158.10000113.7D212 A213 P218D212-T216 HydrophobicContact CB-CG2 4.22Å; D212-T216 PolarHBondContact O-N 3.44Å; D212-T216 PolarHBondContact O-OG1 3.42Å; A213-T216 WeakPolarHBondContact CA-OG1 3.43Å; A213-T216 PolarHBondContact O-N 3.34Å; T216-P218 WeakPolarHBondContact O-CD 3.28Å
217K88.2Confident87.1Confident112 Ų11256.5 Ų56.549%0.48729%0.289SS..  trans-126.373.9-172.9-64-176.2-179.6-179.80112.3A213 E219 Y220 V221A213-K217 PolarHBondContact O-N 2.94Å; K217-E219 VanDerWaalsContact C-N 3.27Å; K217-E219 PolarHBondContact O-N 3.1Å; K217-Y220 PolarHBondContact O-N 3.28Å; K217-V221 WeakPolarHBondContact O-CG2 3.32Å; K217-V221 PolarHBondContact O-N 2.99Å; K217-V221 VanDerWaalsContact O-N 3.14Å
218P88Confident87.3Confident96 Ų9656.5 Ų56.562%0.62329%0.289SS*.Hα-helixtrans-62.6-31.4-176.825.5-34.6000113.5T216 V221 A222T216-P218 WeakPolarHBondContact O-CD 3.28Å; P218-V221 PolarHBondContact O-N 3.19Å; P218-A222 WeakPolarHBondContact O-CB 3.49Å; P218-A222 PolarHBondContact O-N 3.44Å
219E90.3Very high87.6Confident171 Ų17159.9 Ų59.980%0.79931%0.307SS*.Hα-helixtrans-63.5-42.3176.5-62.7-179.4-179.500111.8K217 A222 F223K217-E219 VanDerWaalsContact C-N 3.27Å; K217-E219 PolarHBondContact O-N 3.1Å; E219-A222 PolarHBondContact O-N 2.87Å; E219-F223 WeakPolarHBondContact O-CB 3.23Å; E219-F223 PolarHBondContact O-N 3.02Å
220Y91.8Very high88.1Confident10 Ų1062.3 Ų62.34%0.03932%0.324CS..Hα-helixtrans-69.8-38178176.9-134.4000112.1F178 F181 E182 A207 L208 A213 K217 F223 S224F178-Y220 HydrophobicContact CD1-CE2 4.27Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.49Å; F178-Y220 HydrophobicContact CE1-CE2 4.05Å; F181-Y220 HydrophobicContact CB-CD2 4.04Å; F181-Y220 HydrophobicContact CB-CE1 4.3Å; F181-Y220 HydrophobicContact CB-CE2 3.55Å; F181-Y220 AromaticContact CD1-CD2 3.96Å; F181-Y220 HydrophobicContact CD1-CD2 3.96Å; F181-Y220 HydrophobicContact CD1-CE2 4.34Å; F181-Y220 HydrophobicContact CD1-CG 4.32Å; F181-Y220 AromaticContact CD2-CD2 3.73Å; F181-Y220 HydrophobicContact CD2-CD2 3.73Å; F181-Y220 AromaticContact CD2-CE2 3.65Å; F181-Y220 HydrophobicContact CD2-CE2 3.65Å; F181-Y220 HydrophobicContact CE1-CD2 4.34Å; F181-Y220 HydrophobicContact CE2-CD2 4.14Å; F181-Y220 HydrophobicContact CE2-CE2 4.44Å; F181-Y220 AromaticContact CG-CD2 3.65Å; F181-Y220 HydrophobicContact CG-CD2 3.65Å; F181-Y220 AromaticContact CG-CE2 3.6Å; F181-Y220 HydrophobicContact CG-CE2 3.6Å; F181-Y220 HydrophobicContact CG-CG 4.37Å; F181-Y220 HydrophobicContact CZ-CD2 4.43Å; E182-Y220 VanDerWaalsContact CG-OH 3.31Å; E182-Y220 WeakPolarHBondContact CG-OH 3.31Å; E182-Y220 PolarHBondContact OE1-OH 2.86Å; A207-Y220 WeakPolarHBondContact CB-OH 3.42Å; L208-Y220 HydrophobicContact CD2-CD1 3.37Å; L208-Y220 HydrophobicContact CD2-CE1 3.35Å; L208-Y220 HydrophobicContact CD2-CG 3.99Å; L208-Y220 HydrophobicContact CG-CE1 4.22Å; A213-Y220 HydrophobicContact CB-CD1 4.38Å; K217-Y220 PolarHBondContact O-N 3.28Å; Y220-F223 HydrophobicContact CD2-CD1 4.19Å; Y220-F223 HydrophobicContact CE2-CD1 4.29Å; Y220-F223 PolarHBondContact O-N 3.5Å; Y220-S224 WeakPolarHBondContact CE2-OG 3.27Å; Y220-S224 WeakPolarHBondContact O-CB 3.06Å; Y220-S224 PolarHBondContact O-N 3.44Å; Y220-S224 PolarHBondContact O-OG 3.37Å
221V91.7Very high88.9Confident11 Ų1158.6 Ų58.67%0.06730%0.304CS..Hα-helixtrans-59-50.2172.4173.90000110.4A81 L208 K217 P218 F223 S224 F225A81-V221 HydrophobicContact CB-CG1 4.42Å; L208-V221 HydrophobicContact CD1-CG2 4.47Å; L208-V221 HydrophobicContact CD2-CB 4.36Å; L208-V221 HydrophobicContact CD2-CG2 3.83Å; K217-V221 WeakPolarHBondContact O-CG2 3.32Å; K217-V221 PolarHBondContact O-N 2.99Å; K217-V221 VanDerWaalsContact O-N 3.14Å; P218-V221 PolarHBondContact O-N 3.19Å; V221-F223 PolarHBondContact O-N 3.41Å; V221-S224 PolarHBondContact O-N 2.81Å; V221-F225 HydrophobicContact CG1-CD2 4.03Å; V221-F225 HydrophobicContact CG1-CE1 4.1Å; V221-F225 HydrophobicContact CG1-CE2 3.31Å; V221-F225 HydrophobicContact CG1-CZ 3.37Å; V221-F225 WeakPolarHBondContact O-CG 3.49Å; V221-F225 PolarHBondContact O-N 2.97Å
222A93Very high90.2Very high45 Ų4551.3 Ų51.337%0.37227%0.273SS..Hα-helixtrans-61.7-45.5179.200000111.9P218 E219 S224 F225 I226P218-A222 WeakPolarHBondContact O-CB 3.49Å; P218-A222 PolarHBondContact O-N 3.44Å; E219-A222 PolarHBondContact O-N 2.87Å; A222-S224 VanDerWaalsContact C-N 3.32Å; A222-S224 PolarHBondContact O-N 2.89Å; A222-F225 PolarHBondContact O-N 3.11Å; A222-I226 WeakPolarHBondContact O-CB 3.27Å; A222-I226 VanDerWaalsContact O-CG1 3.28Å; A222-I226 WeakPolarHBondContact O-CG1 3.32Å; A222-I226 PolarHBondContact O-N 2.88Å
223F94.9Very high91.2Very high68 Ų6848.1 Ų48.130%0.29826%0.257SS..Hα-helixtrans-54.5-48.4174168-97.2000111.6A177 F178 F181 E219 Y220 V221 F225 I226 Y227A177-F223 HydrophobicContact CB-CE1 3.71Å; A177-F223 HydrophobicContact CB-CE2 4.4Å; A177-F223 HydrophobicContact CB-CZ 3.38Å; F178-F223 HydrophobicContact CE1-CE1 4.42Å; F178-F223 HydrophobicContact CE2-CE1 4.46Å; F178-F223 HydrophobicContact CZ-CE1 4.13Å; F181-F223 HydrophobicContact CD2-CE1 4.49Å; F181-F223 HydrophobicContact CE2-CD1 4.28Å; F181-F223 HydrophobicContact CE2-CE1 4.34Å; E219-F223 WeakPolarHBondContact O-CB 3.23Å; E219-F223 PolarHBondContact O-N 3.02Å; Y220-F223 HydrophobicContact CD2-CD1 4.19Å; Y220-F223 HydrophobicContact CE2-CD1 4.29Å; Y220-F223 PolarHBondContact O-N 3.5Å; V221-F223 PolarHBondContact O-N 3.41Å; F223-F225 PolarHBondContact O-N 3.46Å; F223-I226 PolarHBondContact O-N 2.94Å; F223-Y227 VanDerWaalsContact O-CB 3.3Å; F223-Y227 WeakPolarHBondContact O-CB 3.5Å; F223-Y227 PolarHBondContact O-N 3.14Å
224S94.7Very high92Very high1 Ų148.9 Ų48.91%0.00726%0.261CS..Hα-helixtrans-62.4-42.5-177.9-60.70000112Y220 V221 A222 Y227 I228Y220-S224 WeakPolarHBondContact CE2-OG 3.27Å; Y220-S224 WeakPolarHBondContact O-CB 3.06Å; Y220-S224 PolarHBondContact O-N 3.44Å; Y220-S224 PolarHBondContact O-OG 3.37Å; V221-S224 PolarHBondContact O-N 2.81Å; A222-S224 VanDerWaalsContact C-N 3.32Å; A222-S224 PolarHBondContact O-N 2.89Å; S224-Y227 PolarHBondContact O-N 3.46Å; S224-I228 VanDerWaalsContact O-CG1 3.3Å; S224-I228 WeakPolarHBondContact O-CG1 3.37Å; S224-I228 PolarHBondContact O-N 3.45Å
225F95Very high92.7Very high21 Ų2149.7 Ų49.79%0.09227%0.265CS..Hα-helixtrans-66.2-44.9177-61.8-15.8000112.2F84 Y85 I88 L208 V221 A222 F223 Y227 I228 L229F84-F225 AromaticContact CD1-CD2 3.6Å; F84-F225 HydrophobicContact CD1-CD2 3.6Å; F84-F225 AromaticContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CE2 3.41Å; F84-F225 VanDerWaalsContact CD1-CE2 3.41Å; F84-F225 HydrophobicContact CD1-CG 4.37Å; F84-F225 HydrophobicContact CD1-CZ 4.04Å; F84-F225 AromaticContact CE1-CD2 3.67Å; F84-F225 HydrophobicContact CE1-CD2 3.67Å; F84-F225 AromaticContact CE1-CE2 3.99Å; F84-F225 HydrophobicContact CE1-CE2 3.99Å; F84-F225 HydrophobicContact CE1-CG 4.29Å; F84-F225 HydrophobicContact CG-CE2 4.44Å; Y85-F225 HydrophobicContact CD2-CD1 4.06Å; Y85-F225 AromaticContact CD2-CE1 3.49Å; Y85-F225 HydrophobicContact CD2-CE1 3.49Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.49Å; Y85-F225 HydrophobicContact CD2-CZ 4.5Å; Y85-F225 HydrophobicContact CE2-CE1 4.4Å; Y85-F225 AromaticContact CG-CE1 3.78Å; Y85-F225 HydrophobicContact CG-CE1 3.78Å; Y85-F225 HydrophobicContact CG-CZ 4.43Å; I88-F225 HydrophobicContact CD1-CB 4.03Å; I88-F225 HydrophobicContact CD1-CD1 3.82Å; I88-F225 HydrophobicContact CD1-CD2 4.36Å; I88-F225 HydrophobicContact CD1-CE1 4.4Å; I88-F225 HydrophobicContact CD1-CG 3.81Å; L208-F225 HydrophobicContact CD1-CE1 3.99Å; V221-F225 HydrophobicContact CG1-CD2 4.03Å; V221-F225 HydrophobicContact CG1-CE1 4.1Å; V221-F225 HydrophobicContact CG1-CE2 3.31Å; V221-F225 HydrophobicContact CG1-CZ 3.37Å; V221-F225 WeakPolarHBondContact O-CG 3.49Å; V221-F225 PolarHBondContact O-N 2.97Å; A222-F225 PolarHBondContact O-N 3.11Å; F223-F225 PolarHBondContact O-N 3.46Å; F225-Y227 VanDerWaalsContact C-N 3.3Å; F225-Y227 PolarHBondContact O-N 3.44Å; F225-I228 PolarHBondContact O-N 3.2Å; F225-L229 WeakPolarHBondContact O-CB 3.28Å; F225-L229 VanDerWaalsContact O-CG 3.32Å; F225-L229 WeakPolarHBondContact O-CG 3.38Å; F225-L229 PolarHBondContact O-N 2.73Å
226I95.6Very high93.3Very high107 Ų10746.6 Ų46.655%0.54925%0.254SS..Hα-helixtrans-62.2-42.3177.5-68.7167.6000110.3A222 F223 T230A222-I226 WeakPolarHBondContact O-CB 3.27Å; A222-I226 VanDerWaalsContact O-CG1 3.28Å; A222-I226 WeakPolarHBondContact O-CG1 3.32Å; A222-I226 PolarHBondContact O-N 2.88Å; F223-I226 PolarHBondContact O-N 2.94Å; I226-T230 WeakPolarHBondContact O-CB 3.35Å; I226-T230 PolarHBondContact O-N 3.03Å; I226-T230 PolarHBondContact O-OG1 3.48Å
227Y97.3Very high93.8Very high17 Ų1742.6 Ų42.67%0.06723%0.23CC..Hα-helixtrans-60.8-49.7177.3174.5-94000111.6T170 G174 F178 C193 L197 F223 S224 F225 L229 T230 G231T170-Y227 HydrophobicContact CG2-CE2 4.19Å; T170-Y227 PolarHBondContact O-OH 3.16Å; G174-Y227 WeakPolarHBondContact CA-OH 3.34Å; F178-Y227 AromaticContact CE2-CD1 3.52Å; F178-Y227 HydrophobicContact CE2-CD1 3.52Å; F178-Y227 AromaticContact CE2-CE1 3.64Å; F178-Y227 HydrophobicContact CE2-CE1 3.64Å; F178-Y227 HydrophobicContact CE2-CG 4.06Å; F178-Y227 AromaticContact CZ-CD1 3.93Å; F178-Y227 HydrophobicContact CZ-CD1 3.93Å; F178-Y227 HydrophobicContact CZ-CE1 4.44Å; F178-Y227 HydrophobicContact CZ-CG 4.41Å; C193-Y227 WeakPolarHBondContact CB-OH 3.23Å; C193-Y227 PolarHBondContact SG-OH 3.3Å; L197-Y227 HydrophobicContact CD1-CE1 4.43Å; L197-Y227 HydrophobicContact CD2-CE1 4.36Å; F223-Y227 VanDerWaalsContact O-CB 3.3Å; F223-Y227 WeakPolarHBondContact O-CB 3.5Å; F223-Y227 PolarHBondContact O-N 3.14Å; S224-Y227 PolarHBondContact O-N 3.46Å; F225-Y227 VanDerWaalsContact C-N 3.3Å; F225-Y227 PolarHBondContact O-N 3.44Å; Y227-L229 PolarHBondContact O-N 3.04Å; Y227-T230 PolarHBondContact O-N 3.4Å; Y227-G231 WeakPolarHBondContact O-CA 3.39Å; Y227-G231 PolarHBondContact O-N 2.92Å
228I96.5Very high94Very high0 Ų039.6 Ų39.60%022%0.217CC..Hα-helixtrans-60.3-49.3179.7-69.2167.4000110.5Y85 I88 I94 T196 S224 F225 T230 G231 L232Y85-I228 HydrophobicContact CE2-CD1 3.88Å; I88-I228 HydrophobicContact CG2-CG2 4.08Å; I94-I228 HydrophobicContact CD1-CG2 3.79Å; T196-I228 HydrophobicContact CG2-CG1 4.06Å; S224-I228 VanDerWaalsContact O-CG1 3.3Å; S224-I228 WeakPolarHBondContact O-CG1 3.37Å; S224-I228 PolarHBondContact O-N 3.45Å; F225-I228 PolarHBondContact O-N 3.2Å; I228-T230 PolarHBondContact O-N 2.92Å; I228-G231 PolarHBondContact O-N 2.96Å; I228-L232 HydrophobicContact CG2-CD1 3.89Å; I228-L232 HydrophobicContact CG2-CG 4.46Å; I228-L232 WeakPolarHBondContact O-CB 3.45Å; I228-L232 VanDerWaalsContact O-CG 3.27Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.4Å
229L94.8Very high94.1Very high70 Ų7039.1 Ų39.137%0.36621%0.208SC..Hα-helixtrans-64.6-43.2-178.5-67.7174.2000112.3F225 Y227 A233F225-L229 WeakPolarHBondContact O-CB 3.28Å; F225-L229 VanDerWaalsContact O-CG 3.32Å; F225-L229 WeakPolarHBondContact O-CG 3.38Å; F225-L229 PolarHBondContact O-N 2.73Å; Y227-L229 PolarHBondContact O-N 3.04Å; L229-A233 WeakPolarHBondContact O-CB 3.42Å; L229-A233 PolarHBondContact O-N 2.94Å; L229-A233 VanDerWaalsContact O-N 3.11Å
230T95.3Very high94Very high81 Ų8132 Ų3250%0.49718%0.176SC..Hα-helixtrans-70.3-42.3179.2-53.70000111.1I226 Y227 I228 A233 V234I226-T230 WeakPolarHBondContact O-CB 3.35Å; I226-T230 PolarHBondContact O-N 3.03Å; I226-T230 PolarHBondContact O-OG1 3.48Å; Y227-T230 PolarHBondContact O-N 3.4Å; I228-T230 PolarHBondContact O-N 2.92Å; T230-A233 WeakPolarHBondContact O-CB 3.38Å; T230-A233 PolarHBondContact O-N 3.4Å; T230-V234 WeakPolarHBondContact O-CG2 3.36Å; T230-V234 PolarHBondContact O-N 2.95Å
231G96.4Very high93.7Very high1 Ų132.8 Ų32.81%0.0118%0.181CC..Hα-helixtrans-63.5-44.5178.600000112Y227 I228 A233 V234 I235Y227-G231 WeakPolarHBondContact O-CA 3.39Å; Y227-G231 PolarHBondContact O-N 2.92Å; I228-G231 PolarHBondContact O-N 2.96Å; G231-A233 VanDerWaalsContact C-N 3.27Å; G231-A233 PolarHBondContact O-N 2.98Å; G231-V234 PolarHBondContact O-N 3.47Å; G231-V234 VanDerWaalsContact O-N 3.11Å; G231-I235 WeakPolarHBondContact O-CG1 3.36Å; G231-I235 PolarHBondContact O-N 3.39Å
232L95.6Very high93.3Very high10 Ų1034.5 Ų34.55%0.05220%0.196CC..Hα-helixtrans-62.3-35.2173.7-74.3173.1000112T92 I94 F125 L197 T199 I228 G236T92-L232 HydrophobicContact CG2-CD1 3.52Å; I94-L232 HydrophobicContact CD1-CD1 4.26Å; F125-L232 HydrophobicContact CD1-CB 4.42Å; F125-L232 HydrophobicContact CE1-CB 3.66Å; F125-L232 HydrophobicContact CE2-CB 3.98Å; F125-L232 HydrophobicContact CE2-CD1 4.01Å; F125-L232 HydrophobicContact CZ-CB 3.41Å; F125-L232 VanDerWaalsContact CZ-CB 3.41Å; F125-L232 HydrophobicContact CZ-CD1 3.74Å; F125-L232 HydrophobicContact CZ-CG 4.24Å; L197-L232 HydrophobicContact CD2-CG 4.26Å; L197-L232 WeakPolarHBondContact O-CD2 3.37Å; T199-L232 HydrophobicContact CG2-CD2 3.57Å; I228-L232 HydrophobicContact CG2-CD1 3.89Å; I228-L232 HydrophobicContact CG2-CG 4.46Å; I228-L232 WeakPolarHBondContact O-CB 3.45Å; I228-L232 VanDerWaalsContact O-CG 3.27Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.4Å; L232-G236 WeakPolarHBondContact O-CA 3.38Å; L232-G236 PolarHBondContact O-N 3.08Å
233A94.6Very high92.8Very high10 Ų1035.2 Ų35.28%0.08320%0.195CC..Hα-helixtrans-65.9-37.7173.600000112.4F125 V128 I132 L229 T230 G231 A237F125-A233 HydrophobicContact CD1-CB 4.12Å; F125-A233 HydrophobicContact CE1-CB 4.24Å; V128-A233 HydrophobicContact CG1-CB 3.98Å; I132-A233 HydrophobicContact CD1-CB 4.16Å; L229-A233 WeakPolarHBondContact O-CB 3.42Å; L229-A233 PolarHBondContact O-N 2.94Å; L229-A233 VanDerWaalsContact O-N 3.11Å; T230-A233 WeakPolarHBondContact O-CB 3.38Å; T230-A233 PolarHBondContact O-N 3.4Å; G231-A233 VanDerWaalsContact C-N 3.27Å; G231-A233 PolarHBondContact O-N 2.98Å; A233-A237 VanDerWaalsContact O-CB 3.32Å; A233-A237 WeakPolarHBondContact O-CB 3.25Å; A233-A237 PolarHBondContact O-N 3.15Å
234V95.3Very high91.9Very high21 Ų2134.8 Ų34.813%0.12720%0.196CC..Hα-helixtrans-66.8-49.6175.4172.30000111.2S166 T230 G231 G236 A237 F238S166-V234 WeakPolarHBondContact OG-CG1 3.45Å; T230-V234 WeakPolarHBondContact O-CG2 3.36Å; T230-V234 PolarHBondContact O-N 2.95Å; G231-V234 PolarHBondContact O-N 3.47Å; G231-V234 VanDerWaalsContact O-N 3.11Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.33Å; V234-A237 WeakPolarHBondContact O-CB 3.43Å; V234-A237 PolarHBondContact O-N 3.09Å; V234-F238 PolarHBondContact O-N 3.37Å
235I94.3Very high90.7Very high27 Ų2742.9 Ų42.914%0.13823%0.226CC..Hα-helixtrans-61.8-43.3176.3-60.7-50.5000110.2C167 L197 G231 A237 F238 L239C167-I235 HydrophobicContact CB-CD1 3.8Å; L197-I235 HydrophobicContact CB-CG1 3.91Å; L197-I235 HydrophobicContact CD1-CG1 4.45Å; G231-I235 WeakPolarHBondContact O-CG1 3.36Å; G231-I235 PolarHBondContact O-N 3.39Å; I235-A237 VanDerWaalsContact C-N 3.35Å; I235-A237 PolarHBondContact O-N 3.17Å; I235-F238 WeakPolarHBondContact O-CB 3.32Å; I235-F238 PolarHBondContact O-N 3.02Å; I235-F238 VanDerWaalsContact O-N 3.15Å; I235-L239 HydrophobicContact CG2-CD1 4.01Å; I235-L239 HydrophobicContact CG2-CG 4.24Å; I235-L239 WeakPolarHBondContact O-CG 3.33Å; I235-L239 PolarHBondContact O-N 3.13Å
236G92.8Very high89.6Confident12 Ų1246.2 Ų46.212%0.12424%0.241CC..Hα-helixtrans-60-40.4175.500000113L232 V234 F238 L239 N240L232-G236 WeakPolarHBondContact O-CA 3.38Å; L232-G236 PolarHBondContact O-N 3.08Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.33Å; G236-F238 VanDerWaalsContact C-N 3.34Å; G236-F238 PolarHBondContact O-N 3.06Å; G236-L239 PolarHBondContact O-N 3.22Å; G236-N240 VanDerWaalsContact O-CB 3.27Å; G236-N240 WeakPolarHBondContact O-CB 3.5Å; G236-N240 PolarHBondContact O-N 3.36Å
237A92.9Very high88.7Confident3 Ų346.9 Ų46.93%0.02524%0.243CC..Hα-helixtrans-62.2-41.9174.100000111.9I132 N133 A233 V234 I235 L241I132-A237 HydrophobicContact CB-CB 4.32Å; I132-A237 HydrophobicContact CG2-CB 4.22Å; N133-A237 PolarHBondContact ND2-O 3Å; A233-A237 VanDerWaalsContact O-CB 3.32Å; A233-A237 WeakPolarHBondContact O-CB 3.25Å; A233-A237 PolarHBondContact O-N 3.15Å; V234-A237 WeakPolarHBondContact O-CB 3.43Å; V234-A237 PolarHBondContact O-N 3.09Å; I235-A237 VanDerWaalsContact C-N 3.35Å; I235-A237 PolarHBondContact O-N 3.17Å; A237-L241 PolarHBondContact O-N 3.48Å; A237-L241 VanDerWaalsContact O-N 3.1Å
238F93.1Very high87.7Confident50 Ų5048.4 Ų48.422%0.21926%0.255CS..Hα-helixtrans-66.6-45.6176.7-179-106.3000112.1V160 F164 V234 I235 G236 N240 L241 A242V160-F238 HydrophobicContact CG1-CE2 4.28Å; F164-F238 HydrophobicContact CB-CE2 4.28Å; V234-F238 PolarHBondContact O-N 3.37Å; I235-F238 WeakPolarHBondContact O-CB 3.32Å; I235-F238 PolarHBondContact O-N 3.02Å; I235-F238 VanDerWaalsContact O-N 3.15Å; G236-F238 VanDerWaalsContact C-N 3.34Å; G236-F238 PolarHBondContact O-N 3.06Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.37Å; F238-L241 PolarHBondContact O-N 3.3Å; F238-L241 VanDerWaalsContact O-N 3.17Å; F238-A242 WeakPolarHBondContact O-CB 3.43Å; F238-A242 PolarHBondContact O-N 3.45Å
239L90.5Very high86.5Confident85 Ų8551.9 Ų51.945%0.44527%0.271SS..Hα-helixtrans-62.6-39.8175.9-68.7176.5000111.9I235 G236 L241 A242 V243 L244I235-L239 HydrophobicContact CG2-CD1 4.01Å; I235-L239 HydrophobicContact CG2-CG 4.24Å; I235-L239 WeakPolarHBondContact O-CG 3.33Å; I235-L239 PolarHBondContact O-N 3.13Å; G236-L239 PolarHBondContact O-N 3.22Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.46Å; L239-A242 PolarHBondContact O-N 3.3Å; L239-V243 HydrophobicContact CD2-CG2 3.91Å; L239-V243 WeakPolarHBondContact O-CA 3.37Å; L239-V243 VanDerWaalsContact O-CB 3.32Å; L239-V243 WeakPolarHBondContact O-CB 3.49Å; L239-V243 PolarHBondContact O-N 3.11Å; L239-L244 PolarHBondContact O-N 3.19Å
240N87.8Confident85.5Confident21 Ų2150.5 Ų50.511%0.11226%0.264CS..Iπ-helixtrans-59.6-43.2173.9-175.89.2000111.1Q126 G236 F238 L244Q126-N240 VanDerWaalsContact OE1-CG 3.23Å; Q126-N240 PolarHBondContact OE1-OD1 3.49Å; G236-N240 VanDerWaalsContact O-CB 3.27Å; G236-N240 WeakPolarHBondContact O-CB 3.5Å; G236-N240 PolarHBondContact O-N 3.36Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.37Å; N240-L244 VanDerWaalsContact O-CB 3.23Å; N240-L244 WeakPolarHBondContact O-CB 3.47Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.41Å
241L86.1Confident84.5Confident28 Ų2849.3 Ų49.315%0.14726%0.263CS..Iπ-helixtrans-67.5-46.6177.9-177.867000112.8L156 M159 V160 A237 F238 L239L156-L241 HydrophobicContact CD1-CD1 3.73Å; L156-L241 HydrophobicContact CD1-CG 4.29Å; M159-L241 HydrophobicContact CB-CD1 4.43Å; M159-L241 HydrophobicContact CB-CD2 3.7Å; V160-L241 HydrophobicContact CG2-CD2 3.92Å; V160-L241 HydrophobicContact CG2-CG 4.32Å; A237-L241 PolarHBondContact O-N 3.48Å; A237-L241 VanDerWaalsContact O-N 3.1Å; F238-L241 PolarHBondContact O-N 3.3Å; F238-L241 VanDerWaalsContact O-N 3.17Å; L239-L241 VanDerWaalsContact C-N 3.31Å; L239-L241 PolarHBondContact O-N 3.46Å
242A84Confident83.6Confident46 Ų4654.1 Ų54.138%0.3829%0.285SS..Iπ-helixtrans-88.5-41.2-169.300000113.7F238 L239F238-A242 WeakPolarHBondContact O-CB 3.43Å; F238-A242 PolarHBondContact O-N 3.45Å; L239-A242 PolarHBondContact O-N 3.3Å
243V81.8Confident82.7Confident60 Ų6054.3 Ų54.336%0.36429%0.286SS..Iπ-helixtrans-101-39.7-168.3-177.70000112L239 R245 F246 M247L239-V243 HydrophobicContact CD2-CG2 3.91Å; L239-V243 WeakPolarHBondContact O-CA 3.37Å; L239-V243 VanDerWaalsContact O-CB 3.32Å; L239-V243 WeakPolarHBondContact O-CB 3.49Å; L239-V243 PolarHBondContact O-N 3.11Å; V243-R245 VanDerWaalsContact C-N 3.26Å; V243-R245 PolarHBondContact O-N 3.23Å; V243-F246 WeakPolarHBondContact O-CB 3.31Å; V243-F246 PolarHBondContact O-N 3.18Å; V243-M247 HydrophobicContact CG1-CE 3.95Å; V243-M247 HydrophobicContact CG1-CG 4.45Å; V243-M247 PolarHBondContact O-N 3.45Å; V243-M247 VanDerWaalsContact O-N 3.16Å
244L74.8Confident81.9Confident59 Ų5959.3 Ų59.331%0.30931%0.308SS..Iπ-helixtrans-61.7-36.4-174.1-166.468.5000112.1L239 N240 F246 M247 T248L239-L244 PolarHBondContact O-N 3.19Å; N240-L244 VanDerWaalsContact O-CB 3.23Å; N240-L244 WeakPolarHBondContact O-CB 3.47Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.41Å; L244-F246 VanDerWaalsContact C-N 3.28Å; L244-F246 PolarHBondContact O-N 3.44Å; L244-M247 PolarHBondContact O-N 3.37Å; L244-T248 HydrophobicContact CG-CG2 4.49Å; L244-T248 WeakPolarHBondContact O-CG2 3.49Å; L244-T248 PolarHBondContact O-N 3.41Å; L244-T248 PolarHBondContact O-OG1 3.18Å
245R70.2Confident81.2Confident171 Ų17164.8 Ų64.865%0.64533%0.33SS*.Hα-helixtrans-60.1-36.2175.2-74.9-70.1-173.8-131.2-3.8113.1V243 T248 M249V243-R245 VanDerWaalsContact C-N 3.26Å; V243-R245 PolarHBondContact O-N 3.23Å; R245-T248 WeakPolarHBondContact CA-OG1 3.11Å; R245-T248 PolarHBondContact O-OG1 3.5Å; R245-T248 VanDerWaalsContact O-OG1 3.08Å; R245-M249 WeakPolarHBondContact O-CB 3.45Å; R245-M249 PolarHBondContact O-N 3.13Å; R245-M249 VanDerWaalsContact O-N 3.13Å
246F73Confident80.6Confident91 Ų9170.2 Ų70.240%0.39935%0.349SS..Hα-helixtrans-72.5-39.8177.4-173.2-95.9000111.4L11 V243 L244 M249L11-F246 HydrophobicContact CD1-CE1 4.08Å; L11-F246 HydrophobicContact CD1-CZ 4.43Å; L11-F246 HydrophobicContact CD2-CE1 4.33Å; L11-F246 HydrophobicContact CD2-CZ 4.41Å; V243-F246 WeakPolarHBondContact O-CB 3.31Å; V243-F246 PolarHBondContact O-N 3.18Å; L244-F246 VanDerWaalsContact C-N 3.28Å; L244-F246 PolarHBondContact O-N 3.44Å; F246-M249 HydrophobicContact CD2-CE 3.64Å; F246-M249 HydrophobicContact CE2-CE 3.71Å; F246-M249 WeakPolarHBondContact O-CB 3.37Å; F246-M249 PolarHBondContact O-N 3.47Å
247M74.9Confident80Confident122 Ų12272.1 Ų72.160%0.60136%0.356SS*.Hα-helixtrans-63.9-42.9175.4-67.3-172171.800112.1V243 L244 M249 N250V243-M247 HydrophobicContact CG1-CE 3.95Å; V243-M247 HydrophobicContact CG1-CG 4.45Å; V243-M247 PolarHBondContact O-N 3.45Å; V243-M247 VanDerWaalsContact O-N 3.16Å; L244-M247 PolarHBondContact O-N 3.37Å; M247-M249 VanDerWaalsContact C-N 3.32Å; M247-M249 PolarHBondContact O-N 3.49Å; M247-N250 PolarHBondContact O-N 3.34Å
248T76.2Confident79.5Confident49 Ų4974.1 Ų74.130%0.30137%0.373SS..Hα-helixtrans-70.1-28.3178.955.60000113.1L244 R245 N250 A251 E252L244-T248 HydrophobicContact CG-CG2 4.49Å; L244-T248 WeakPolarHBondContact O-CG2 3.49Å; L244-T248 PolarHBondContact O-N 3.41Å; L244-T248 PolarHBondContact O-OG1 3.18Å; R245-T248 WeakPolarHBondContact CA-OG1 3.11Å; R245-T248 PolarHBondContact O-OG1 3.5Å; R245-T248 VanDerWaalsContact O-OG1 3.08Å; T248-N250 PolarHBondContact O-N 3.48Å; T248-A251 PolarHBondContact O-N 3.38Å; T248-A251 VanDerWaalsContact O-N 3.14Å; T248-E252 WeakPolarHBondContact O-CG 3.31Å; T248-E252 PolarHBondContact O-N 3.11Å
249M72.7Confident79.1Confident72 Ų7276.7 Ų76.736%0.35539%0.385SS..Hα-helixtrans-59.6-32.6176.5-171.9173.462.900111.6R245 F246 M247 D253R245-M249 WeakPolarHBondContact O-CB 3.45Å; R245-M249 PolarHBondContact O-N 3.13Å; R245-M249 VanDerWaalsContact O-N 3.13Å; F246-M249 HydrophobicContact CD2-CE 3.64Å; F246-M249 HydrophobicContact CE2-CE 3.71Å; F246-M249 WeakPolarHBondContact O-CB 3.37Å; F246-M249 PolarHBondContact O-N 3.47Å; M247-M249 VanDerWaalsContact C-N 3.32Å; M247-M249 PolarHBondContact O-N 3.49Å; M249-D253 WeakPolarHBondContact O-CB 3.42Å; M249-D253 PolarHBondContact O-N 2.85Å
250N72.9Confident78.8Confident41 Ų4178.7 Ų78.722%0.21939%0.393CS..Hα-helixtrans-65.3-44.1176.2-64.14000112.3R7 M247 T248 D253 E254R7-N250 VanDerWaalsContact CZ-CG 3.44Å; R7-N250 PolarHBondContact NE-OD1 3.4Å; R7-N250 PolarHBondContact NH1-OD1 2.88Å; R7-N250 PolarHBondContact NH2-OD1 2.95Å; M247-N250 PolarHBondContact O-N 3.34Å; T248-N250 PolarHBondContact O-N 3.48Å; N250-D253 PolarHBondContact O-N 3.17Å; N250-E254 WeakPolarHBondContact O-CG 3Å; N250-E254 PolarHBondContact O-N 2.84Å
251A75.8Confident78.6Confident57 Ų5784.2 Ų84.247%0.47141%0.412SS..Hα-helixtrans-70-36.9178.900000112.3T248 E254 K255T248-A251 PolarHBondContact O-N 3.38Å; T248-A251 VanDerWaalsContact O-N 3.14Å; A251-E254 PolarHBondContact O-N 3.4Å; A251-K255 PolarHBondContact O-N 3.44Å
252E76.8Confident78.5Confident101 Ų10185.9 Ų85.947%0.47243%0.43SS..Hα-helixtrans-66.2-38.5174.8-71.5-179.5176.800111.8T248 K255 R256T248-E252 WeakPolarHBondContact O-CG 3.31Å; T248-E252 PolarHBondContact O-N 3.11Å; E252-K255 PolarHBondContact O-N 3.37Å; E252-R256 WeakPolarHBondContact O-CG 3.48Å; E252-R256 PolarHBondContact O-N 2.83Å
253D76.4Confident78.6Confident15 Ų1589.4 Ų89.48%0.0844%0.442CS..Hα-helixtrans-63.6-42.7172-69.6-22.4000111.8Q4 R7 M249 N250 K255 R256 D257Q4-D253 HydrophobicContact CG-CB 4.5Å; Q4-D253 VanDerWaalsContact NE2-C 3.28Å; Q4-D253 PolarHBondContact NE2-O 3.35Å; R7-D253 IonicContact CZ-OD2 3.39Å; R7-D253 IonicContact NH1-OD2 3.36Å; R7-D253 PolarHBondContact NH1-OD2 3.33Å; R7-D253 IonicContact NH2-OD2 3.16Å; R7-D253 PolarHBondContact NH2-OD2 2.92Å; R7-D253 VanDerWaalsContact NH2-OD2 3.16Å; M249-D253 WeakPolarHBondContact O-CB 3.42Å; M249-D253 PolarHBondContact O-N 2.85Å; N250-D253 PolarHBondContact O-N 3.17Å; D253-K255 VanDerWaalsContact C-N 3.33Å; D253-K255 PolarHBondContact O-N 2.91Å; D253-R256 PolarHBondContact O-N 3.33Å; D253-R256 IonicContact OD1-CZ 3.55Å; D253-R256 IonicContact OD1-NE 3.83Å; D253-R256 IonicContact OD1-NH2 2.7Å; D253-R256 PolarHBondContact OD1-NH2 2.89Å; D253-D257 WeakPolarHBondContact O-CB 3.39Å; D253-D257 PolarHBondContact O-N 3.4Å
254E76.8Confident78.7Confident114 Ų11492.4 Ų92.453%0.53346%0.455SS..Hα-helixtrans-61.5-42.2177.4-78.9179.6-178.300112Q4 N250 A251 D257 A258Q4-E254 HydrophobicContact CG-CG 4.44Å; Q4-E254 VanDerWaalsContact NE2-CA 3.28Å; N250-E254 WeakPolarHBondContact O-CG 3Å; N250-E254 PolarHBondContact O-N 2.84Å; A251-E254 PolarHBondContact O-N 3.4Å; E254-D257 PolarHBondContact O-N 3.15Å; E254-A258 WeakPolarHBondContact O-CB 3.38Å; E254-A258 PolarHBondContact O-N 2.88Å
255K81.6Confident79Confident137 Ų13792.6 Ų92.660%0.59647%0.465SS*.Hα-helixtrans-62.6-47.2176.1-174.9177.9172.8-177.20111.2A251 E252 D253 D257 A258 E259A251-K255 PolarHBondContact O-N 3.44Å; E252-K255 PolarHBondContact O-N 3.37Å; D253-K255 VanDerWaalsContact C-N 3.33Å; D253-K255 PolarHBondContact O-N 2.91Å; K255-D257 PolarHBondContact O-N 3.26Å; K255-A258 PolarHBondContact O-N 2.96Å; K255-E259 WeakPolarHBondContact CE-OE1 3.49Å; K255-E259 IonicContact NZ-OE1 3.98Å; K255-E259 WeakPolarHBondContact O-CG 3.2Å; K255-E259 PolarHBondContact O-N 2.8Å
256R80.6Confident79.2Confident140 Ų14090.2 Ų90.253%0.52846%0.461SS..Hα-helixtrans-61.3-43177.6-73.4-171.2-70.2172.4-7.1112.2E252 D253 A258 E259 Q260E252-R256 WeakPolarHBondContact O-CG 3.48Å; E252-R256 PolarHBondContact O-N 2.83Å; D253-R256 PolarHBondContact O-N 3.33Å; D253-R256 IonicContact OD1-CZ 3.55Å; D253-R256 IonicContact OD1-NE 3.83Å; D253-R256 IonicContact OD1-NH2 2.7Å; D253-R256 PolarHBondContact OD1-NH2 2.89Å; R256-A258 VanDerWaalsContact C-N 3.3Å; R256-A258 PolarHBondContact O-N 3.26Å; R256-E259 PolarHBondContact O-N 2.74Å; R256-Q260 WeakPolarHBondContact O-CB 3.49Å; R256-Q260 PolarHBondContact O-N 3.17Å
257D80.9Confident78.9Confident53 Ų5391.7 Ų91.728%0.28347%0.473SS..Hα-helixtrans-68.3-28.2177.5-75.3-11.6000112.8Q4 D253 E254 K255 R261Q4-D257 PolarHBondContact NE2-OD2 3.37Å; D253-D257 WeakPolarHBondContact O-CB 3.39Å; D253-D257 PolarHBondContact O-N 3.4Å; E254-D257 PolarHBondContact O-N 3.15Å; K255-D257 PolarHBondContact O-N 3.26Å; D257-R261 WeakPolarHBondContact O-CB 3.27Å; D257-R261 WeakPolarHBondContact O-CG 3.41Å; D257-R261 PolarHBondContact O-N 3.42Å; D257-R261 PolarHBondContact O-NE 2.98Å
258A82.7Confident78.1Confident45 Ų4588.6 Ų88.637%0.37247%0.472SS..Hα-helixtrans-74.4-45174.100000111.6E254 K255 R256 R261 A262E254-A258 WeakPolarHBondContact O-CB 3.38Å; E254-A258 PolarHBondContact O-N 2.88Å; K255-A258 PolarHBondContact O-N 2.96Å; R256-A258 VanDerWaalsContact C-N 3.3Å; R256-A258 PolarHBondContact O-N 3.26Å; A258-R261 PolarHBondContact O-N 3.25Å; A258-A262 PolarHBondContact O-N 3.29Å
259E85.8Confident77.1Confident103 Ų10393.6 Ų93.648%0.48149%0.492SS..Hα-helixtrans-60.3-45.8175.3-72.9172.8-179.900111.1K255 R256 R261 A262 L263K255-E259 WeakPolarHBondContact CE-OE1 3.49Å; K255-E259 IonicContact NZ-OE1 3.98Å; K255-E259 WeakPolarHBondContact O-CG 3.2Å; K255-E259 PolarHBondContact O-N 2.8Å; R256-E259 PolarHBondContact O-N 2.74Å; E259-R261 VanDerWaalsContact C-N 3.31Å; E259-R261 PolarHBondContact O-N 3.49Å; E259-A262 PolarHBondContact O-N 3.46Å; E259-A262 VanDerWaalsContact O-N 3.15Å; E259-L263 WeakPolarHBondContact O-CG 3.41Å; E259-L263 PolarHBondContact O-N 3.1Å
260Q83.3Confident76.1Confident128 Ų12895.3 Ų95.360%0.59851%0.506SS*.Hα-helixtrans-65.6-33.2179.3-164.7154.8-14.400112.7R256 L264R256-Q260 WeakPolarHBondContact O-CB 3.49Å; R256-Q260 PolarHBondContact O-N 3.17Å; Q260-L264 VanDerWaalsContact O-CG 3.32Å; Q260-L264 WeakPolarHBondContact O-CG 3.31Å; Q260-L264 PolarHBondContact O-N 3.04Å
261R82.6Confident74.8Confident137 Ų13796.6 Ų96.652%0.51753%0.529SS..Hα-helixtrans-68.5-39.3171.8-82.3-179.6-75.2144.3-4.5112.7D257 A258 E259 L263 L264 A265D257-R261 WeakPolarHBondContact O-CB 3.27Å; D257-R261 WeakPolarHBondContact O-CG 3.41Å; D257-R261 PolarHBondContact O-N 3.42Å; D257-R261 PolarHBondContact O-NE 2.98Å; A258-R261 PolarHBondContact O-N 3.25Å; E259-R261 VanDerWaalsContact C-N 3.31Å; E259-R261 PolarHBondContact O-N 3.49Å; R261-L263 VanDerWaalsContact C-N 3.34Å; R261-L264 PolarHBondContact O-N 3.4Å; R261-A265 PolarHBondContact O-N 3.05Å
262A85.6Confident73.1Confident63 Ų6397 Ų9752%0.52154%0.538SS..Hα-helixtrans-64-40176.600000111.7A258 E259 A265 H266A258-A262 PolarHBondContact O-N 3.29Å; E259-A262 PolarHBondContact O-N 3.46Å; E259-A262 VanDerWaalsContact O-N 3.15Å; A262-A265 PolarHBondContact O-N 3.03Å; A262-H266 PolarHBondContact O-N 3.46Å; A262-H266 VanDerWaalsContact O-N 3.08Å
263L84.3Confident71.5Confident120 Ų120100.6 Ų100.663%0.62856%0.555SS**Hα-helixtrans-64.1-41.4175.5-68.4173.7000112.7E259 R261 A265 H266 N267E259-L263 WeakPolarHBondContact O-CG 3.41Å; E259-L263 PolarHBondContact O-N 3.1Å; R261-L263 VanDerWaalsContact C-N 3.34Å; L263-A265 VanDerWaalsContact C-N 3.34Å; L263-H266 PolarHBondContact O-N 3.24Å; L263-N267 PolarHBondContact O-N 3.06Å; L263-N267 VanDerWaalsContact O-N 3.09Å
264L84.6Confident70.1Confident123 Ų123107.3 Ų107.364%0.64459%0.589SS**Hα-helixtrans-65.5-36.7176-70.4169.6000112.2Q260 R261 G268Q260-L264 VanDerWaalsContact O-CG 3.32Å; Q260-L264 WeakPolarHBondContact O-CG 3.31Å; Q260-L264 PolarHBondContact O-N 3.04Å; R261-L264 PolarHBondContact O-N 3.4Å; L264-G268 PolarHBondContact O-N 3.33Å; L264-G268 VanDerWaalsContact O-N 3.11Å
265A81Confident68.2Low62 Ų62109 Ų10951%0.51260%0.602SS.*Hα-helixtrans-66.6-38.9175.700000112.5R261 A262 L263R261-A265 PolarHBondContact O-N 3.05Å; A262-A265 PolarHBondContact O-N 3.03Å; L263-A265 VanDerWaalsContact C-N 3.34Å
266H75.1Confident65.9Low122 Ų122108.2 Ų108.257%0.56561%0.613SS**Hα-helixtrans-68.9-42.9178.2-170.4-81.6000112.4A262 L263 G268 Q269A262-H266 PolarHBondContact O-N 3.46Å; A262-H266 VanDerWaalsContact O-N 3.08Å; L263-H266 PolarHBondContact O-N 3.24Å; H266-G268 VanDerWaalsContact C-N 3.32Å; H266-G268 PolarHBondContact O-N 3.16Å; H266-Q269 PolarHBondContact O-N 3.35Å
267N66.3Low63.6Low122 Ų122107.3 Ų107.365%0.65263%0.628SS**Hα-helixtrans-70.7-26.7177.4-83.42.6000113.3L263 Q269 V270 G271L263-N267 PolarHBondContact O-N 3.06Å; L263-N267 VanDerWaalsContact O-N 3.09Å; N267-Q269 VanDerWaalsContact C-N 3.29Å; N267-Q269 PolarHBondContact O-N 3.04Å; N267-V270 PolarHBondContact O-N 3.31Å; N267-G271 PolarHBondContact O-N 3.48Å
268G58.5Low61.5Low57 Ų57110.9 Ų110.959%0.58865%0.651SS**Hα-helixtrans-68.1-23.9173.400000114.2L264 H266L264-G268 PolarHBondContact O-N 3.33Å; L264-G268 VanDerWaalsContact O-N 3.11Å; H266-G268 VanDerWaalsContact C-N 3.32Å; H266-G268 PolarHBondContact O-N 3.16Å
269Q54.1Low59.1Low154 Ų154116 Ų11672%0.7267%0.672SS**Hα-helixtrans-83.6-25.8176.3-82.3175.6-35.600113.4H266 N267H266-Q269 PolarHBondContact O-N 3.35Å; N267-Q269 VanDerWaalsContact C-N 3.29Å; N267-Q269 PolarHBondContact O-N 3.04Å
270V52.6Low57.9Low108 Ų108116.2 Ų116.266%0.65568%0.682SS**Hα-helixtrans-80.7-23178.6-177.20000112.1N267N267-V270 PolarHBondContact O-N 3.31Å
271G45.6Very low55.4Low67 Ų67116.9 Ų116.969%0.69170%0.695SS**THydrogen-bonded Turntrans-84.7-417800000116.1N267N267-G271 PolarHBondContact O-N 3.48Å
272G41.1Very low53Low65 Ų65115.4 Ų115.467%0.6771%0.706SS**THydrogen-bonded Turntrans-93.43.1-17500000115.9
273H41.1Very low51.3Low178 Ų178118 Ų11882%0.82472%0.717SS**  trans-113.853.7-172.1-114.9-62.8000112.6
274I47.4Very low48.6Very low155 Ų155117.3 Ų117.380%0.79572%0.722SS**  trans-135.9124.5165.5-57-179.3000108.7
275N38.3Very low46Very low149 Ų149117.1 Ų117.180%0.79773%0.732SS**  trans82.998.5-179.7-68.8-0.1000118.3
276C32Very low43.5Very low122 Ų122120.5 Ų120.582%0.82475%0.746SS**  -167116.4103-102.50000112.6
277S33.1Very low42Very low121 Ų121120.2 Ų120.285%0.84676%0.755SS**  trans11.8138.2148.1-19.40000122.4
278V36.7Very low41Very low127 Ų127120.8 Ų120.877%0.7777%0.765SS**  trans-59.4137.9167.6-177.40000113.1
279D32.9Very low39.6Very low153 Ų153122 Ų12282%0.81878%0.777SS**  -179.4158.2118.1-97.1-30.3000113.7
280P60.4Low38.6Very low107 Ų107121.5 Ų121.570%0.69579%0.79SS**  trans-106170.9-153.740.2-34.6000115.1
281V30.4Very low37.5Very low143 Ų143120.1 Ų120.187%0.86780%0.797SS**  trans158.1127.9137.4161.60000110.8
282S31.1Very low36.6Very low106 Ų106121 Ų12174%0.74181%0.806SS**  trans-80.2-172.9171.1-430000111.1
283P50Low36Very low116 Ų116122 Ų12275%0.75382%0.816SS**  cis-142.9-178.5-0.437.4-15.3000116.7
284S28.4Very low35.5Very low106 Ų106119.5 Ų119.574%0.74182%0.819SS**  trans87.3122.8144.375.20000121.6
285S30Very low34.6Very low120 Ų120117 Ų11784%0.83982%0.822SS**  142.4132.3120.260.70000114.7
286T28.4Very low34.4Very low133 Ų133118.5 Ų118.582%0.81683%0.827SS**  trans-67.3-175.6170.540.40000112
287P42.6Very low34.3Very low116 Ų116116.3 Ų116.375%0.75383%0.825SS**  cis-134.8-169.5-2.219.79.3000113.9
288P47.2Very low34.1Very low134 Ų134114.3 Ų114.387%0.8782%0.824SS**  trans-92.4151.7-175.335.8-30.2000113.8
289G28.4Very low33.7Very low81 Ų81114 Ų11484%0.83583%0.827SS**  trans-131.3115.7177.100000112.6
290C32.7Very low33.9Very low145 Ų145112.4 Ų112.498%0.9883%0.828SS**  trans-79.2144.2164.6-80.40000111.4
291G28.9Very low32.7Very low79 Ų79111.3 Ų111.381%0.81484%0.837SS**  trans176.1121.8162.800000106.4
292G27.7Very low32.9Very low86 Ų86107.3 Ų107.389%0.88782%0.824SS**  cis114.8122.439.300000106.2
293G28.3Very low33.1Very low84 Ų84106.7 Ų106.787%0.86683%0.825SS**  trans144.3103.5167.900000116.7
294S29.7Very low32.5Very low127 Ų127105.4 Ų105.489%0.88883%0.825SS**  trans-54.9151.9171.6-43.40000115.8
295A29.8Very low33.1Very low103 Ų103104.7 Ų104.785%0.85182%0.819SS**  trans-164.3130.1133.700000111.8
296I33.8Very low33.6Very low179 Ų179108.5 Ų108.592%0.91882%0.815SS**  trans-79.4137.8174.2-68.3164.9000108.9
297G28.9Very low34.1Very low76 Ų76104.4 Ų104.478%0.78480%0.8SS**  trans-164.1101.7167.500000110
298G30Very low34.1Very low79 Ų79105.1 Ų105.181%0.81480%0.797SS**  trans-73.5150.2-179.600000113.2
299S28.4Very low33.9Very low120 Ų120108 Ų10884%0.83979%0.79SS**  trans-157.5121.7141.9-162.50000110.5
300S37.6Very low34.7Very low121 Ų121109.7 Ų109.785%0.84678%0.78SS**  trans-64.8127.3170.545.10000111.7
301G35Very low35.6Very low84 Ų84107 Ų10787%0.86676%0.759SS**  trans169.646.617200000115.4
302G33.7Very low36.3Very low58 Ų58111.7 Ų111.760%0.59875%0.754SS**  trans-121.74-165.900000118.3
303A35.3Very low37.3Very low93 Ų93109.9 Ų109.977%0.76973%0.73SS**SBendtrans-102.1-31.5-169.300000115.2
304A38.3Very low38.5Very low90 Ų90113.2 Ų113.274%0.74472%0.723SS**SBendtrans-83-23.6-174.700000114.4
305S39.4Very low39.5Very low90 Ų90111.6 Ų111.663%0.62971%0.708SS**Hα-helixtrans-79.5-17.2-177.5174.60000114.1
306R40.9Very low40.3Very low200 Ų200111.7 Ų111.776%0.75569%0.694SS**Hα-helixtrans-80.8-26.9-179.6-80.6-179.6175.6170.9-0.9113.4
307G38.6Very low40.9Very low48 Ų48109.7 Ų109.750%0.49568%0.68SS.*Hα-helixtrans-71-43.8178.500000113.6R309 N310 V311G307-R309 VanDerWaalsContact C-N 3.31Å; G307-R309 PolarHBondContact O-N 3.49Å; G307-N310 PolarHBondContact O-N 2.87Å; G307-V311 PolarHBondContact O-N 3.2Å
308L43.1Very low41.8Very low131 Ų131113.3 Ų113.369%0.68667%0.674SS**Hα-helixtrans-69.1-28.9-180-80.3159.4000113.3Y312L308-Y312 PolarHBondContact O-N 3.02Å
309R43.5Very low42.7Very low194 Ų194115.9 Ų115.973%0.73267%0.665SS**Hα-helixtrans-74-28.5179-160.7167.8163.5-100.7-0.3112.5G307 A313G307-R309 VanDerWaalsContact C-N 3.31Å; G307-R309 PolarHBondContact O-N 3.49Å; R309-A313 WeakPolarHBondContact O-CB 3.45Å; R309-A313 PolarHBondContact O-N 3.29Å
310N45.2Very low43.6Very low116 Ų116113.2 Ų113.262%0.6265%0.647SS**Hα-helixtrans-74.6-37.6172.8-91.96000112.4G307 A313 E314G307-N310 PolarHBondContact O-N 2.87Å; N310-A313 PolarHBondContact O-N 3.48Å; N310-E314 PolarHBondContact O-N 3.48Å
311V50.6Low44Very low90 Ų90112.6 Ų112.655%0.54563%0.632SS.*Hα-helixtrans-67.1-38.3176.1179.10000111.3G307 A313 E314 V315G307-V311 PolarHBondContact O-N 3.2Å; V311-A313 VanDerWaalsContact C-N 3.34Å; V311-A313 PolarHBondContact O-N 2.89Å; V311-E314 PolarHBondContact O-N 3.34Å; V311-V315 WeakPolarHBondContact O-CG2 3.38Å; V311-V315 PolarHBondContact O-N 3.34Å
312Y44.5Very low44.5Very low177 Ų177111.7 Ų111.769%0.69461%0.611SS**Hα-helixtrans-65-36.6172.6-114.1-94000112.7L308 L316L308-Y312 PolarHBondContact O-N 3.02Å; Y312-L316 HydrophobicContact CD1-CD1 4.23Å; Y312-L316 WeakPolarHBondContact O-CD1 3.43Å; Y312-L316 PolarHBondContact O-N 3.25Å; Y312-L316 VanDerWaalsContact O-N 3.13Å
313A49Very low45.2Very low48 Ų48112.2 Ų112.240%0.39761%0.606SS.*Hα-helixtrans-68.2-36.6177.800000112.5R309 N310 V311 H317R309-A313 WeakPolarHBondContact O-CB 3.45Å; R309-A313 PolarHBondContact O-N 3.29Å; N310-A313 PolarHBondContact O-N 3.48Å; V311-A313 VanDerWaalsContact C-N 3.34Å; V311-A313 PolarHBondContact O-N 2.89Å; A313-H317 PolarHBondContact O-N 2.94Å
314E52.7Low45.6Very low153 Ų153111.3 Ų111.372%0.71559%0.593SS**Hα-helixtrans-72.3-36.4176.9-69.9-158.316800113.1N310 V311 H317 F318N310-E314 PolarHBondContact O-N 3.48Å; V311-E314 PolarHBondContact O-N 3.34Å; E314-H317 PolarHBondContact O-N 2.97Å; E314-F318 PolarHBondContact O-N 3.48Å; E314-F318 VanDerWaalsContact O-N 3.1Å
315V51.2Low46.4Very low93 Ų93112.9 Ų112.956%0.56459%0.588SS**Hα-helixtrans-67-38.9174.91750000111.5V311 H317 F318 Q319V311-V315 WeakPolarHBondContact O-CG2 3.38Å; V311-V315 PolarHBondContact O-N 3.34Å; V315-H317 VanDerWaalsContact C-N 3.32Å; V315-H317 PolarHBondContact O-N 2.83Å; V315-F318 PolarHBondContact O-N 3.5Å; V315-Q319 PolarHBondContact O-N 2.95Å
316L46.5Very low46.9Very low106 Ų106114.8 Ų114.856%0.55558%0.582SS**Hα-helixtrans-66.2-33.2172.6-97.9133.1000112.5Y312 S320Y312-L316 HydrophobicContact CD1-CD1 4.23Å; Y312-L316 WeakPolarHBondContact O-CD1 3.43Å; Y312-L316 PolarHBondContact O-N 3.25Å; Y312-L316 VanDerWaalsContact O-N 3.13Å; L316-S320 WeakPolarHBondContact O-CB 3.37Å; L316-S320 PolarHBondContact O-N 3.22Å
317H45.8Very low47.1Very low136 Ų136112.8 Ų112.863%0.6358%0.575SS**Hα-helixtrans-68.3-35175.8-122.3-84.5000112.5A313 E314 V315 S320 M321A313-H317 PolarHBondContact O-N 2.94Å; E314-H317 PolarHBondContact O-N 2.97Å; V315-H317 VanDerWaalsContact C-N 3.32Å; V315-H317 PolarHBondContact O-N 2.83Å; H317-S320 PolarHBondContact O-N 2.95Å; H317-M321 WeakPolarHBondContact O-CB 3.31Å; H317-M321 WeakPolarHBondContact O-CG 3.49Å; H317-M321 PolarHBondContact O-N 2.89Å
318F48.4Very low47.2Very low153 Ų153118.1 Ų118.167%0.67159%0.585SS**Hα-helixtrans-71.1-39.7176.7-147.7-96000112.1E314 V315 S320 M321 C322E314-F318 PolarHBondContact O-N 3.48Å; E314-F318 VanDerWaalsContact O-N 3.1Å; V315-F318 PolarHBondContact O-N 3.5Å; F318-S320 VanDerWaalsContact C-N 3.32Å; F318-S320 PolarHBondContact O-N 3.3Å; F318-M321 PolarHBondContact O-N 3.49Å; F318-C322 PolarHBondContact O-N 2.84Å; F318-C322 PolarHBondContact O-SG 3.37Å
319Q48.4Very low47.1Very low133 Ų133115.2 Ų115.262%0.62158%0.576SS**Hα-helixtrans-65.4-35.1174.3-167.2169-0.900112.3V315 S323V315-Q319 PolarHBondContact O-N 2.95Å; Q319-S323 WeakPolarHBondContact O-CB 3.33Å; Q319-S323 PolarHBondContact O-N 2.86Å; Q319-S323 PolarHBondContact O-OG 3.04Å
320S47Very low47.1Very low64 Ų64112.4 Ų112.445%0.44857%0.565SS.*Hα-helixtrans-68.8-41.2173.1-171.70000112.3L316 H317 F318 S323 C324L316-S320 WeakPolarHBondContact O-CB 3.37Å; L316-S320 PolarHBondContact O-N 3.22Å; H317-S320 PolarHBondContact O-N 2.95Å; F318-S320 VanDerWaalsContact C-N 3.32Å; F318-S320 PolarHBondContact O-N 3.3Å; S320-S323 PolarHBondContact O-N 3.46Å; S320-C324 WeakPolarHBondContact O-CB 3.45Å; S320-C324 PolarHBondContact O-N 3.04Å; S320-C324 PolarHBondContact O-SG 3.37Å
321M45.7Very low47.2Very low108 Ų108112.3 Ų112.353%0.53256%0.561SS.*Hα-helixtrans-65.2-41.9177.7-76.7-74.4-6500113.3H317 F318 S323 C324 L325H317-M321 WeakPolarHBondContact O-CB 3.31Å; H317-M321 WeakPolarHBondContact O-CG 3.49Å; H317-M321 PolarHBondContact O-N 2.89Å; F318-M321 PolarHBondContact O-N 3.49Å; M321-S323 VanDerWaalsContact C-N 3.32Å; M321-C324 PolarHBondContact O-N 2.99Å; M321-L325 PolarHBondContact O-N 2.89Å
322C45.4Very low46.8Very low64 Ų64116.3 Ų116.343%0.43257%0.571SS.*Hα-helixtrans-66.1-35.2173.8-68.60000112.1F318 W326F318-C322 PolarHBondContact O-N 2.84Å; F318-C322 PolarHBondContact O-SG 3.37Å; C322-W326 WeakPolarHBondContact O-CB 3.44Å; C322-W326 PolarHBondContact O-N 2.96Å
323S49.1Very low46.5Very low70 Ų70113.2 Ų113.249%0.4957%0.566SS.*Hα-helixtrans-69.1-37175.2-59.10000112.3Q319 S320 M321 W326 Y327Q319-S323 WeakPolarHBondContact O-CB 3.33Å; Q319-S323 PolarHBondContact O-N 2.86Å; Q319-S323 PolarHBondContact O-OG 3.04Å; S320-S323 PolarHBondContact O-N 3.46Å; M321-S323 VanDerWaalsContact C-N 3.32Å; S323-W326 PolarHBondContact O-N 2.88Å; S323-Y327 VanDerWaalsContact O-CB 3.31Å; S323-Y327 WeakPolarHBondContact O-CB 3.48Å; S323-Y327 PolarHBondContact O-N 3.19Å
324C45.1Very low46.1Very low74 Ų74117.6 Ų117.650%0.558%0.578SS.*Hα-helixtrans-71.3-37.8176.4-72.80000113S320 M321 W326 Y327 K328S320-C324 WeakPolarHBondContact O-CB 3.45Å; S320-C324 PolarHBondContact O-N 3.04Å; S320-C324 PolarHBondContact O-SG 3.37Å; M321-C324 PolarHBondContact O-N 2.99Å; C324-W326 VanDerWaalsContact C-N 3.35Å; C324-Y327 PolarHBondContact O-N 3.29Å; C324-K328 WeakPolarHBondContact O-CB 3.49Å; C324-K328 PolarHBondContact O-N 3.29Å
325L54.5Low45.3Very low123 Ų123121 Ų12164%0.64459%0.586SS**Hα-helixtrans-66.9-36.9172.8-78.7163.2000111.8M321 S329M321-L325 PolarHBondContact O-N 2.89Å; L325-S329 PolarHBondContact O-N 3.37Å
326W49.7Very low44.6Very low129 Ų129121 Ų12149%0.48959%0.59SS.*Hα-helixtrans-66.1-42171.4-172-94.2000112.3E130 C322 S323 C324 S329 R330E130-W326 WeakPolarHBondContact OE2-CH2 3.47Å; E130-W326 WeakPolarHBondContact OE2-CZ3 3.42Å; C322-W326 WeakPolarHBondContact O-CB 3.44Å; C322-W326 PolarHBondContact O-N 2.96Å; S323-W326 PolarHBondContact O-N 2.88Å; C324-W326 VanDerWaalsContact C-N 3.35Å; W326-S329 PolarHBondContact O-N 3.44Å; W326-R330 PolarHBondContact O-N 3.48Å
327Y44.3Very low44.1Very low159 Ų159121.7 Ų121.762%0.62459%0.593SS**Hα-helixtrans-65.1-42.9179.1-162.6-91.9000112.4S323 C324 S329 R330 E331S323-Y327 VanDerWaalsContact O-CB 3.31Å; S323-Y327 WeakPolarHBondContact O-CB 3.48Å; S323-Y327 PolarHBondContact O-N 3.19Å; C324-Y327 PolarHBondContact O-N 3.29Å; Y327-S329 VanDerWaalsContact C-N 3.28Å; Y327-S329 PolarHBondContact O-N 3.31Å; Y327-R330 PolarHBondContact O-N 3.21Å; Y327-R330 VanDerWaalsContact O-N 3.14Å; Y327-E331 PolarHBondContact O-N 3.21Å
328K41.7Very low43.6Very low159 Ų159120.7 Ų120.769%0.69160%0.599SS**Hα-helixtrans-69.3-23.2178.8-160.6170.7-175171.60113.5C324C324-K328 WeakPolarHBondContact O-CB 3.49Å; C324-K328 PolarHBondContact O-N 3.29Å
329S40.4Very low42.7Very low71 Ų71121.2 Ų121.250%0.49761%0.605SS.*Hα-helixtrans-74.7-34.2171.9-170.60000112L325 W326 Y327 K332 L333L325-S329 PolarHBondContact O-N 3.37Å; W326-S329 PolarHBondContact O-N 3.44Å; Y327-S329 VanDerWaalsContact C-N 3.28Å; Y327-S329 PolarHBondContact O-N 3.31Å; S329-K332 PolarHBondContact O-N 3.12Å; S329-L333 PolarHBondContact O-N 3.5Å
330R44.8Very low42.1Very low135 Ų135122.5 Ų122.551%0.50961%0.614SS.*Hα-helixtrans-73.7-35.7-176.5-147.6176.6177.6-170.7-2.1113W326 Y327 K332 L333 Q334W326-R330 PolarHBondContact O-N 3.48Å; Y327-R330 PolarHBondContact O-N 3.21Å; Y327-R330 VanDerWaalsContact O-N 3.14Å; R330-K332 VanDerWaalsContact C-N 3.3Å; R330-K332 PolarHBondContact O-N 3.5Å; R330-L333 PolarHBondContact O-N 3.39Å; R330-L333 VanDerWaalsContact O-N 3.12Å; R330-Q334 PolarHBondContact O-N 3.14Å
331E47Very low41.3Very low114 Ų114125.1 Ų125.153%0.53362%0.622SS.*Hα-helixtrans-62.4-33.8173.4-84.5-177.3162.800113.1Y327 L333Y327-E331 PolarHBondContact O-N 3.21Å; E331-L333 VanDerWaalsContact C-N 3.33Å; E331-L333 PolarHBondContact O-N 3.45Å
332K42.4Very low40.6Very low173 Ų173125.3 Ų125.375%0.75263%0.631SS**Hα-helixtrans-72.4-24.9174.9-76.2-162.2175.4-171.50113.3S329 R330 S336S329-K332 PolarHBondContact O-N 3.12Å; R330-K332 VanDerWaalsContact C-N 3.3Å; R330-K332 PolarHBondContact O-N 3.5Å; K332-S336 PolarHBondContact O-OG 3.34Å
333L38.1Very low39.8Very low112 Ų112133.7 Ų133.759%0.58665%0.654SS**Hα-helixtrans-81.2-30.3178.4-138.585.8000112.5S329 R330 E331 Y335 S336S329-L333 PolarHBondContact O-N 3.5Å; R330-L333 PolarHBondContact O-N 3.39Å; R330-L333 VanDerWaalsContact O-N 3.12Å; E331-L333 VanDerWaalsContact C-N 3.33Å; E331-L333 PolarHBondContact O-N 3.45Å; L333-Y335 VanDerWaalsContact C-N 3.35Å; L333-Y335 PolarHBondContact O-N 3.28Å; L333-S336 PolarHBondContact O-N 3.34Å
334Q39.2Very low38.9Very low140 Ų140137.2 Ų137.265%0.65467%0.667SS**Hα-helixtrans-73.9-19.6-179.3-101.7157-64.700114.5R330 S336R330-Q334 PolarHBondContact O-N 3.14Å; Q334-S336 VanDerWaalsContact C-N 3.3Å
335Y37.6Very low38.4Very low226 Ų226141.5 Ų141.589%0.88668%0.684SS**THydrogen-bonded Turntrans-81.8-4.7170-96.8-86.7000114.2L333L333-Y335 VanDerWaalsContact C-N 3.35Å; L333-Y335 PolarHBondContact O-N 3.28Å
336S35.2Very low37.1Very low93 Ų93141 Ų14165%0.6569%0.691SS**THydrogen-bonded Turntrans-105.11.5-173.1-52.30000114.3K332 L333 Q334K332-S336 PolarHBondContact O-OG 3.34Å; L333-S336 PolarHBondContact O-N 3.34Å; Q334-S336 VanDerWaalsContact C-N 3.3Å
337I36.2Very low36.1Very low120 Ų120141.7 Ų141.762%0.61571%0.71SS**SBendtrans-126.9113.4-176.8-53.9175.6000108.6M339I337-M339 PolarHBondContact O-N 3.35Å
338P34.5Very low35.3Very low115 Ų115139.3 Ų139.375%0.74772%0.717SS**  trans-70.6122.9174.527.5-29.1000109.5I340P338-I340 PolarHBondContact O-N 3.36Å
339M31Very low34.7Very low164 Ų164138.5 Ų138.581%0.80872%0.72SS**  trans-77.2111.6177.5-161.7-163.3-52.500109.1I337 I341I337-M339 PolarHBondContact O-N 3.35Å; M339-I341 HydrophobicContact CG-CG1 4.32Å; M339-I341 HydrophobicContact SD-CD1 3.85Å; M339-I341 HydrophobicContact SD-CG1 4.04Å
340I34.7Very low34.1Very low159 Ų159140.5 Ų140.582%0.81573%0.729SS**  trans-91108.9170.1-69.7164.1000107.7P338P338-I340 PolarHBondContact O-N 3.36Å
341I31.4Very low33.3Very low120 Ų120143.7 Ų143.762%0.61574%0.742SS**  trans-101.2125.4165-60.6173.8000106.5M339 R343M339-I341 HydrophobicContact CG-CG1 4.32Å; M339-I341 HydrophobicContact SD-CD1 3.85Å; M339-I341 HydrophobicContact SD-CG1 4.04Å; I341-R343 PolarHBondContact O-N 3.23Å
342P30Very low32.3Very low111 Ų111144.8 Ų144.872%0.72175%0.749SS**  trans-75.1114163.7-1.418.9000108.2
343R29.9Very low31.7Very low241 Ų241144.6 Ų144.691%0.90975%0.751SS**  trans-89104.2165.5-102.5-170.6170.9163.1-2.3107.7I341I341-R343 PolarHBondContact O-N 3.23Å
344D30.2Very low31Very low143 Ų143149 Ų14977%0.76577%0.768SS**  trans-100127.9159-84.7-35.2000110
345L32.8Very low30.4Very low164 Ų164145.9 Ų145.986%0.85977%0.774SS**  trans51.499.5156.4-86.273000119.6
346S27.3Very low30Very low113 Ų113144.6 Ų144.679%0.7978%0.776SS**  trans-170.192.7140.9161.10000109.5
347T29.4Very low29.6Very low144 Ų144144.3 Ų144.388%0.88378%0.78SS**  trans-154.9112.9149.4370000109.4
348S28.6Very low29.1Very low109 Ų109147.8 Ų147.876%0.76279%0.791SS**  trans-60143.3158.5-45.70000110.9
349D27.5Very low28.8Very low142 Ų142146.5 Ų146.576%0.75978%0.784SS**  trans177.1103.8139.7-93.1-26.3000108.2
350T28.9Very low28.6Very low112 Ų112146.1 Ų146.169%0.68779%0.785SS**  83.3131.692.3530000114.9
351Y26.8Very low28.9Very low202 Ų202143.8 Ų143.879%0.79278%0.781SS**  trans87.4102.1163.4-74.2-83.4000122.6
352M27.6Very low28.7Very low138 Ų138145.6 Ų145.668%0.6879%0.791SS**  66.5126.8119.7-73.1-166.773.500124.1
353E28.7Very low28.7Very low169 Ų169148.4 Ų148.479%0.7979%0.794SS**  trans71.4105.8142.1-75.1-168.1132.700121.2
354Q24.6Very low28.6Very low203 Ų203140.9 Ų140.995%0.94978%0.778SS**  trans-71.7120.7148.2-85.8158.7-58.500110.2
355G25.9Very low28.5Very low75 Ų75141.7 Ų141.777%0.77378%0.783SS**  trans-137.3112.5161.600000109
356E27.9Very low28.3Very low200 Ų200138 Ų13894%0.93579%0.785SS**  trans-67.7139.6170.6-63.9-179.214200110.9
357A27.1Very low28.4Very low87 Ų87138.4 Ų138.472%0.71979%0.786SS**  trans168.3127.5135.500000114
358F27.3Very low28.4Very low193 Ų193138.7 Ų138.785%0.84679%0.787SS**  trans72.3112.4137.8-85.8-91.9000123.9
359S27.3Very low28.4Very low87 Ų87138.8 Ų138.861%0.60879%0.786SS**  65.7116125.363.90000123
360N26.9Very low28.4Very low156 Ų156137 Ų13783%0.83479%0.785SS**  128.3131.4121.1-84.8-11.9000115.9
361P39.9Very low28.4Very low110 Ų110139.1 Ų139.171%0.71479%0.791SS**  trans-100.8143.3174.137.1-28000111.4
362L28.7Very low28.4Very low158 Ų158136.5 Ų136.583%0.82779%0.786SS**  trans-168.8129.7153-132.386.1000113.2
363H28.5Very low28.6Very low170 Ų170137.4 Ų137.479%0.78779%0.788SS**  trans62.8152145.2-88.2-123.3000119.4
364S28.2Very low28.6Very low83 Ų83138.1 Ų138.158%0.5879%0.791SS**  cis-178.8145.5-7160.50000107.1
365N28.8Very low28.9Very low161 Ų161133.3 Ų133.386%0.86178%0.78SS**  trans22.9134.6150.1-60.3-18.9000121.6
366G28.6Very low29.2Very low87 Ų87133.7 Ų133.790%0.89778%0.783SS**  trans179.695.6154.100000114.2
367C29.2Very low29.4Very low121 Ų121131.4 Ų131.482%0.81878%0.776SS**  trans-117.5117.3168.3-176.80000107.7
368V29Very low29.5Very low149 Ų149133.2 Ų133.290%0.90378%0.784SS**  trans-152.7144.7160.6-177.50000110.4
369C28.9Very low29.6Very low111 Ų111128.8 Ų128.875%0.7578%0.777SS**  trans-84.5164-165.2-52.90000117.7
370S28.2Very low29.7Very low104 Ų104131.6 Ų131.673%0.72779%0.79SS**  trans81.2123.4136.3-1490000121.1
371L27.3Very low29.9Very low157 Ų157129.7 Ų129.782%0.82279%0.789SS**  -171.2130.4109.6-139.472.4000114.4
372H28.9Very low29.6Very low147 Ų147130.7 Ų130.768%0.68179%0.793SS**  trans6.9129.3151.2-88.6-55.3000124.4
373H30.1Very low29.7Very low158 Ų158126.4 Ų126.473%0.73179%0.786SS**  76.3116.8107.5-90.4-16.9000118.9
374H29.9Very low29.9Very low184 Ų184125.3 Ų125.385%0.85279%0.786SS**  -164.5152.7108.5-111.6-70.3000113
375S30.5Very low29.9Very low102 Ų102130.5 Ų130.571%0.71380%0.8SS**  trans-91.5157.3-169.632.80000114.2
376G31.4Very low29.9Very low82 Ų82127.1 Ų127.185%0.84579%0.789SS**  trans-152.5112.9166.400000110.8
377I32.6Very low30Very low153 Ų153130.8 Ų130.879%0.78579%0.787SS**  trans-92.4143.8-175.2-69.4164.2000110
378S28.6Very low30Very low125 Ų125131.4 Ų131.487%0.87478%0.782SS**  trans-152.4123.4136.657.50000111.5
379S30.9Very low30.1Very low100 Ų100129.3 Ų129.370%0.69977%0.77SS**  trans-126.9137.4172.855.90000107.6
380V29.3Very low30.1Very low146 Ų146134 Ų13489%0.88577%0.773SS**  trans-133.7111.9158.2-1790000108.4
381S29.6Very low30.1Very low116 Ų116139.7 Ų139.781%0.81178%0.779SS**  trans-122.7135.7166.1168.70000106.2
382T35.1Very low30.1Very low131 Ų131143 Ų14380%0.80478%0.78SS**  trans-112.6115.1170.340.50000109.3
383G31.2Very low30.2Very low67 Ų67143.7 Ų143.769%0.69179%0.788SS**  trans-79.9-170.615600000109.7
384L31.8Very low30.3Very low147 Ų147143.4 Ų143.477%0.7779%0.792SS**  cis-176.9149.80.3-150.3136.1000103.6
385H29Very low30.3Very low192 Ų192142.9 Ų142.989%0.88979%0.787SS**  trans-166.6121137.4-105.9-68.9000111.1
386S27.5Very low30.4Very low90 Ų90147.9 Ų147.963%0.62979%0.79SS**  trans-98149.9168.71690000108.7
387I31Very low30.8Very low164 Ų164155.5 Ų155.584%0.84179%0.794SS**  trans-153.9129.6143.3-93.1151.1000109.3
388N28.7Very low30.8Very low134 Ų134153 Ų15372%0.71779%0.79SS**  trans-56.2161.5168.1-107.8-21.6000112.1
389T31.5Very low31.2Very low106 Ų106151.7 Ų151.765%0.6578%0.781SS**  cis176.115446.3-2.70000110.3
390Y29.4Very low31.7Very low209 Ų209158.4 Ų158.482%0.8281%0.806SS**  trans69.1124.4144.8-91.1-76.2000124.6
391R27.4Very low31.8Very low223 Ų223159.1 Ų159.184%0.84280%0.802SS**  10495.3128.5-130.3175.1-155175.14.9120
392R28.4Very low31.9Very low227 Ų227161.3 Ų161.386%0.85780%0.802SS**  36.4116.2114.5-137.3-173.6-164.5-167.14.9117.4
393L30.1Very low31.8Very low162 Ų162163 Ų16385%0.84880%0.802SS**  172.5129.8115.9-98.4149.3000114.3
394N31.5Very low31.8Very low151 Ų151168.6 Ų168.681%0.80781%0.808SS**  trans-49.5139.8156.4-88-25.2000113.2
395K30.7Very low31.8Very low173 Ų173170 Ų17075%0.75281%0.811SS**  177.9132.3119-113.6178.9174.2170.70114.3
396R32.9Very low32Very low208 Ų208168.5 Ų168.579%0.78581%0.806SS**  trans61.9117.7135.9-81.3179.2178.6-172.3-1.7122.1
397R38.7Very low32.3Very low241 Ų241174.1 Ų174.191%0.90982%0.818SS**  53.3117.4108.9-136.6-172.3-160.4-164.54.7118.3
398S33.6Very low32.4Very low101 Ų101174.9 Ų174.971%0.70682%0.816SS**  159.6137109.4-1660000112.6
399S36.9Very low32.7Very low98 Ų98178.3 Ų178.369%0.68583%0.825SS**  trans36.9125.9146.1630000120.4
400I41.2Very low32.8Very low241 Ų241184.9 Ų184.9100%1.23684%0.841SS**  -147.7077.1-86.3165.8000107.7

Retrieved 400 of 400 residues in 62.2 ms (Link to these results)

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