A0A077ZFA8_TRITR Loading...

CDP-diacylglycerol--inositol 3-phosphatidyltransferase

AlphaFold DB , UniProt , Accession A0A077ZFA8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 223 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
1M44.8Very low70.3Confident236 Ų236123.5 Ų123.5100%1.16359%0.586SS**  048.80-160.9170.3176.900111.4
2M48.4Very low72.3Confident130 Ų130118.7 Ų118.764%0.6457%0.565SS**  trans-121.612.8-170.9-77.5-170.1-65.900114.8R6M2-R6 PolarHBondContact O-NE 3.41Å; M2-R6 VanDerWaalsContact O-NE 3.15Å
3K46Very low74Confident172 Ų172110.2 Ų110.275%0.74853%0.525SS*.Hα-helixtrans-86-32.4-177.9-92.7-174.7175.2-178.80113N7K3-N7 PolarHBondContact O-ND2 3.41Å
4T59.8Low75.6Confident112 Ų112102.4 Ų102.469%0.68749%0.489SS*.Hα-helixtrans-79-40-174.7-37.90000112.5N7T4-N7 PolarHBondContact O-N 3.44Å
5E59.3Low77Confident135 Ų135100.6 Ų100.663%0.63148%0.482SS*.Hα-helixtrans-64.5-44.9-178.4-65.4-177.4164.700112.8N7 V8 F9E5-N7 PolarHBondContact O-N 3.46Å; E5-V8 PolarHBondContact O-N 3.25Å; E5-V8 VanDerWaalsContact O-N 3.11Å; E5-F9 WeakPolarHBondContact O-CD2 3.45Å
6R60.7Low78.2Confident151 Ų15196.1 Ų96.157%0.5746%0.461SS*.Hα-helixtrans-57.7-32.3177.5-79.4-172-75.2-172.2-2.5112.1M2 F10M2-R6 PolarHBondContact O-NE 3.41Å; M2-R6 VanDerWaalsContact O-NE 3.15Å; R6-F10 VanDerWaalsContact O-CD2 3.26Å; R6-F10 WeakPolarHBondContact O-CD2 3.5Å
7N84.9Confident79.3Confident99 Ų9990.6 Ų90.653%0.52944%0.435SS..Hα-helixtrans-72.6-33.2-179.5-69.5-15000112.5K3 T4 E5 F9 F10 F11K3-N7 PolarHBondContact O-ND2 3.41Å; T4-N7 PolarHBondContact O-N 3.44Å; E5-N7 PolarHBondContact O-N 3.46Å; N7-F9 PolarHBondContact O-N 3.39Å; N7-F10 PolarHBondContact O-N 3.1Å; N7-F11 HydrophobicContact CB-CE1 4.15Å; N7-F11 WeakPolarHBondContact O-CD1 3.5Å; N7-F11 VanDerWaalsContact O-CE1 3.29Å; N7-F11 WeakPolarHBondContact O-CE1 3.34Å; N7-F11 PolarHBondContact O-N 3.36Å
8V90Very high80.3Confident33 Ų3389.9 Ų89.920%0.243%0.428CS..Hα-helixtrans-64.9-44.3-175.1179.20000111.3E5 F10 F11 N14 S63 F65E5-V8 PolarHBondContact O-N 3.25Å; E5-V8 VanDerWaalsContact O-N 3.11Å; V8-F10 PolarHBondContact O-N 3.36Å; V8-F10 VanDerWaalsContact O-N 3.15Å; V8-F11 HydrophobicContact CB-CE2 4.37Å; V8-F11 HydrophobicContact CG1-CD2 4.26Å; V8-F11 HydrophobicContact CG1-CE2 4.31Å; V8-F11 HydrophobicContact CG2-CE2 4.07Å; V8-F11 HydrophobicContact CG2-CZ 4.05Å; V8-F11 WeakPolarHBondContact O-CB 3.49Å; V8-F11 WeakPolarHBondContact O-CG 3.45Å; V8-F11 PolarHBondContact O-N 3.25Å; V8-F11 VanDerWaalsContact O-N 3.07Å; V8-N14 PolarHBondContact O-ND2 3.49Å; V8-S63 WeakPolarHBondContact CG1-OG 3.28Å; V8-F65 HydrophobicContact CG1-CB 4.22Å
9F92Very high81.3Confident97 Ų9790.8 Ų90.843%0.42543%0.434SS..Hα-helixtrans-61.6-25.4-179.6-65.1-68000113.8E5 N7 Y18 F65E5-F9 WeakPolarHBondContact O-CD2 3.45Å; N7-F9 PolarHBondContact O-N 3.39Å; F9-Y18 WeakPolarHBondContact O-CE2 3.36Å; F9-Y18 PolarHBondContact O-OH 2.98Å; F9-F65 HydrophobicContact CD1-CD1 4.3Å; F9-F65 AromaticContact CD1-CE1 3.88Å; F9-F65 HydrophobicContact CD1-CE1 3.88Å; F9-F65 HydrophobicContact CD1-CE2 4.12Å; F9-F65 AromaticContact CD1-CZ 3.77Å; F9-F65 HydrophobicContact CD1-CZ 3.77Å; F9-F65 AromaticContact CE1-CD2 3.98Å; F9-F65 HydrophobicContact CE1-CD2 3.98Å; F9-F65 HydrophobicContact CE1-CE1 4.26Å; F9-F65 AromaticContact CE1-CE2 3.67Å; F9-F65 HydrophobicContact CE1-CE2 3.67Å; F9-F65 HydrophobicContact CE1-CG 4.4Å; F9-F65 AromaticContact CE1-CZ 3.82Å; F9-F65 HydrophobicContact CE1-CZ 3.82Å
10F94Very high82.1Confident152 Ų15286.4 Ų86.467%0.66741%0.412SS*.THydrogen-bonded Turntrans-101.612.4178.8-64.9-75.2000113.4R6 N7 V8 L15R6-F10 VanDerWaalsContact O-CD2 3.26Å; R6-F10 WeakPolarHBondContact O-CD2 3.5Å; N7-F10 PolarHBondContact O-N 3.1Å; V8-F10 PolarHBondContact O-N 3.36Å; V8-F10 VanDerWaalsContact O-N 3.15Å; F10-L15 HydrophobicContact CD1-CD2 4.3Å
11F93.8Very high82.8Confident42 Ų4285.1 Ų85.118%0.18441%0.41CS..  trans-59.8139.5169-75-3.7000110.3N7 V8 P13 N14 L15 Q61N7-F11 HydrophobicContact CB-CE1 4.15Å; N7-F11 WeakPolarHBondContact O-CD1 3.5Å; N7-F11 VanDerWaalsContact O-CE1 3.29Å; N7-F11 WeakPolarHBondContact O-CE1 3.34Å; N7-F11 PolarHBondContact O-N 3.36Å; V8-F11 HydrophobicContact CB-CE2 4.37Å; V8-F11 HydrophobicContact CG1-CD2 4.26Å; V8-F11 HydrophobicContact CG1-CE2 4.31Å; V8-F11 HydrophobicContact CG2-CE2 4.07Å; V8-F11 HydrophobicContact CG2-CZ 4.05Å; V8-F11 WeakPolarHBondContact O-CB 3.49Å; V8-F11 WeakPolarHBondContact O-CG 3.45Å; V8-F11 PolarHBondContact O-N 3.25Å; V8-F11 VanDerWaalsContact O-N 3.07Å; F11-P13 VanDerWaalsContact C-CD 3.49Å; F11-P13 HydrophobicContact CB-CG 4.03Å; F11-N14 WeakPolarHBondContact O-CA 3.45Å; F11-N14 WeakPolarHBondContact O-CB 3.38Å; F11-N14 PolarHBondContact O-N 3.32Å; F11-L15 PolarHBondContact O-N 3.09Å; F11-Q61 HydrophobicContact CB-CB 4.11Å; F11-Q61 HydrophobicContact CB-CG 4.38Å; F11-Q61 HydrophobicContact CD1-CB 4.44Å; F11-Q61 HydrophobicContact CD1-CG 3.99Å; F11-Q61 HydrophobicContact CD2-CB 3.7Å; F11-Q61 HydrophobicContact CD2-CG 4.1Å; F11-Q61 VanDerWaalsContact CD2-O 3.25Å; F11-Q61 WeakPolarHBondContact CD2-O 3.39Å; F11-Q61 HydrophobicContact CE1-CG 4.26Å; F11-Q61 HydrophobicContact CE2-CB 4.17Å; F11-Q61 HydrophobicContact CE2-CG 4.34Å; F11-Q61 HydrophobicContact CG-CB 3.85Å; F11-Q61 HydrophobicContact CG-CG 3.91Å; F11-Q61 HydrophobicContact CZ-CG 4.43Å
12I94.2Very high85.4Confident65 Ų6577.4 Ų77.433%0.33338%0.376SS..Hα-helixtrans-49.7-47.8-179.9-61.4171.8000112.3N14 L15 I16 A55 F59I12-N14 VanDerWaalsContact C-N 3.29Å; I12-N14 PolarHBondContact O-N 3.2Å; I12-L15 PolarHBondContact O-N 3.39Å; I12-I16 HydrophobicContact CG2-CD1 4.14Å; I12-I16 WeakPolarHBondContact O-CG1 3.2Å; I12-I16 PolarHBondContact O-N 3.15Å; I12-I16 VanDerWaalsContact O-N 3.11Å; I12-A55 HydrophobicContact CG2-CB 4.24Å; I12-F59 HydrophobicContact CB-CD2 4.16Å; I12-F59 HydrophobicContact CB-CE2 4.37Å; I12-F59 HydrophobicContact CD1-CD1 4.01Å; I12-F59 HydrophobicContact CD1-CD2 3.7Å; I12-F59 HydrophobicContact CD1-CE1 3.93Å; I12-F59 HydrophobicContact CD1-CE2 3.63Å; I12-F59 HydrophobicContact CD1-CG 3.9Å; I12-F59 HydrophobicContact CD1-CZ 3.74Å; I12-F59 HydrophobicContact CG2-CD2 4.19Å; I12-F59 HydrophobicContact CG2-CE2 3.97Å
13P94.7Very high87.8Confident8 Ų872.4 Ų72.45%0.05235%0.352CS..Hα-helixtrans-58-37174.723.7-38.1000113.9F11 I16 G17 D52 A55 A56 Q61F11-P13 VanDerWaalsContact C-CD 3.49Å; F11-P13 HydrophobicContact CB-CG 4.03Å; P13-I16 PolarHBondContact O-N 3.22Å; P13-G17 PolarHBondContact O-N 2.98Å; P13-D52 HydrophobicContact CB-CB 4.26Å; P13-D52 WeakPolarHBondContact CB-O 3.43Å; P13-D52 WeakPolarHBondContact O-CB 3.43Å; P13-A55 HydrophobicContact CB-CB 4.49Å; P13-A56 HydrophobicContact CB-CB 3.82Å; P13-A56 HydrophobicContact CG-CB 3.94Å; P13-Q61 HydrophobicContact CG-CB 4.13Å
14N95.8Very high90.2Very high2 Ų264.8 Ų64.81%0.01132%0.319CS..Hα-helixtrans-72.9-34.8-179.2-65.8-18.6000111.7V8 F11 I12 I16 G17 Y18 F65 G66V8-N14 PolarHBondContact O-ND2 3.49Å; F11-N14 WeakPolarHBondContact O-CA 3.45Å; F11-N14 WeakPolarHBondContact O-CB 3.38Å; F11-N14 PolarHBondContact O-N 3.32Å; I12-N14 VanDerWaalsContact C-N 3.29Å; I12-N14 PolarHBondContact O-N 3.2Å; N14-I16 VanDerWaalsContact C-N 3.33Å; N14-G17 CarbonylContact O-C 3.49Å; N14-G17 WeakPolarHBondContact O-CA 3.46Å; N14-G17 PolarHBondContact O-N 3.13Å; N14-Y18 WeakPolarHBondContact O-CD2 3.35Å; N14-Y18 VanDerWaalsContact O-CG 3.25Å; N14-Y18 PolarHBondContact O-N 3.02Å; N14-F65 HydrophobicContact CB-CE1 4.46Å; N14-G66 WeakPolarHBondContact OD1-CA 3.48Å
15L96.6Very high92Very high75 Ų7563.9 Ų63.939%0.39331%0.314SS..Hα-helixtrans-63.2-40.2172.1-61.3-179.1000111.5F10 F11 I12 G17 Y18 M19F10-L15 HydrophobicContact CD1-CD2 4.3Å; F11-L15 PolarHBondContact O-N 3.09Å; I12-L15 PolarHBondContact O-N 3.39Å; L15-G17 VanDerWaalsContact C-N 3.34Å; L15-Y18 HydrophobicContact CD2-CD2 4.01Å; L15-Y18 HydrophobicContact CD2-CE2 4.11Å; L15-Y18 PolarHBondContact O-N 2.98Å; L15-M19 WeakPolarHBondContact O-CG 3.35Å; L15-M19 PolarHBondContact O-N 3.3Å; L15-M19 VanDerWaalsContact O-N 3.08Å
16I96.9Very high93.9Very high29 Ų2960.3 Ų60.315%0.14930%0.299CS..Hα-helixtrans-63.5-42.5172.5-62.1162000110.1I12 P13 N14 Y18 M19 R20 L48 V51 D52 A55I12-I16 HydrophobicContact CG2-CD1 4.14Å; I12-I16 WeakPolarHBondContact O-CG1 3.2Å; I12-I16 PolarHBondContact O-N 3.15Å; I12-I16 VanDerWaalsContact O-N 3.11Å; P13-I16 PolarHBondContact O-N 3.22Å; N14-I16 VanDerWaalsContact C-N 3.33Å; I16-Y18 VanDerWaalsContact C-N 3.34Å; I16-Y18 PolarHBondContact O-N 2.96Å; I16-M19 WeakPolarHBondContact O-CB 3.42Å; I16-M19 PolarHBondContact O-N 3.12Å; I16-M19 VanDerWaalsContact O-N 3.11Å; I16-R20 PolarHBondContact O-N 3.32Å; I16-L48 HydrophobicContact CG2-CB 4.06Å; I16-L48 HydrophobicContact CG2-CD2 4.22Å; I16-V51 HydrophobicContact CD1-CG1 4.1Å; I16-D52 HydrophobicContact CB-CB 3.86Å; I16-D52 HydrophobicContact CD1-CB 4.44Å; I16-D52 HydrophobicContact CG2-CB 3.73Å; I16-A55 HydrophobicContact CD1-CB 3.9Å
17G96.9Very high95.6Very high2 Ų253.1 Ų53.12%0.02127%0.272CS..Hα-helixtrans-56.2-43.417300000113.2P13 N14 L15 M19 R20 V21P13-G17 PolarHBondContact O-N 2.98Å; N14-G17 CarbonylContact O-C 3.49Å; N14-G17 WeakPolarHBondContact O-CA 3.46Å; N14-G17 PolarHBondContact O-N 3.13Å; L15-G17 VanDerWaalsContact C-N 3.34Å; G17-M19 VanDerWaalsContact C-N 3.34Å; G17-M19 PolarHBondContact O-N 3.31Å; G17-R20 WeakPolarHBondContact O-CB 3.43Å; G17-R20 PolarHBondContact O-N 3.04Å; G17-V21 WeakPolarHBondContact O-CG2 3.45Å; G17-V21 PolarHBondContact O-N 2.66Å
18Y97.5Very high96.2Very high78 Ų7850.6 Ų50.631%0.30626%0.261SS..Hα-helixtrans-64.6-37.9174.9-55.7-33.3000112.5F9 N14 L15 I16 R20 V21 V22 F65 L69F9-Y18 WeakPolarHBondContact O-CE2 3.36Å; F9-Y18 PolarHBondContact O-OH 2.98Å; N14-Y18 WeakPolarHBondContact O-CD2 3.35Å; N14-Y18 VanDerWaalsContact O-CG 3.25Å; N14-Y18 PolarHBondContact O-N 3.02Å; L15-Y18 HydrophobicContact CD2-CD2 4.01Å; L15-Y18 HydrophobicContact CD2-CE2 4.11Å; L15-Y18 PolarHBondContact O-N 2.98Å; I16-Y18 VanDerWaalsContact C-N 3.34Å; I16-Y18 PolarHBondContact O-N 2.96Å; Y18-R20 VanDerWaalsContact C-N 3.32Å; Y18-R20 PolarHBondContact O-N 2.84Å; Y18-V21 WeakPolarHBondContact O-CB 3.09Å; Y18-V21 PolarHBondContact O-N 2.94Å; Y18-V22 WeakPolarHBondContact O-CG2 3.5Å; Y18-V22 PolarHBondContact O-N 2.91Å; Y18-F65 HydrophobicContact CE1-CE1 4.26Å; Y18-F65 HydrophobicContact CE1-CZ 4.28Å; Y18-F65 WeakPolarHBondContact OH-CE1 3.31Å; Y18-L69 HydrophobicContact CD1-CD2 3.81Å; Y18-L69 HydrophobicContact CE1-CD1 4.48Å; Y18-L69 HydrophobicContact CE1-CD2 3.57Å
19M97.7Very high96.6Very high108 Ų10857 Ų5753%0.53228%0.283SS..Hα-helixtrans-63.2-38173.1-69.3-59.1-62.200111.9L15 I16 G17 V22 L23L15-M19 WeakPolarHBondContact O-CG 3.35Å; L15-M19 PolarHBondContact O-N 3.3Å; L15-M19 VanDerWaalsContact O-N 3.08Å; I16-M19 WeakPolarHBondContact O-CB 3.42Å; I16-M19 PolarHBondContact O-N 3.12Å; I16-M19 VanDerWaalsContact O-N 3.11Å; G17-M19 VanDerWaalsContact C-N 3.34Å; G17-M19 PolarHBondContact O-N 3.31Å; M19-V22 PolarHBondContact O-N 3.32Å; M19-L23 VanDerWaalsContact O-CG 3.3Å; M19-L23 WeakPolarHBondContact O-CG 3.2Å; M19-L23 PolarHBondContact O-N 3.1Å
20R98Very high96.8Very high1 Ų155.8 Ų55.80%0.00428%0.276CS..Hα-helixtrans-59.4-45.5171.8-69.3171.963.6-1621.6111.4I16 G17 Y18 V22 L23 T24 S45 L48 D49 D52 D70 T73 D74I16-R20 PolarHBondContact O-N 3.32Å; G17-R20 WeakPolarHBondContact O-CB 3.43Å; G17-R20 PolarHBondContact O-N 3.04Å; Y18-R20 VanDerWaalsContact C-N 3.32Å; Y18-R20 PolarHBondContact O-N 2.84Å; R20-V22 VanDerWaalsContact C-N 3.34Å; R20-V22 PolarHBondContact O-N 2.94Å; R20-L23 PolarHBondContact O-N 2.65Å; R20-T24 WeakPolarHBondContact O-CB 3.33Å; R20-T24 PolarHBondContact O-N 3.09Å; R20-T24 PolarHBondContact O-OG1 2.94Å; R20-T24 VanDerWaalsContact O-OG1 3.05Å; R20-S45 PolarHBondContact NE-O 3.21Å; R20-S45 PolarHBondContact O-OG 2.94Å; R20-S45 VanDerWaalsContact O-OG 3.09Å; R20-L48 HydrophobicContact CG-CB 3.58Å; R20-L48 HydrophobicContact CG-CD1 4.31Å; R20-D49 IonicContact CZ-OD1 3.64Å; R20-D49 IonicContact NH1-OD1 3.51Å; R20-D49 PolarHBondContact NH1-OD1 3.46Å; R20-D49 VanDerWaalsContact NH1-OD1 3.1Å; R20-D49 IonicContact NH2-OD1 2.7Å; R20-D49 PolarHBondContact NH2-OD1 3.35Å; R20-D52 VanDerWaalsContact CD-OD2 3.26Å; R20-D52 WeakPolarHBondContact CD-OD2 3.32Å; R20-D52 IonicContact CZ-OD2 2.9Å; R20-D52 IonicContact NE-OD2 3.88Å; R20-D52 IonicContact NH1-OD1 3.85Å; R20-D52 IonicContact NH1-OD2 2.68Å; R20-D52 PolarHBondContact NH1-OD2 2.89Å; R20-D70 IonicContact CZ-OD1 3.46Å; R20-D70 IonicContact NH1-OD1 2.68Å; R20-D70 PolarHBondContact NH1-OD1 2.86Å; R20-D70 IonicContact NH2-OD1 2.76Å; R20-T73 HydrophobicContact CB-CG2 3.76Å; R20-D74 IonicContact CZ-OD1 2.78Å; R20-D74 IonicContact NH2-OD1 3.21Å; R20-D74 PolarHBondContact NH2-OD1 3.27Å
21V97.8Very high96.9Very high60 Ų6049.2 Ų49.236%0.36425%0.247SC..Hα-helixtrans-57.9-45.7175.6175.80000111.4G17 Y18 T24 V25 L69 T73G17-V21 WeakPolarHBondContact O-CG2 3.45Å; G17-V21 PolarHBondContact O-N 2.66Å; Y18-V21 WeakPolarHBondContact O-CB 3.09Å; Y18-V21 PolarHBondContact O-N 2.94Å; V21-T24 PolarHBondContact O-N 3.35Å; V21-V25 WeakPolarHBondContact O-CG2 3.44Å; V21-V25 PolarHBondContact O-N 3.37Å; V21-L69 HydrophobicContact CG2-CD1 4.46Å; V21-T73 HydrophobicContact CG2-CG2 3.88Å; V21-T73 WeakPolarHBondContact CG2-OG1 3.3Å
22V98.2Very high96.8Very high74 Ų7451.2 Ų51.245%0.44827%0.272SS..Hα-helixtrans-61.3-45.9176.8173.30000111.3Y18 M19 R20 T24 V25 L26Y18-V22 WeakPolarHBondContact O-CG2 3.5Å; Y18-V22 PolarHBondContact O-N 2.91Å; M19-V22 PolarHBondContact O-N 3.32Å; R20-V22 VanDerWaalsContact C-N 3.34Å; R20-V22 PolarHBondContact O-N 2.94Å; V22-T24 VanDerWaalsContact C-N 3.32Å; V22-T24 PolarHBondContact O-N 3.05Å; V22-V25 PolarHBondContact O-N 3.3Å; V22-L26 HydrophobicContact CG1-CD1 4.15Å; V22-L26 HydrophobicContact CG1-CG 4.49Å; V22-L26 WeakPolarHBondContact O-CG 3.42Å; V22-L26 PolarHBondContact O-N 3.49Å
23L98.1Very high96.8Very high26 Ų2652.6 Ų52.614%0.13628%0.283CS..Hα-helixtrans-62.3-39.3177.2-70.9167.9000112.1M19 R20 L26 S27 F41 C44 L48M19-L23 VanDerWaalsContact O-CG 3.3Å; M19-L23 WeakPolarHBondContact O-CG 3.2Å; M19-L23 PolarHBondContact O-N 3.1Å; R20-L23 PolarHBondContact O-N 2.65Å; L23-L26 PolarHBondContact O-N 3.48Å; L23-S27 WeakPolarHBondContact O-CB 3.09Å; L23-S27 PolarHBondContact O-N 3.14Å; L23-F41 HydrophobicContact CD2-CD1 3.7Å; L23-F41 HydrophobicContact CD2-CE1 4.37Å; L23-C44 HydrophobicContact CD1-CB 4.1Å; L23-C44 HydrophobicContact CD2-CB 4.46Å; L23-L48 HydrophobicContact CD1-CD1 3.48Å; L23-L48 VanDerWaalsContact CD1-CD1 3.48Å
24T97.6Very high96.9Very high11 Ų1157.7 Ų57.77%0.06731%0.306CS..Hα-helixtrans-63-45.9174.7-640000110.9R20 V21 V22 L26 S27 C28 S45 T77R20-T24 WeakPolarHBondContact O-CB 3.33Å; R20-T24 PolarHBondContact O-N 3.09Å; R20-T24 PolarHBondContact O-OG1 2.94Å; R20-T24 VanDerWaalsContact O-OG1 3.05Å; V21-T24 PolarHBondContact O-N 3.35Å; V22-T24 VanDerWaalsContact C-N 3.32Å; V22-T24 PolarHBondContact O-N 3.05Å; T24-L26 VanDerWaalsContact C-N 3.34Å; T24-L26 PolarHBondContact O-N 2.69Å; T24-S27 WeakPolarHBondContact O-CB 3.41Å; T24-S27 PolarHBondContact O-N 2.83Å; T24-C28 PolarHBondContact O-N 2.96Å; T24-C28 PolarHBondContact O-SG 3.09Å; T24-S45 PolarHBondContact OG1-OG 3.21Å; T24-T77 HydrophobicContact CG2-CG2 4.07Å; T24-T77 VanDerWaalsContact CG2-OG1 3.23Å; T24-T77 WeakPolarHBondContact CG2-OG1 3.16Å; T24-T77 PolarHBondContact OG1-OG1 3.26Å
25V97.9Very high96.9Very high93 Ų9359.8 Ų59.856%0.56431%0.314SS*.Hα-helixtrans-60.1-43.4175.3171.80000111.5V21 V22 C28 Y29V21-V25 WeakPolarHBondContact O-CG2 3.44Å; V21-V25 PolarHBondContact O-N 3.37Å; V22-V25 PolarHBondContact O-N 3.3Å; V25-C28 PolarHBondContact O-N 3.3Å; V25-Y29 WeakPolarHBondContact O-CB 3.36Å; V25-Y29 PolarHBondContact O-N 3.49Å
26L98.1Very high96.9Very high60 Ų6064.6 Ų64.631%0.31433%0.327SS..Hα-helixtrans-62-42.8175-70.4172.4000111.6V22 L23 T24 C28 Y29 Y30 F41V22-L26 HydrophobicContact CG1-CD1 4.15Å; V22-L26 HydrophobicContact CG1-CG 4.49Å; V22-L26 WeakPolarHBondContact O-CG 3.42Å; V22-L26 PolarHBondContact O-N 3.49Å; L23-L26 PolarHBondContact O-N 3.48Å; T24-L26 VanDerWaalsContact C-N 3.34Å; T24-L26 PolarHBondContact O-N 2.69Å; L26-C28 PolarHBondContact O-N 3.45Å; L26-Y29 PolarHBondContact O-N 3Å; L26-Y30 HydrophobicContact CD2-CE2 4.39Å; L26-Y30 WeakPolarHBondContact O-CD2 3.43Å; L26-Y30 PolarHBondContact O-N 2.94Å; L26-F41 HydrophobicContact CB-CB 4.49Å; L26-F41 HydrophobicContact CB-CD1 4.46Å; L26-F41 HydrophobicContact CB-CD2 3.84Å; L26-F41 HydrophobicContact CB-CE2 4.14Å; L26-F41 HydrophobicContact CB-CG 4.03Å; L26-F41 HydrophobicContact CD1-CD1 4.43Å; L26-F41 HydrophobicContact CD1-CE1 4.19Å; L26-F41 HydrophobicContact CD1-CZ 4.33Å
27S97.8Very high96.9Very high1 Ų164.5 Ų64.51%0.00733%0.331CS..Hα-helixtrans-56.6-52.1174.6-173.40000110.4L23 T24 Y29 Y30 M31 A38L23-S27 WeakPolarHBondContact O-CB 3.09Å; L23-S27 PolarHBondContact O-N 3.14Å; T24-S27 WeakPolarHBondContact O-CB 3.41Å; T24-S27 PolarHBondContact O-N 2.83Å; S27-Y29 VanDerWaalsContact C-N 3.33Å; S27-Y29 PolarHBondContact O-N 3.37Å; S27-Y30 PolarHBondContact O-N 3.48Å; S27-M31 VanDerWaalsContact O-CG 3.28Å; S27-M31 WeakPolarHBondContact O-CG 3.49Å; S27-M31 PolarHBondContact O-N 3.18Å; S27-A38 PolarHBondContact OG-O 2.89Å
28C97.1Very high96.9Very high45 Ų4564.4 Ų64.430%0.30433%0.33SS..Hα-helixtrans-57-42.9177.8-62.50000112.9T24 V25 L26 Y30 M31 C80T24-C28 PolarHBondContact O-N 2.96Å; T24-C28 PolarHBondContact O-SG 3.09Å; V25-C28 PolarHBondContact O-N 3.3Å; L26-C28 PolarHBondContact O-N 3.45Å; C28-Y30 PolarHBondContact O-N 3.48Å; C28-M31 PolarHBondContact O-N 3.12Å; C28-C80 WeakPolarHBondContact SG-CB 3.39Å; C28-C80 PolarHBondContact SG-SG 3.05Å
29Y97.1Very high96.9Very high168 Ų16861.1 Ų61.166%0.65932%0.319SS*.Hα-helixtrans-61.9-42.2178.6178.6-98000112.1V25 L26 S27V25-Y29 WeakPolarHBondContact O-CB 3.36Å; V25-Y29 PolarHBondContact O-N 3.49Å; L26-Y29 PolarHBondContact O-N 3Å; S27-Y29 VanDerWaalsContact C-N 3.33Å; S27-Y29 PolarHBondContact O-N 3.37Å
30Y97.4Very high96.9Very high71 Ų7160.9 Ų60.928%0.27832%0.319SS..Hα-helixtrans-85.1-11-179.1-71.1-65.6000114.1L26 S27 C28 A32 T33 H34 A37 F41L26-Y30 HydrophobicContact CD2-CE2 4.39Å; L26-Y30 WeakPolarHBondContact O-CD2 3.43Å; L26-Y30 PolarHBondContact O-N 2.94Å; S27-Y30 PolarHBondContact O-N 3.48Å; C28-Y30 PolarHBondContact O-N 3.48Å; Y30-A32 PolarHBondContact O-N 2.91Å; Y30-T33 PolarHBondContact O-N 3.24Å; Y30-H34 HydrophobicContact CD1-CB 3.97Å; Y30-H34 AromaticContact CD1-ND1 3.95Å; Y30-H34 CarbonylContact O-C 3.6Å; Y30-H34 PolarHBondContact O-N 2.91Å; Y30-A37 HydrophobicContact CD1-CB 4.48Å; Y30-A37 HydrophobicContact CD2-CB 4.29Å; Y30-A37 HydrophobicContact CG-CB 4.08Å; Y30-F41 AromaticContact CD2-CD2 3.85Å; Y30-F41 HydrophobicContact CD2-CD2 3.85Å; Y30-F41 AromaticContact CD2-CE2 3.52Å; Y30-F41 HydrophobicContact CD2-CE2 3.52Å; Y30-F41 HydrophobicContact CE2-CD2 4.35Å; Y30-F41 AromaticContact CE2-CE2 3.6Å; Y30-F41 HydrophobicContact CE2-CE2 3.6Å; Y30-F41 HydrophobicContact CE2-CZ 4.45Å
31M95.8Very high96.9Very high14 Ų1463.3 Ų63.37%0.06933%0.33CS..THydrogen-bonded Turntrans-53.7-34.4-171.1-92.7176.9-167.500114.1S27 C28 A38 Y42 C80 L81 A84 Y165S27-M31 VanDerWaalsContact O-CG 3.28Å; S27-M31 WeakPolarHBondContact O-CG 3.49Å; S27-M31 PolarHBondContact O-N 3.18Å; C28-M31 PolarHBondContact O-N 3.12Å; M31-A38 HydrophobicContact CB-CB 4.47Å; M31-A38 HydrophobicContact CG-CB 4.08Å; M31-Y42 HydrophobicContact CE-CD2 4.46Å; M31-C80 HydrophobicContact CE-CB 4.38Å; M31-L81 HydrophobicContact CE-CB 4.21Å; M31-L81 HydrophobicContact CE-CD1 4.26Å; M31-A84 HydrophobicContact SD-CB 3.82Å; M31-Y165 VanDerWaalsContact CA-OH 3.27Å; M31-Y165 WeakPolarHBondContact CA-OH 3.3Å; M31-Y165 HydrophobicContact CB-CE2 4.27Å; M31-Y165 HydrophobicContact CG-CE2 4.02Å; M31-Y165 PolarHBondContact O-OH 3.05Å
32A92.1Very high96.9Very high84 Ų8460.7 Ų60.769%0.69431%0.314SS*.THydrogen-bonded Turntrans-94.5-18.5-178.800000114.4Y30Y30-A32 PolarHBondContact O-N 2.91Å
33T94Very high96.8Very high94 Ų9459.6 Ų59.658%0.57731%0.307SS*.THydrogen-bonded Turntrans-112.7-39.7-170.5600000113.4Y30Y30-T33 PolarHBondContact O-N 3.24Å
34H96Very high96.8Very high115 Ų11560.7 Ų60.753%0.53232%0.316SS..  trans-138.782.3-173.7-65.685.2000110.2Y30 R36 A37 A38Y30-H34 HydrophobicContact CD1-CB 3.97Å; Y30-H34 AromaticContact CD1-ND1 3.95Å; Y30-H34 CarbonylContact O-C 3.6Å; Y30-H34 PolarHBondContact O-N 2.91Å; H34-R36 PolarHBondContact O-N 3.08Å; H34-R36 VanDerWaalsContact O-N 3.14Å; H34-A37 HydrophobicContact CB-CB 4.09Å; H34-A37 PolarHBondContact O-N 3.38Å; H34-A38 PolarHBondContact O-N 3.27Å
35Y95.9Very high96.8Very high46 Ų4660.2 Ų60.218%0.1831%0.313CS..Hα-helixtrans-57.7-34.4-172.178.3-90.2000114A38 A39 Y165 F169 D170Y35-A38 PolarHBondContact O-N 2.93Å; Y35-A39 WeakPolarHBondContact O-CB 3.48Å; Y35-A39 PolarHBondContact O-N 2.98Å; Y35-Y165 VanDerWaalsContact CA-OH 3.31Å; Y35-Y165 WeakPolarHBondContact CA-OH 3.26Å; Y35-F169 HydrophobicContact CD1-CB 3.53Å; Y35-F169 HydrophobicContact CD1-CD1 4.08Å; Y35-F169 HydrophobicContact CD1-CD2 4.43Å; Y35-F169 AromaticContact CD1-CG 3.78Å; Y35-F169 HydrophobicContact CD1-CG 3.78Å; Y35-F169 HydrophobicContact CD2-CB 3.85Å; Y35-F169 HydrophobicContact CD2-CD2 4.35Å; Y35-F169 HydrophobicContact CD2-CG 4.3Å; Y35-F169 HydrophobicContact CE1-CB 3.87Å; Y35-F169 HydrophobicContact CE2-CB 4.18Å; Y35-F169 HydrophobicContact CG-CB 3.52Å; Y35-F169 HydrophobicContact CG-CD1 4.27Å; Y35-F169 AromaticContact CG-CD2 3.82Å; Y35-F169 HydrophobicContact CG-CD2 3.82Å; Y35-F169 AromaticContact CG-CG 3.62Å; Y35-F169 HydrophobicContact CG-CG 3.62Å; Y35-D170 HydrophobicContact CE2-CB 4.05Å; Y35-D170 WeakPolarHBondContact OH-CB 3.34Å; Y35-D170 PolarHBondContact OH-OD2 2.69Å
36R96.6Very high96.6Very high176 Ų17657.5 Ų57.566%0.66430%0.298SS*.Hα-helixtrans-64.8-44177.9-63.9-177.3178.8177.8-2.8112H34 L40H34-R36 PolarHBondContact O-N 3.08Å; H34-R36 VanDerWaalsContact O-N 3.14Å; R36-L40 WeakPolarHBondContact O-CB 3.06Å; R36-L40 PolarHBondContact O-N 3.09Å
37A97.4Very high96.4Very high28 Ų2860.2 Ų60.223%0.23131%0.312CS..Hα-helixtrans-66.7-45.1177.300000110.4Y30 H34 A39 L40 F41Y30-A37 HydrophobicContact CD1-CB 4.48Å; Y30-A37 HydrophobicContact CD2-CB 4.29Å; Y30-A37 HydrophobicContact CG-CB 4.08Å; H34-A37 HydrophobicContact CB-CB 4.09Å; H34-A37 PolarHBondContact O-N 3.38Å; A37-A39 PolarHBondContact O-N 3.39Å; A37-L40 PolarHBondContact O-N 3.36Å; A37-F41 HydrophobicContact CB-CD2 4.43Å; A37-F41 HydrophobicContact CB-CE2 4.12Å; A37-F41 WeakPolarHBondContact O-CD2 3.39Å; A37-F41 WeakPolarHBondContact O-CG 3.19Å; A37-F41 PolarHBondContact O-N 3.38Å
38A97.6Very high96.3Very high0 Ų062.6 Ų62.60%033%0.325CS..Hα-helixtrans-58.5-47.6176.900000112.5S27 M31 H34 Y35 L40 F41 Y42 Y165S27-A38 PolarHBondContact OG-O 2.89Å; M31-A38 HydrophobicContact CB-CB 4.47Å; M31-A38 HydrophobicContact CG-CB 4.08Å; H34-A38 PolarHBondContact O-N 3.27Å; Y35-A38 PolarHBondContact O-N 2.93Å; A38-L40 PolarHBondContact O-N 3.49Å; A38-F41 PolarHBondContact O-N 3.06Å; A38-Y42 WeakPolarHBondContact O-CB 3.38Å; A38-Y42 PolarHBondContact O-N 3.4Å; A38-Y165 HydrophobicContact CB-CE1 4.24Å; A38-Y165 WeakPolarHBondContact CB-OH 3.42Å
39A97.2Very high96.1Very high8 Ų862.8 Ų62.87%0.06632%0.323CS..Hα-helixtrans-63.3-38.817800000112.5Y35 A37 V43 W162 Y165 V166Y35-A39 WeakPolarHBondContact O-CB 3.48Å; Y35-A39 PolarHBondContact O-N 2.98Å; A37-A39 PolarHBondContact O-N 3.39Å; A39-V43 WeakPolarHBondContact O-CG2 3.25Å; A39-V43 PolarHBondContact O-N 2.85Å; A39-V43 VanDerWaalsContact O-N 3.1Å; A39-W162 HydrophobicContact CB-CZ2 4.16Å; A39-W162 PolarHBondContact O-NE1 3.23Å; A39-Y165 HydrophobicContact CB-CE1 4.32Å; A39-V166 HydrophobicContact CB-CG2 3.9Å
40L97.6Very high95.8Very high104 Ų10457.9 Ų57.955%0.54532%0.317SS..Hα-helixtrans-65.9-50.6176178.963.5000111.4R36 A37 A38 Y42 V43 C44R36-L40 WeakPolarHBondContact O-CB 3.06Å; R36-L40 PolarHBondContact O-N 3.09Å; A37-L40 PolarHBondContact O-N 3.36Å; A38-L40 PolarHBondContact O-N 3.49Å; L40-Y42 VanDerWaalsContact C-N 3.28Å; L40-Y42 PolarHBondContact O-N 2.71Å; L40-V43 PolarHBondContact O-N 3.07Å; L40-C44 WeakPolarHBondContact O-CB 3.31Å; L40-C44 PolarHBondContact O-N 3.38Å; L40-C44 PolarHBondContact O-SG 3.18Å
41F98.1Very high95.7Very high52 Ų5257.8 Ų57.823%0.22832%0.324CS..Hα-helixtrans-61.9-37.3178.7-67.9-50.1000112.2L23 L26 Y30 A37 A38 C44 S45L23-F41 HydrophobicContact CD2-CD1 3.7Å; L23-F41 HydrophobicContact CD2-CE1 4.37Å; L26-F41 HydrophobicContact CB-CB 4.49Å; L26-F41 HydrophobicContact CB-CD1 4.46Å; L26-F41 HydrophobicContact CB-CD2 3.84Å; L26-F41 HydrophobicContact CB-CE2 4.14Å; L26-F41 HydrophobicContact CB-CG 4.03Å; L26-F41 HydrophobicContact CD1-CD1 4.43Å; L26-F41 HydrophobicContact CD1-CE1 4.19Å; L26-F41 HydrophobicContact CD1-CZ 4.33Å; Y30-F41 AromaticContact CD2-CD2 3.85Å; Y30-F41 HydrophobicContact CD2-CD2 3.85Å; Y30-F41 AromaticContact CD2-CE2 3.52Å; Y30-F41 HydrophobicContact CD2-CE2 3.52Å; Y30-F41 HydrophobicContact CE2-CD2 4.35Å; Y30-F41 AromaticContact CE2-CE2 3.6Å; Y30-F41 HydrophobicContact CE2-CE2 3.6Å; Y30-F41 HydrophobicContact CE2-CZ 4.45Å; A37-F41 HydrophobicContact CB-CD2 4.43Å; A37-F41 HydrophobicContact CB-CE2 4.12Å; A37-F41 WeakPolarHBondContact O-CD2 3.39Å; A37-F41 WeakPolarHBondContact O-CG 3.19Å; A37-F41 PolarHBondContact O-N 3.38Å; A38-F41 PolarHBondContact O-N 3.06Å; F41-C44 PolarHBondContact O-N 3.09Å; F41-S45 WeakPolarHBondContact O-CB 3.32Å; F41-S45 PolarHBondContact O-N 3.02Å
42Y97.9Very high95.5Very high5 Ų557.6 Ų57.62%0.0232%0.323CS..Hα-helixtrans-57.2-55.6173-169.3-84.3000111.1M31 A38 L40 C44 S45 S46 T77 L81 E158 W162M31-Y42 HydrophobicContact CE-CD2 4.46Å; A38-Y42 WeakPolarHBondContact O-CB 3.38Å; A38-Y42 PolarHBondContact O-N 3.4Å; L40-Y42 VanDerWaalsContact C-N 3.28Å; L40-Y42 PolarHBondContact O-N 2.71Å; Y42-C44 VanDerWaalsContact C-N 3.33Å; Y42-C44 PolarHBondContact O-N 3.17Å; Y42-S45 WeakPolarHBondContact O-CB 3.41Å; Y42-S45 PolarHBondContact O-N 3.47Å; Y42-S45 VanDerWaalsContact O-N 3.15Å; Y42-S46 PolarHBondContact O-N 3.34Å; Y42-S46 PolarHBondContact O-OG 3.39Å; Y42-T77 HydrophobicContact CD2-CG2 3.79Å; Y42-T77 HydrophobicContact CE2-CG2 3.47Å; Y42-T77 VanDerWaalsContact CE2-CG2 3.47Å; Y42-L81 HydrophobicContact CD2-CD2 4.35Å; Y42-L81 HydrophobicContact CE1-CD2 4.19Å; Y42-L81 HydrophobicContact CE2-CB 3.74Å; Y42-L81 HydrophobicContact CE2-CD2 3.6Å; Y42-L81 HydrophobicContact CE2-CG 4.19Å; Y42-L81 WeakPolarHBondContact OH-CD2 3.02Å; Y42-E158 PolarHBondContact OH-OE2 3.41Å; Y42-W162 AromaticContact CD1-CD1 3.66Å; Y42-W162 HydrophobicContact CD1-CG 4.49Å
43V96.6Very high95.4Very high51 Ų5154.4 Ų54.431%0.30930%0.299SS..Hα-helixtrans-61.8-41.7-179170.40000111.2A39 L40 S45 S46 L47 W162A39-V43 WeakPolarHBondContact O-CG2 3.25Å; A39-V43 PolarHBondContact O-N 2.85Å; A39-V43 VanDerWaalsContact O-N 3.1Å; L40-V43 PolarHBondContact O-N 3.07Å; V43-S45 VanDerWaalsContact C-N 3.35Å; V43-S45 PolarHBondContact O-N 2.89Å; V43-S46 PolarHBondContact O-N 2.83Å; V43-L47 HydrophobicContact CG1-CD1 3.77Å; V43-L47 HydrophobicContact CG1-CG 4.14Å; V43-L47 WeakPolarHBondContact O-CB 3.41Å; V43-L47 VanDerWaalsContact O-CG 3.26Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 3.09Å; V43-W162 HydrophobicContact CG2-CD2 4.45Å; V43-W162 HydrophobicContact CG2-CZ2 4.09Å
44C97.3Very high95.3Very high48 Ų4856.8 Ų56.832%0.32430%0.298SS..Hα-helixtrans-60-43.7175.4-70.40000112.1L23 L40 F41 Y42 L47 L48L23-C44 HydrophobicContact CD1-CB 4.1Å; L23-C44 HydrophobicContact CD2-CB 4.46Å; L40-C44 WeakPolarHBondContact O-CB 3.31Å; L40-C44 PolarHBondContact O-N 3.38Å; L40-C44 PolarHBondContact O-SG 3.18Å; F41-C44 PolarHBondContact O-N 3.09Å; Y42-C44 VanDerWaalsContact C-N 3.33Å; Y42-C44 PolarHBondContact O-N 3.17Å; C44-L47 PolarHBondContact O-N 3.4Å; C44-L48 WeakPolarHBondContact O-CG 3.15Å; C44-L48 PolarHBondContact O-N 3.33Å; C44-L48 VanDerWaalsContact O-N 3.11Å
45S96.9Very high95.2Very high2 Ų251.6 Ų51.61%0.01428%0.275CS..Hα-helixtrans-61.7-46.6176-169.50000111.5R20 T24 F41 Y42 V43 L47 L48R20-S45 PolarHBondContact NE-O 3.21Å; R20-S45 PolarHBondContact O-OG 2.94Å; R20-S45 VanDerWaalsContact O-OG 3.09Å; T24-S45 PolarHBondContact OG1-OG 3.21Å; F41-S45 WeakPolarHBondContact O-CB 3.32Å; F41-S45 PolarHBondContact O-N 3.02Å; Y42-S45 WeakPolarHBondContact O-CB 3.41Å; Y42-S45 PolarHBondContact O-N 3.47Å; Y42-S45 VanDerWaalsContact O-N 3.15Å; V43-S45 VanDerWaalsContact C-N 3.35Å; V43-S45 PolarHBondContact O-N 2.89Å; S45-L47 PolarHBondContact O-N 3.08Å; S45-L48 PolarHBondContact O-N 2.96Å
46S94.4Very high95Very high35 Ų3550 Ų5025%0.24527%0.272CS..Hα-helixtrans-66.5-32.3178.3-56.40000113.5Y42 V43 D49Y42-S46 PolarHBondContact O-N 3.34Å; Y42-S46 PolarHBondContact O-OG 3.39Å; V43-S46 PolarHBondContact O-N 2.83Å; S46-D49 VanDerWaalsContact O-CB 3.23Å; S46-D49 WeakPolarHBondContact O-CB 3.48Å
47L94.4Very high94.7Very high117 Ų11749.6 Ų49.661%0.61327%0.27SS*.Hα-helixtrans-74.8-33.2176.9-72.3175.6000112.3V43 C44 S45 D49 A50V43-L47 HydrophobicContact CG1-CD1 3.77Å; V43-L47 HydrophobicContact CG1-CG 4.14Å; V43-L47 WeakPolarHBondContact O-CB 3.41Å; V43-L47 VanDerWaalsContact O-CG 3.26Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 3.09Å; C44-L47 PolarHBondContact O-N 3.4Å; S45-L47 PolarHBondContact O-N 3.08Å; L47-D49 PolarHBondContact O-N 3.46Å; L47-A50 PolarHBondContact O-N 3.01Å
48L95.8Very high94.5Very high51 Ų5155.8 Ų55.827%0.26729%0.289SS..Hα-helixtrans-67.5-19.3177.3-76.2177.4000113.3I16 R20 L23 C44 S45 A50 V51 D52I16-L48 HydrophobicContact CG2-CB 4.06Å; I16-L48 HydrophobicContact CG2-CD2 4.22Å; R20-L48 HydrophobicContact CG-CB 3.58Å; R20-L48 HydrophobicContact CG-CD1 4.31Å; L23-L48 HydrophobicContact CD1-CD1 3.48Å; L23-L48 VanDerWaalsContact CD1-CD1 3.48Å; C44-L48 WeakPolarHBondContact O-CG 3.15Å; C44-L48 PolarHBondContact O-N 3.33Å; C44-L48 VanDerWaalsContact O-N 3.11Å; S45-L48 PolarHBondContact O-N 2.96Å; L48-A50 VanDerWaalsContact C-N 3.35Å; L48-A50 PolarHBondContact O-N 3.44Å; L48-V51 HydrophobicContact CD2-CB 4.3Å; L48-V51 HydrophobicContact CD2-CG2 4.24Å; L48-V51 WeakPolarHBondContact O-CA 3.27Å; L48-V51 WeakPolarHBondContact O-CB 3.24Å; L48-V51 PolarHBondContact O-N 3.25Å; L48-D52 PolarHBondContact O-N 3.33Å
49D92.5Very high94.1Very high49 Ų4960.4 Ų60.426%0.26231%0.309SS..Hα-helixtrans-53.4-48.2169.2-177.969000112.4R20 S46 L47 V51 D52 G53R20-D49 IonicContact CZ-OD1 3.64Å; R20-D49 IonicContact NH1-OD1 3.51Å; R20-D49 PolarHBondContact NH1-OD1 3.46Å; R20-D49 VanDerWaalsContact NH1-OD1 3.1Å; R20-D49 IonicContact NH2-OD1 2.7Å; R20-D49 PolarHBondContact NH2-OD1 3.35Å; S46-D49 VanDerWaalsContact O-CB 3.23Å; S46-D49 WeakPolarHBondContact O-CB 3.48Å; L47-D49 PolarHBondContact O-N 3.46Å; D49-V51 PolarHBondContact O-N 2.95Å; D49-D52 PolarHBondContact O-N 3.47Å; D49-G53 PolarHBondContact O-N 3.02Å
50A91.2Very high93.8Very high65 Ų6565.1 Ų65.154%0.53733%0.333SS..Hα-helixtrans-64.9-31.2177.200000111.9L47 L48 Y54L47-A50 PolarHBondContact O-N 3.01Å; L48-A50 VanDerWaalsContact C-N 3.35Å; L48-A50 PolarHBondContact O-N 3.44Å; A50-Y54 VanDerWaalsContact O-CB 3.3Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.02Å
51V94.3Very high93.4Very high69 Ų6962.3 Ų62.342%0.41832%0.317SS..Hα-helixtrans-75.4-43.2-177.1-173.70000111.2I16 L48 D49 Y54 A55I16-V51 HydrophobicContact CD1-CG1 4.1Å; L48-V51 HydrophobicContact CD2-CB 4.3Å; L48-V51 HydrophobicContact CD2-CG2 4.24Å; L48-V51 WeakPolarHBondContact O-CA 3.27Å; L48-V51 WeakPolarHBondContact O-CB 3.24Å; L48-V51 PolarHBondContact O-N 3.25Å; D49-V51 PolarHBondContact O-N 2.95Å; V51-Y54 PolarHBondContact O-N 2.93Å; V51-A55 WeakPolarHBondContact O-CB 3.4Å; V51-A55 PolarHBondContact O-N 3.42Å
52D92.5Very high92.9Very high10 Ų1061.4 Ų61.45%0.05332%0.317CS..Hα-helixtrans-65.5-40.7176.965.133.2000111.8P13 I16 R20 L48 D49 Y54 A55 A56P13-D52 HydrophobicContact CB-CB 4.26Å; P13-D52 WeakPolarHBondContact CB-O 3.43Å; P13-D52 WeakPolarHBondContact O-CB 3.43Å; I16-D52 HydrophobicContact CB-CB 3.86Å; I16-D52 HydrophobicContact CD1-CB 4.44Å; I16-D52 HydrophobicContact CG2-CB 3.73Å; R20-D52 VanDerWaalsContact CD-OD2 3.26Å; R20-D52 WeakPolarHBondContact CD-OD2 3.32Å; R20-D52 IonicContact CZ-OD2 2.9Å; R20-D52 IonicContact NE-OD2 3.88Å; R20-D52 IonicContact NH1-OD1 3.85Å; R20-D52 IonicContact NH1-OD2 2.68Å; R20-D52 PolarHBondContact NH1-OD2 2.89Å; L48-D52 PolarHBondContact O-N 3.33Å; D49-D52 PolarHBondContact O-N 3.47Å; D52-Y54 VanDerWaalsContact C-N 3.31Å; D52-Y54 PolarHBondContact O-N 3.47Å; D52-A55 PolarHBondContact O-N 2.99Å; D52-A56 WeakPolarHBondContact O-CB 3.29Å; D52-A56 PolarHBondContact O-N 3.15Å
53G90Very high92.5Very high18 Ų1862 Ų6219%0.18632%0.322CS..Hα-helixtrans-64.6-38.817600000111.4D49 R57D49-G53 PolarHBondContact O-N 3.02Å; G53-R57 VanDerWaalsContact C-CZ 3.42Å; G53-R57 VanDerWaalsContact C-NH2 3.33Å; G53-R57 PolarHBondContact O-N 2.87Å; G53-R57 PolarHBondContact O-NE 3.21Å; G53-R57 PolarHBondContact O-NH1 3.46Å; G53-R57 VanDerWaalsContact O-NH1 3.07Å; G53-R57 PolarHBondContact O-NH2 2.94Å
54Y92.2Very high92Very high143 Ų14363.4 Ų63.456%0.56133%0.325SS*.Hα-helixtrans-64.5-47.6173.4-176.7-93.9000111.5A50 V51 D52 A56 R57 Y58A50-Y54 VanDerWaalsContact O-CB 3.3Å; A50-Y54 WeakPolarHBondContact O-CB 3.36Å; A50-Y54 PolarHBondContact O-N 3.02Å; V51-Y54 PolarHBondContact O-N 2.93Å; D52-Y54 VanDerWaalsContact C-N 3.31Å; D52-Y54 PolarHBondContact O-N 3.47Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; Y54-A56 PolarHBondContact O-N 2.95Å; Y54-R57 PolarHBondContact O-N 3.39Å; Y54-Y58 HydrophobicContact CE1-CD2 4.28Å; Y54-Y58 HydrophobicContact CE1-CG 4.31Å; Y54-Y58 VanDerWaalsContact O-CB 3.32Å; Y54-Y58 WeakPolarHBondContact O-CB 2.92Å; Y54-Y58 PolarHBondContact O-N 3.34Å
55A93.1Very high91.7Very high6 Ų664.7 Ų64.75%0.0533%0.325CS..Hα-helixtrans-60.4-41.6177.700000112.1I12 P13 I16 V51 D52 R57 Y58 F59I12-A55 HydrophobicContact CG2-CB 4.24Å; P13-A55 HydrophobicContact CB-CB 4.49Å; I16-A55 HydrophobicContact CD1-CB 3.9Å; V51-A55 WeakPolarHBondContact O-CB 3.4Å; V51-A55 PolarHBondContact O-N 3.42Å; D52-A55 PolarHBondContact O-N 2.99Å; A55-R57 VanDerWaalsContact C-N 3.27Å; A55-R57 PolarHBondContact O-N 3.44Å; A55-Y58 PolarHBondContact O-N 3.1Å; A55-F59 HydrophobicContact CB-CD2 4.07Å; A55-F59 HydrophobicContact CB-CE2 4.26Å; A55-F59 WeakPolarHBondContact O-CB 3.46Å; A55-F59 VanDerWaalsContact O-CD2 3.29Å; A55-F59 WeakPolarHBondContact O-CD2 3.31Å; A55-F59 PolarHBondContact O-N 2.94Å
56A92Very high91.5Very high14 Ų1465.2 Ų65.212%0.11633%0.331CS..Hα-helixtrans-59.4-37.417800000112.8P13 D52 Y54 Q61 S62P13-A56 HydrophobicContact CB-CB 3.82Å; P13-A56 HydrophobicContact CG-CB 3.94Å; D52-A56 WeakPolarHBondContact O-CB 3.29Å; D52-A56 PolarHBondContact O-N 3.15Å; Y54-A56 VanDerWaalsContact C-N 3.34Å; Y54-A56 PolarHBondContact O-N 2.95Å; A56-Q61 PolarHBondContact O-N 3.27Å; A56-S62 PolarHBondContact O-N 3Å; A56-S62 PolarHBondContact O-OG 3.44Å
57R90.8Very high91.3Very high166 Ų16665.7 Ų65.763%0.62634%0.337SS*.Hα-helixtrans-79.5-43.8176.8-68.2-178.9-66.9-90.11.7111.9G53 Y54 A55 N60G53-R57 VanDerWaalsContact C-CZ 3.42Å; G53-R57 VanDerWaalsContact C-NH2 3.33Å; G53-R57 PolarHBondContact O-N 2.87Å; G53-R57 PolarHBondContact O-NE 3.21Å; G53-R57 PolarHBondContact O-NH1 3.46Å; G53-R57 VanDerWaalsContact O-NH1 3.07Å; G53-R57 PolarHBondContact O-NH2 2.94Å; Y54-R57 PolarHBondContact O-N 3.39Å; A55-R57 VanDerWaalsContact C-N 3.27Å; A55-R57 PolarHBondContact O-N 3.44Å; R57-N60 PolarHBondContact O-N 3.44Å
58Y91.9Very high91.1Very high159 Ų15964.5 Ų64.562%0.62433%0.33SS*.Hα-helixtrans-65-45.4-177.2-176.1-94.5000112.2Y54 A55 N60Y54-Y58 HydrophobicContact CE1-CD2 4.28Å; Y54-Y58 HydrophobicContact CE1-CG 4.31Å; Y54-Y58 VanDerWaalsContact O-CB 3.32Å; Y54-Y58 WeakPolarHBondContact O-CB 2.92Å; Y54-Y58 PolarHBondContact O-N 3.34Å; A55-Y58 PolarHBondContact O-N 3.1Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.35Å
59F90.8Very high91Very high96 Ų9663.3 Ų63.342%0.42132%0.323SS..THydrogen-bonded Turntrans-87.23.4179.7-64.8-68000113.9I12 A55 Q61I12-F59 HydrophobicContact CB-CD2 4.16Å; I12-F59 HydrophobicContact CB-CE2 4.37Å; I12-F59 HydrophobicContact CD1-CD1 4.01Å; I12-F59 HydrophobicContact CD1-CD2 3.7Å; I12-F59 HydrophobicContact CD1-CE1 3.93Å; I12-F59 HydrophobicContact CD1-CE2 3.63Å; I12-F59 HydrophobicContact CD1-CG 3.9Å; I12-F59 HydrophobicContact CD1-CZ 3.74Å; I12-F59 HydrophobicContact CG2-CD2 4.19Å; I12-F59 HydrophobicContact CG2-CE2 3.97Å; A55-F59 HydrophobicContact CB-CD2 4.07Å; A55-F59 HydrophobicContact CB-CE2 4.26Å; A55-F59 WeakPolarHBondContact O-CB 3.46Å; A55-F59 VanDerWaalsContact O-CD2 3.29Å; A55-F59 WeakPolarHBondContact O-CD2 3.31Å; A55-F59 PolarHBondContact O-N 2.94Å; F59-Q61 HydrophobicContact CB-CB 4.24Å; F59-Q61 HydrophobicContact CB-CG 3.98Å; F59-Q61 PolarHBondContact O-N 3.29Å
60N89.5Confident91.1Very high107 Ų10763.2 Ų63.257%0.57232%0.323SS*.THydrogen-bonded Turntrans55.834.1-175.5-158.657.9000112.4R57 Y58 L124R57-N60 PolarHBondContact O-N 3.44Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.35Å; N60-L124 HydrophobicContact CB-CD2 4.47Å; N60-L124 WeakPolarHBondContact ND2-CD1 3.23Å; N60-L124 WeakPolarHBondContact OD1-CD1 3.26Å; N60-L124 WeakPolarHBondContact OD1-CD2 3.47Å
61Q90.2Very high91.2Very high46 Ų4661.6 Ų61.622%0.21531%0.305CS..  trans-109.728.7-174.6-78.5-177.8-12.200112.1F11 P13 A56 F59 S63F11-Q61 HydrophobicContact CB-CB 4.11Å; F11-Q61 HydrophobicContact CB-CG 4.38Å; F11-Q61 HydrophobicContact CD1-CB 4.44Å; F11-Q61 HydrophobicContact CD1-CG 3.99Å; F11-Q61 HydrophobicContact CD2-CB 3.7Å; F11-Q61 HydrophobicContact CD2-CG 4.1Å; F11-Q61 VanDerWaalsContact CD2-O 3.25Å; F11-Q61 WeakPolarHBondContact CD2-O 3.39Å; F11-Q61 HydrophobicContact CE1-CG 4.26Å; F11-Q61 HydrophobicContact CE2-CB 4.17Å; F11-Q61 HydrophobicContact CE2-CG 4.34Å; F11-Q61 HydrophobicContact CG-CB 3.85Å; F11-Q61 HydrophobicContact CG-CG 3.91Å; F11-Q61 HydrophobicContact CZ-CG 4.43Å; P13-Q61 HydrophobicContact CG-CB 4.13Å; A56-Q61 PolarHBondContact O-N 3.27Å; F59-Q61 HydrophobicContact CB-CB 4.24Å; F59-Q61 HydrophobicContact CB-CG 3.98Å; F59-Q61 PolarHBondContact O-N 3.29Å; Q61-S63 PolarHBondContact O-N 2.91Å
62S87.7Confident91.2Very high33 Ų3362.9 Ų62.923%0.23131%0.309CS..  trans-71.2124.4176.9-61.30000110.3A56A56-S62 PolarHBondContact O-N 3Å; A56-S62 PolarHBondContact O-OG 3.44Å
63S88.9Confident91.3Very high18 Ų1862.8 Ų62.813%0.12631%0.308CS..  trans-136.5156.1-17966.90000112.2V8 Q61 F65 G66 A67 L123V8-S63 WeakPolarHBondContact CG1-OG 3.28Å; Q61-S63 PolarHBondContact O-N 2.91Å; S63-F65 VanDerWaalsContact C-N 3.31Å; S63-F65 PolarHBondContact O-N 3.44Å; S63-G66 PolarHBondContact O-N 3.23Å; S63-G66 PolarHBondContact OG-N 3.11Å; S63-G66 VanDerWaalsContact OG-N 3.15Å; S63-A67 PolarHBondContact O-N 2.82Å; S63-L123 WeakPolarHBondContact O-CD1 3.13Å
64Q86.1Confident91.5Very high80 Ų8063.6 Ų63.637%0.37431%0.309SS..Hα-helixtrans-62.5-39.1176.2-75.3-60.5-63.100112.2A67 M68 H121Q64-A67 PolarHBondContact O-N 3.47Å; Q64-M68 WeakPolarHBondContact O-CB 3.49Å; Q64-M68 PolarHBondContact O-N 3.27Å; Q64-H121 HydrophobicContact CG-CB 4.2Å; Q64-H121 PolarHBondContact NE2-CD2 3.34Å
65F90.6Very high91.7Very high74 Ų7457.6 Ų57.633%0.32529%0.285SS..Hα-helixtrans-59-48.2173.9175.7-95.7000111.1V8 F9 N14 Y18 S63 A67 M68 L69V8-F65 HydrophobicContact CG1-CB 4.22Å; F9-F65 HydrophobicContact CD1-CD1 4.3Å; F9-F65 AromaticContact CD1-CE1 3.88Å; F9-F65 HydrophobicContact CD1-CE1 3.88Å; F9-F65 HydrophobicContact CD1-CE2 4.12Å; F9-F65 AromaticContact CD1-CZ 3.77Å; F9-F65 HydrophobicContact CD1-CZ 3.77Å; F9-F65 AromaticContact CE1-CD2 3.98Å; F9-F65 HydrophobicContact CE1-CD2 3.98Å; F9-F65 HydrophobicContact CE1-CE1 4.26Å; F9-F65 AromaticContact CE1-CE2 3.67Å; F9-F65 HydrophobicContact CE1-CE2 3.67Å; F9-F65 HydrophobicContact CE1-CG 4.4Å; F9-F65 AromaticContact CE1-CZ 3.82Å; F9-F65 HydrophobicContact CE1-CZ 3.82Å; N14-F65 HydrophobicContact CB-CE1 4.46Å; Y18-F65 HydrophobicContact CE1-CE1 4.26Å; Y18-F65 HydrophobicContact CE1-CZ 4.28Å; Y18-F65 WeakPolarHBondContact OH-CE1 3.31Å; S63-F65 VanDerWaalsContact C-N 3.31Å; S63-F65 PolarHBondContact O-N 3.44Å; F65-A67 PolarHBondContact O-N 3.49Å; F65-M68 PolarHBondContact O-N 2.94Å; F65-L69 HydrophobicContact CE1-CD2 4.04Å; F65-L69 HydrophobicContact CZ-CD2 4.48Å; F65-L69 WeakPolarHBondContact O-CB 3.42Å; F65-L69 PolarHBondContact O-N 3.31Å
66G92Very high91.8Very high13 Ų1359.9 Ų59.913%0.13430%0.3CS..Hα-helixtrans-61.3-43.8178.900000113N14 S63 M68 L69 D70N14-G66 WeakPolarHBondContact OD1-CA 3.48Å; S63-G66 PolarHBondContact O-N 3.23Å; S63-G66 PolarHBondContact OG-N 3.11Å; S63-G66 VanDerWaalsContact OG-N 3.15Å; G66-M68 VanDerWaalsContact C-N 3.31Å; G66-M68 PolarHBondContact O-N 2.73Å; G66-L69 PolarHBondContact O-N 3.04Å; G66-D70 WeakPolarHBondContact O-CB 3.37Å; G66-D70 PolarHBondContact O-N 2.91Å
67A90.1Very high92.1Very high45 Ų4559.4 Ų59.437%0.37230%0.296SS..Hα-helixtrans-63.6-34.7176.600000113.2S63 Q64 F65 M71S63-A67 PolarHBondContact O-N 2.82Å; Q64-A67 PolarHBondContact O-N 3.47Å; F65-A67 PolarHBondContact O-N 3.49Å; A67-M71 PolarHBondContact O-N 2.76Å
68M91.9Very high92.4Very high92 Ų9251.7 Ų51.745%0.45327%0.267SS..Hα-helixtrans-73.6-42.2175.5-178.8176.2-61.400111.9Q64 F65 G66 D70 L72 M111Q64-M68 WeakPolarHBondContact O-CB 3.49Å; Q64-M68 PolarHBondContact O-N 3.27Å; F65-M68 PolarHBondContact O-N 2.94Å; G66-M68 VanDerWaalsContact C-N 3.31Å; G66-M68 PolarHBondContact O-N 2.73Å; M68-D70 VanDerWaalsContact C-N 3.34Å; M68-L72 VanDerWaalsContact O-CB 3.25Å; M68-L72 WeakPolarHBondContact O-CB 3.43Å; M68-L72 PolarHBondContact O-N 3.29Å; M68-M111 HydrophobicContact CB-SD 3.99Å; M68-M111 HydrophobicContact CE-CE 3.92Å; M68-M111 HydrophobicContact CE-SD 3.99Å; M68-M111 HydrophobicContact CG-CE 3.94Å; M68-M111 HydrophobicContact CG-SD 3.66Å; M68-M111 HydrophobicContact SD-CE 4.27Å
69L94Very high92.6Very high26 Ų2647.1 Ų47.114%0.13625%0.253CS..Hα-helixtrans-60.2-45.8176.6176.764.2000111.1Y18 V21 F65 G66 L72 T73Y18-L69 HydrophobicContact CD1-CD2 3.81Å; Y18-L69 HydrophobicContact CE1-CD1 4.48Å; Y18-L69 HydrophobicContact CE1-CD2 3.57Å; V21-L69 HydrophobicContact CG2-CD1 4.46Å; F65-L69 HydrophobicContact CE1-CD2 4.04Å; F65-L69 HydrophobicContact CZ-CD2 4.48Å; F65-L69 WeakPolarHBondContact O-CB 3.42Å; F65-L69 PolarHBondContact O-N 3.31Å; G66-L69 PolarHBondContact O-N 3.04Å; L69-L72 PolarHBondContact O-N 2.65Å; L69-T73 VanDerWaalsContact O-CB 3.32Å; L69-T73 WeakPolarHBondContact O-CB 3.48Å; L69-T73 PolarHBondContact O-N 3.48Å; L69-T73 PolarHBondContact O-OG1 3.33Å
70D93.3Very high92.9Very high48 Ų4844.7 Ų44.726%0.25725%0.247SC..Hα-helixtrans-54.2-61.7175.4173.142.7000111.4R20 G66 M68 L72 T73 D74R20-D70 IonicContact CZ-OD1 3.46Å; R20-D70 IonicContact NH1-OD1 2.68Å; R20-D70 PolarHBondContact NH1-OD1 2.86Å; R20-D70 IonicContact NH2-OD1 2.76Å; G66-D70 WeakPolarHBondContact O-CB 3.37Å; G66-D70 PolarHBondContact O-N 2.91Å; M68-D70 VanDerWaalsContact C-N 3.34Å; D70-L72 VanDerWaalsContact C-N 3.3Å; D70-L72 PolarHBondContact O-N 2.97Å; D70-T73 PolarHBondContact O-N 2.97Å; D70-D74 PolarHBondContact O-N 3.37Å
71M93.5Very high93.3Very high31 Ų3139.7 Ų39.715%0.15322%0.221CC..Hα-helixtrans-55.3-44.5179.3-172.8-154.171.900112.1A67 D74 R75 H107 M111A67-M71 PolarHBondContact O-N 2.76Å; M71-D74 WeakPolarHBondContact O-CB 3.38Å; M71-R75 VanDerWaalsContact O-CG 3.29Å; M71-R75 WeakPolarHBondContact O-CG 3.46Å; M71-R75 PolarHBondContact O-N 3.28Å; M71-R75 VanDerWaalsContact O-N 3.07Å; M71-H107 HydrophobicContact CG-CB 4.34Å; M71-H107 HydrophobicContact SD-CB 3.96Å; M71-M111 HydrophobicContact CE-CB 4.23Å; M71-M111 HydrophobicContact CE-CE 3.44Å; M71-M111 VanDerWaalsContact CE-CE 3.44Å; M71-M111 HydrophobicContact CE-CG 4.4Å; M71-M111 HydrophobicContact CE-SD 3.3Å; M71-M111 WeakPolarHBondContact CE-SD 3.42Å; M71-M111 HydrophobicContact SD-CB 3.69Å; M71-M111 HydrophobicContact SD-CE 4.37Å; M71-M111 HydrophobicContact SD-CG 4.13Å; M71-M111 HydrophobicContact SD-SD 3.63Å; M71-M111 VanDerWaalsContact SD-SD 3.63Å
72L93.8Very high93.7Very high95 Ų9537.7 Ų37.750%0.49721%0.211SC..Hα-helixtrans-66.9-42.6-178.2-176.261.7000112M68 L69 D70 D74 R75 C76M68-L72 VanDerWaalsContact O-CB 3.25Å; M68-L72 WeakPolarHBondContact O-CB 3.43Å; M68-L72 PolarHBondContact O-N 3.29Å; L69-L72 PolarHBondContact O-N 2.65Å; D70-L72 VanDerWaalsContact C-N 3.3Å; D70-L72 PolarHBondContact O-N 2.97Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.43Å; L72-R75 PolarHBondContact O-N 3.23Å; L72-C76 WeakPolarHBondContact O-CB 3.33Å; L72-C76 PolarHBondContact O-N 2.9Å; L72-C76 PolarHBondContact O-SG 3.36Å; L72-C76 VanDerWaalsContact O-SG 3.32Å
73T95.6Very high94.2Very high8 Ų839.5 Ų39.55%0.04922%0.224CC..Hα-helixtrans-62.8-44.7180-57.40000110.5R20 V21 L69 D70 C76 T77R20-T73 HydrophobicContact CB-CG2 3.76Å; V21-T73 HydrophobicContact CG2-CG2 3.88Å; V21-T73 WeakPolarHBondContact CG2-OG1 3.3Å; L69-T73 VanDerWaalsContact O-CB 3.32Å; L69-T73 WeakPolarHBondContact O-CB 3.48Å; L69-T73 PolarHBondContact O-N 3.48Å; L69-T73 PolarHBondContact O-OG1 3.33Å; D70-T73 PolarHBondContact O-N 2.97Å; T73-C76 PolarHBondContact O-N 2.94Å; T73-T77 WeakPolarHBondContact O-CB 3.16Å; T73-T77 PolarHBondContact O-N 3.06Å; T73-T77 PolarHBondContact O-OG1 3.49Å
74D94.3Very high94.6Very high36 Ų3639.4 Ų39.419%0.19322%0.223CC..Hα-helixtrans-53.1-54.6172.1-110.716.7000112.2R20 D70 M71 L72 C76 T77 T78R20-D74 IonicContact CZ-OD1 2.78Å; R20-D74 IonicContact NH2-OD1 3.21Å; R20-D74 PolarHBondContact NH2-OD1 3.27Å; D70-D74 PolarHBondContact O-N 3.37Å; M71-D74 WeakPolarHBondContact O-CB 3.38Å; L72-D74 VanDerWaalsContact C-N 3.34Å; L72-D74 PolarHBondContact O-N 3.43Å; D74-C76 PolarHBondContact O-N 3.33Å; D74-T77 PolarHBondContact O-N 2.87Å; D74-T78 PolarHBondContact O-N 2.96Å; D74-T78 VanDerWaalsContact O-N 3.1Å; D74-T78 PolarHBondContact O-OG1 3.42Å
75R95.5Very high95.1Very high16 Ų1635.6 Ų35.66%0.0621%0.206CC..Hα-helixtrans-63.7-43-176.5-68.1-3988.3160.45.2112M71 L72 T77 L79 D103 V104 H107M71-R75 VanDerWaalsContact O-CG 3.29Å; M71-R75 WeakPolarHBondContact O-CG 3.46Å; M71-R75 PolarHBondContact O-N 3.28Å; M71-R75 VanDerWaalsContact O-N 3.07Å; L72-R75 PolarHBondContact O-N 3.23Å; R75-T77 VanDerWaalsContact C-N 3.34Å; R75-L79 WeakPolarHBondContact O-CB 3.36Å; R75-L79 PolarHBondContact O-N 3.37Å; R75-D103 WeakPolarHBondContact CD-OD2 3.47Å; R75-D103 IonicContact CZ-OD2 3.45Å; R75-D103 IonicContact NE-OD2 3.97Å; R75-D103 PolarHBondContact NE-OD2 3.05Å; R75-D103 IonicContact NH1-OD1 3.59Å; R75-D103 PolarHBondContact NH1-OD1 3.05Å; R75-D103 IonicContact NH1-OD2 3.1Å; R75-D103 PolarHBondContact NH1-OD2 3.48Å; R75-V104 HydrophobicContact CB-CG2 4.47Å; R75-H107 HydrophobicContact CG-CB 4.36Å; R75-H107 PolarHBondContact NH1-CE1 2.9Å; R75-H107 PolarHBondContact NH1-ND1 3.49Å; R75-H107 PolarHBondContact NH1-NE2 2.79Å
76C96.4Very high95.4Very high54 Ų5433 Ų3337%0.36520%0.197SC..Hα-helixtrans-64.4-39.3177.3-72.40000111.8L72 T73 D74 L79 C80L72-C76 WeakPolarHBondContact O-CB 3.33Å; L72-C76 PolarHBondContact O-N 2.9Å; L72-C76 PolarHBondContact O-SG 3.36Å; L72-C76 VanDerWaalsContact O-SG 3.32Å; T73-C76 PolarHBondContact O-N 2.94Å; D74-C76 PolarHBondContact O-N 3.33Å; C76-L79 PolarHBondContact O-N 2.84Å; C76-C80 PolarHBondContact O-N 3.38Å; C76-C80 PolarHBondContact O-SG 3.31Å
77T96.7Very high95.7Very high4 Ų437.7 Ų37.73%0.02522%0.223CC..Hα-helixtrans-62.4-51.5179.5-56.80000111.2T24 Y42 T73 D74 R75 L79 C80 L81T24-T77 HydrophobicContact CG2-CG2 4.07Å; T24-T77 VanDerWaalsContact CG2-OG1 3.23Å; T24-T77 WeakPolarHBondContact CG2-OG1 3.16Å; T24-T77 PolarHBondContact OG1-OG1 3.26Å; Y42-T77 HydrophobicContact CD2-CG2 3.79Å; Y42-T77 HydrophobicContact CE2-CG2 3.47Å; Y42-T77 VanDerWaalsContact CE2-CG2 3.47Å; T73-T77 WeakPolarHBondContact O-CB 3.16Å; T73-T77 PolarHBondContact O-N 3.06Å; T73-T77 PolarHBondContact O-OG1 3.49Å; D74-T77 PolarHBondContact O-N 2.87Å; R75-T77 VanDerWaalsContact C-N 3.34Å; T77-L79 PolarHBondContact O-N 2.78Å; T77-C80 PolarHBondContact O-N 3.01Å; T77-L81 PolarHBondContact O-N 3.18Å
78T96.9Very high95.9Very high4 Ų437.6 Ų37.63%0.02521%0.214CC..Hα-helixtrans-64.7-39.4176.4-50.80000111.6D74 C80 L81 L82 E158 F161D74-T78 PolarHBondContact O-N 2.96Å; D74-T78 VanDerWaalsContact O-N 3.1Å; D74-T78 PolarHBondContact O-OG1 3.42Å; T78-C80 PolarHBondContact O-N 3.22Å; T78-L81 WeakPolarHBondContact O-CB 3.16Å; T78-L81 PolarHBondContact O-N 3.34Å; T78-L82 HydrophobicContact CG2-CD1 4.12Å; T78-L82 HydrophobicContact CG2-CG 4.39Å; T78-L82 VanDerWaalsContact O-CG 3.3Å; T78-L82 WeakPolarHBondContact O-CG 3.38Å; T78-L82 PolarHBondContact O-N 3.07Å; T78-E158 PolarHBondContact OG1-OE1 3.45Å; T78-E158 PolarHBondContact OG1-OE2 3.16Å; T78-E158 VanDerWaalsContact OG1-OE2 3.12Å; T78-F161 HydrophobicContact CG2-CD2 4.39Å
79L97.6Very high96.1Very high63 Ų6336 Ų3633%0.3320%0.204SC..Hα-helixtrans-59.1-45.6176.7178.964.2000112R75 C76 T77 L81 L82 C83 A100R75-L79 WeakPolarHBondContact O-CB 3.36Å; R75-L79 PolarHBondContact O-N 3.37Å; C76-L79 PolarHBondContact O-N 2.84Å; T77-L79 PolarHBondContact O-N 2.78Å; L79-L81 VanDerWaalsContact C-N 3.32Å; L79-L81 PolarHBondContact O-N 3.33Å; L79-L82 PolarHBondContact O-N 3.12Å; L79-C83 PolarHBondContact O-N 3.46Å; L79-C83 PolarHBondContact O-SG 3.01Å; L79-A100 HydrophobicContact CD1-CB 3.63Å
80C97.4Very high96.3Very high45 Ų4539 Ų3930%0.30423%0.225SC..Hα-helixtrans-61.7-40177.4-720000112.3C28 M31 C76 T77 T78 C83 A84C28-C80 WeakPolarHBondContact SG-CB 3.39Å; C28-C80 PolarHBondContact SG-SG 3.05Å; M31-C80 HydrophobicContact CE-CB 4.38Å; C76-C80 PolarHBondContact O-N 3.38Å; C76-C80 PolarHBondContact O-SG 3.31Å; T77-C80 PolarHBondContact O-N 3.01Å; T78-C80 PolarHBondContact O-N 3.22Å; C80-C83 WeakPolarHBondContact O-CB 3.32Å; C80-C83 PolarHBondContact O-N 3.42Å; C80-A84 PolarHBondContact O-N 2.9Å; C80-A84 VanDerWaalsContact O-N 3.08Å
81L97.7Very high96.5Very high2 Ų246.2 Ų46.21%0.0125%0.253CS..Hα-helixtrans-63.3-44.2174.4-17862.6000111.8M31 Y42 T77 T78 L79 C83 A84 L85 F161 Y165M31-L81 HydrophobicContact CE-CB 4.21Å; M31-L81 HydrophobicContact CE-CD1 4.26Å; Y42-L81 HydrophobicContact CD2-CD2 4.35Å; Y42-L81 HydrophobicContact CE1-CD2 4.19Å; Y42-L81 HydrophobicContact CE2-CB 3.74Å; Y42-L81 HydrophobicContact CE2-CD2 3.6Å; Y42-L81 HydrophobicContact CE2-CG 4.19Å; Y42-L81 WeakPolarHBondContact OH-CD2 3.02Å; T77-L81 PolarHBondContact O-N 3.18Å; T78-L81 WeakPolarHBondContact O-CB 3.16Å; T78-L81 PolarHBondContact O-N 3.34Å; L79-L81 VanDerWaalsContact C-N 3.32Å; L79-L81 PolarHBondContact O-N 3.33Å; L81-C83 VanDerWaalsContact C-N 3.3Å; L81-C83 PolarHBondContact O-N 3.33Å; L81-A84 PolarHBondContact O-N 3.27Å; L81-L85 HydrophobicContact CG-CD1 4.31Å; L81-L85 WeakPolarHBondContact O-CG 3.25Å; L81-L85 PolarHBondContact O-N 2.97Å; L81-F161 HydrophobicContact CD2-CB 3.6Å; L81-F161 HydrophobicContact CG-CB 4.28Å; L81-Y165 HydrophobicContact CD1-CD1 4.47Å; L81-Y165 HydrophobicContact CD1-CD2 3.81Å; L81-Y165 HydrophobicContact CD1-CG 3.71Å
82L97.9Very high96.6Very high4 Ų448.9 Ų48.92%0.02127%0.265CS..Hα-helixtrans-62.3-36.2175.9-70.4171.9000112.3T78 L79 L85 S86 F96 A100 F161T78-L82 HydrophobicContact CG2-CD1 4.12Å; T78-L82 HydrophobicContact CG2-CG 4.39Å; T78-L82 VanDerWaalsContact O-CG 3.3Å; T78-L82 WeakPolarHBondContact O-CG 3.38Å; T78-L82 PolarHBondContact O-N 3.07Å; L79-L82 PolarHBondContact O-N 3.12Å; L82-L85 HydrophobicContact CD2-CD1 4.47Å; L82-L85 PolarHBondContact O-N 3.17Å; L82-S86 WeakPolarHBondContact O-CB 3.14Å; L82-S86 PolarHBondContact O-N 3.03Å; L82-S86 PolarHBondContact O-OG 3.04Å; L82-F96 HydrophobicContact CD2-CB 4.24Å; L82-F96 HydrophobicContact CD2-CD1 3.66Å; L82-F96 HydrophobicContact CD2-CG 4.34Å; L82-A100 HydrophobicContact CD1-CB 3.76Å; L82-F161 HydrophobicContact CD2-CD1 3.45Å; L82-F161 VanDerWaalsContact CD2-CD1 3.45Å; L82-F161 HydrophobicContact CD2-CD2 4.24Å; L82-F161 HydrophobicContact CD2-CE1 3.33Å; L82-F161 HydrophobicContact CD2-CE2 4.13Å; L82-F161 HydrophobicContact CD2-CG 3.93Å; L82-F161 HydrophobicContact CD2-CZ 3.69Å
83C97.5Very high96.7Very high72 Ų7247.7 Ų47.749%0.48626%0.259SS..Hα-helixtrans-62.7-44.7172.5-71.40000111.6L79 C80 L81 S86 V87L79-C83 PolarHBondContact O-N 3.46Å; L79-C83 PolarHBondContact O-SG 3.01Å; C80-C83 WeakPolarHBondContact O-CB 3.32Å; C80-C83 PolarHBondContact O-N 3.42Å; L81-C83 VanDerWaalsContact C-N 3.3Å; L81-C83 PolarHBondContact O-N 3.33Å; C83-S86 WeakPolarHBondContact O-CB 3.48Å; C83-S86 PolarHBondContact O-N 3.11Å; C83-V87 PolarHBondContact O-N 3.4Å
84A97.3Very high96.8Very high15 Ų1552.9 Ų52.912%0.12429%0.286CS..Hα-helixtrans-62.8-45.2175.300000111.8M31 C80 L81 S86 V87 F88M31-A84 HydrophobicContact SD-CB 3.82Å; C80-A84 PolarHBondContact O-N 2.9Å; C80-A84 VanDerWaalsContact O-N 3.08Å; L81-A84 PolarHBondContact O-N 3.27Å; A84-S86 VanDerWaalsContact C-N 3.26Å; A84-S86 PolarHBondContact O-N 3.07Å; A84-V87 WeakPolarHBondContact O-CB 3.37Å; A84-V87 PolarHBondContact O-N 3.15Å; A84-V87 VanDerWaalsContact O-N 3.08Å; A84-F88 HydrophobicContact CB-CE2 4.23Å; A84-F88 HydrophobicContact CB-CZ 4.44Å; A84-F88 WeakPolarHBondContact O-CD2 3.21Å; A84-F88 WeakPolarHBondContact O-CG 3.46Å; A84-F88 PolarHBondContact O-N 3.48Å; A84-F88 VanDerWaalsContact O-N 3.08Å
85L97.5Very high96.9Very high0 Ų054 Ų540%029%0.289CS..Hα-helixtrans-60.8-35.2176-70.5174.3000112.7L81 L82 V87 F88 Y89 F96 F161 L164L81-L85 HydrophobicContact CG-CD1 4.31Å; L81-L85 WeakPolarHBondContact O-CG 3.25Å; L81-L85 PolarHBondContact O-N 2.97Å; L82-L85 HydrophobicContact CD2-CD1 4.47Å; L82-L85 PolarHBondContact O-N 3.17Å; L85-V87 PolarHBondContact O-N 3.27Å; L85-F88 PolarHBondContact O-N 2.92Å; L85-Y89 HydrophobicContact CD2-CD2 3.96Å; L85-Y89 HydrophobicContact CD2-CE2 3.74Å; L85-Y89 WeakPolarHBondContact O-CB 2.99Å; L85-Y89 PolarHBondContact O-N 3Å; L85-F96 HydrophobicContact CB-CD1 4.27Å; L85-F96 HydrophobicContact CB-CD2 4.25Å; L85-F96 HydrophobicContact CB-CE1 4.01Å; L85-F96 HydrophobicContact CB-CE2 4Å; L85-F96 HydrophobicContact CB-CG 4.38Å; L85-F96 HydrophobicContact CB-CZ 3.87Å; L85-F96 HydrophobicContact CD1-CD1 4.42Å; L85-F96 HydrophobicContact CD1-CE1 3.96Å; L85-F96 HydrophobicContact CD1-CZ 4.43Å; L85-F161 HydrophobicContact CD1-CB 3.94Å; L85-F161 HydrophobicContact CD1-CD1 3.71Å; L85-F161 HydrophobicContact CD1-CG 4.27Å; L85-L164 HydrophobicContact CD1-CB 4.39Å; L85-L164 HydrophobicContact CD2-CB 3.85Å
86S97.6Very high97Very high21 Ų2153.5 Ų53.515%0.14729%0.288CS..Hα-helixtrans-62.9-31.6175.8-64.20000112.7L82 C83 A84 F96L82-S86 WeakPolarHBondContact O-CB 3.14Å; L82-S86 PolarHBondContact O-N 3.03Å; L82-S86 PolarHBondContact O-OG 3.04Å; C83-S86 WeakPolarHBondContact O-CB 3.48Å; C83-S86 PolarHBondContact O-N 3.11Å; A84-S86 VanDerWaalsContact C-N 3.26Å; A84-S86 PolarHBondContact O-N 3.07Å; S86-F96 WeakPolarHBondContact OG-CB 3.41Å
87V96.5Very high97.1Very high111 Ų11155.7 Ų55.767%0.67329%0.293SS*.Hα-helixtrans-76.3-42.7174.1176.50000110.9C83 A84 L85C83-V87 PolarHBondContact O-N 3.4Å; A84-V87 WeakPolarHBondContact O-CB 3.37Å; A84-V87 PolarHBondContact O-N 3.15Å; A84-V87 VanDerWaalsContact O-N 3.08Å; L85-V87 PolarHBondContact O-N 3.27Å
88F95.4Very high97.1Very high43 Ų4360.1 Ų60.119%0.18932%0.315CS..Hα-helixtrans-72.8-30.6-176.9-59.9-20.7000113.7A84 L85 P90 Y165 H168 F169A84-F88 HydrophobicContact CB-CE2 4.23Å; A84-F88 HydrophobicContact CB-CZ 4.44Å; A84-F88 WeakPolarHBondContact O-CD2 3.21Å; A84-F88 WeakPolarHBondContact O-CG 3.46Å; A84-F88 PolarHBondContact O-N 3.48Å; A84-F88 VanDerWaalsContact O-N 3.08Å; L85-F88 PolarHBondContact O-N 2.92Å; F88-P90 VanDerWaalsContact C-CD 3.46Å; F88-P90 WeakPolarHBondContact O-CD 3.18Å; F88-Y165 HydrophobicContact CD2-CD2 4.38Å; F88-Y165 AromaticContact CE2-CD2 3.7Å; F88-Y165 HydrophobicContact CE2-CD2 3.7Å; F88-Y165 AromaticContact CE2-CE2 3.62Å; F88-Y165 HydrophobicContact CE2-CE2 3.62Å; F88-Y165 HydrophobicContact CZ-CE2 4.26Å; F88-H168 AromaticContact CD1-NE2 3.77Å; F88-H168 HydrophobicContact CD2-CB 4.32Å; F88-H168 AromaticContact CD2-CD2 3.7Å; F88-H168 AromaticContact CD2-CG 3.94Å; F88-H168 AromaticContact CG-CD2 3.67Å; F88-H168 AromaticContact CG-NE2 3.7Å; F88-F169 HydrophobicContact CD2-CE2 4.46Å; F88-F169 HydrophobicContact CE1-CZ 4.31Å; F88-F169 AromaticContact CE2-CE2 3.65Å; F88-F169 HydrophobicContact CE2-CE2 3.65Å; F88-F169 AromaticContact CE2-CZ 3.8Å; F88-F169 HydrophobicContact CE2-CZ 3.8Å; F88-F169 AromaticContact CZ-CE2 3.93Å; F88-F169 HydrophobicContact CZ-CE2 3.93Å; F88-F169 AromaticContact CZ-CZ 3.58Å; F88-F169 HydrophobicContact CZ-CZ 3.58Å
89Y96.4Very high97.1Very high59 Ų5960.7 Ų60.723%0.23132%0.317CS..  trans-127.266.7-175.4-61-74.2000110.3L85 K91 Q92 L93 F96 L164 H168L85-Y89 HydrophobicContact CD2-CD2 3.96Å; L85-Y89 HydrophobicContact CD2-CE2 3.74Å; L85-Y89 WeakPolarHBondContact O-CB 2.99Å; L85-Y89 PolarHBondContact O-N 3Å; Y89-K91 PolarHBondContact O-N 2.95Å; Y89-K91 VanDerWaalsContact O-N 3.12Å; Y89-Q92 PolarHBondContact O-N 3.22Å; Y89-Q92 PolarHBondContact O-OE1 2.86Å; Y89-L93 PolarHBondContact O-N 2.78Å; Y89-F96 HydrophobicContact CD2-CZ 4.41Å; Y89-L164 PolarHBondContact OH-O 3.25Å; Y89-L164 VanDerWaalsContact OH-O 3.06Å; Y89-H168 HydrophobicContact CE2-CB 4.34Å; Y89-H168 WeakPolarHBondContact OH-CB 3.49Å
90P96.9Very high97Very high89 Ų8958.3 Ų58.358%0.57831%0.307SS*.G310 helixtrans-62.9-25-172.224.6-34.9000113.3F88 Q92 L93F88-P90 VanDerWaalsContact C-CD 3.46Å; F88-P90 WeakPolarHBondContact O-CD 3.18Å; P90-Q92 PolarHBondContact O-N 3.03Å; P90-L93 VanDerWaalsContact O-CB 3.3Å; P90-L93 WeakPolarHBondContact O-CB 3.25Å; P90-L93 PolarHBondContact O-N 3.46Å
91K97.3Very high97Very high198 Ų19859.1 Ų59.186%0.86132%0.317SS*.G310 helixtrans-64.9-24.7174.5-65.6-177.7179.5179.90112.6Y89Y89-K91 PolarHBondContact O-N 2.95Å; Y89-K91 VanDerWaalsContact O-N 3.12Å
92Q96.5Very high97Very high87 Ų8760.2 Ų60.241%0.40732%0.322SS..G310 helixtrans-106.112.8-179-64.380.14.200112Y89 P90 L94 F95 F96Y89-Q92 PolarHBondContact O-N 3.22Å; Y89-Q92 PolarHBondContact O-OE1 2.86Å; P90-Q92 PolarHBondContact O-N 3.03Å; Q92-L94 VanDerWaalsContact C-N 3.3Å; Q92-L94 PolarHBondContact O-N 2.9Å; Q92-F95 HydrophobicContact CB-CB 4.45Å; Q92-F95 WeakPolarHBondContact O-CA 3.47Å; Q92-F95 VanDerWaalsContact O-CB 3.29Å; Q92-F95 WeakPolarHBondContact O-CB 3.36Å; Q92-F95 PolarHBondContact O-N 3.05Å; Q92-F96 HydrophobicContact CB-CD2 4.28Å; Q92-F96 HydrophobicContact CB-CE2 3.71Å; Q92-F96 HydrophobicContact CB-CZ 4.29Å; Q92-F96 VanDerWaalsContact O-CD2 3.32Å; Q92-F96 WeakPolarHBondContact O-CD2 3.25Å; Q92-F96 PolarHBondContact O-N 3.47Å
93L96.9Very high96.9Very high71 Ų7160.8 Ų60.837%0.37233%0.325SS..Hα-helixtrans-48.7-50.2-178.9173.462.6000112.6Y89 P90 F95 F96 Q97Y89-L93 PolarHBondContact O-N 2.78Å; P90-L93 VanDerWaalsContact O-CB 3.3Å; P90-L93 WeakPolarHBondContact O-CB 3.25Å; P90-L93 PolarHBondContact O-N 3.46Å; L93-F95 VanDerWaalsContact C-N 3.25Å; L93-F95 PolarHBondContact O-N 2.88Å; L93-F96 PolarHBondContact O-N 3.02Å; L93-Q97 HydrophobicContact CD1-CG 4.07Å; L93-Q97 HydrophobicContact CG-CG 4.41Å; L93-Q97 WeakPolarHBondContact O-CG 3.37Å; L93-Q97 PolarHBondContact O-N 3.41Å
94L97.2Very high96.8Very high116 Ų11660 Ų6061%0.60732%0.318SS*.Hα-helixtrans-60.2-37-179.7-178.362.4000112.1Q92 Q97 I98Q92-L94 VanDerWaalsContact C-N 3.3Å; Q92-L94 PolarHBondContact O-N 2.9Å; L94-Q97 PolarHBondContact O-N 3.49Å; L94-I98 HydrophobicContact CD1-CD1 3.94Å; L94-I98 HydrophobicContact CD1-CG1 4.15Å; L94-I98 HydrophobicContact CD2-CD1 4.49Å; L94-I98 HydrophobicContact CG-CD1 3.84Å; L94-I98 HydrophobicContact CG-CG1 4.44Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.37Å; L94-I98 PolarHBondContact O-N 3.43Å
95F96.3Very high96.7Very high60 Ų6061.4 Ų61.426%0.26333%0.327SS..Hα-helixtrans-62.7-49.1177.9168.2-91.1000111.1Q92 L93 Q97 I98 F99 F160 F161 F191Q92-F95 HydrophobicContact CB-CB 4.45Å; Q92-F95 WeakPolarHBondContact O-CA 3.47Å; Q92-F95 VanDerWaalsContact O-CB 3.29Å; Q92-F95 WeakPolarHBondContact O-CB 3.36Å; Q92-F95 PolarHBondContact O-N 3.05Å; L93-F95 VanDerWaalsContact C-N 3.25Å; L93-F95 PolarHBondContact O-N 2.88Å; F95-Q97 PolarHBondContact O-N 3.45Å; F95-I98 PolarHBondContact O-N 3.41Å; F95-F99 HydrophobicContact CD1-CD2 4.4Å; F95-F99 HydrophobicContact CD2-CD2 4.05Å; F95-F99 AromaticContact CD2-CE2 3.98Å; F95-F99 HydrophobicContact CD2-CE2 3.98Å; F95-F99 HydrophobicContact CE1-CD2 4.02Å; F95-F99 HydrophobicContact CE1-CE2 4.14Å; F95-F99 AromaticContact CE2-CD2 3.67Å; F95-F99 HydrophobicContact CE2-CD2 3.67Å; F95-F99 AromaticContact CE2-CE2 3.21Å; F95-F99 HydrophobicContact CE2-CE2 3.21Å; F95-F99 HydrophobicContact CE2-CZ 4.17Å; F95-F99 HydrophobicContact CG-CD2 4.4Å; F95-F99 AromaticContact CZ-CD2 3.63Å; F95-F99 HydrophobicContact CZ-CD2 3.63Å; F95-F99 AromaticContact CZ-CE2 3.29Å; F95-F99 HydrophobicContact CZ-CE2 3.29Å; F95-F99 AromaticContact CZ-CZ 3.96Å; F95-F99 HydrophobicContact CZ-CZ 3.96Å; F95-F99 PolarHBondContact O-N 2.92Å; F95-F160 HydrophobicContact CE1-CE1 4.13Å; F95-F160 HydrophobicContact CZ-CE1 4.14Å; F95-F160 HydrophobicContact CZ-CZ 4.48Å; F95-F161 HydrophobicContact CE1-CE1 4.26Å; F95-F191 HydrophobicContact CE2-CE2 4.22Å; F95-F191 AromaticContact CZ-CE2 3.98Å; F95-F191 HydrophobicContact CZ-CE2 3.98Å
96F97.3Very high96.6Very high6 Ų661.4 Ų61.43%0.02633%0.327CS..Hα-helixtrans-66.8-36.8178.1-60.1-57.9000112.5L82 L85 S86 Y89 Q92 L93 F99 A100 F161 L164L82-F96 HydrophobicContact CD2-CB 4.24Å; L82-F96 HydrophobicContact CD2-CD1 3.66Å; L82-F96 HydrophobicContact CD2-CG 4.34Å; L85-F96 HydrophobicContact CB-CD1 4.27Å; L85-F96 HydrophobicContact CB-CD2 4.25Å; L85-F96 HydrophobicContact CB-CE1 4.01Å; L85-F96 HydrophobicContact CB-CE2 4Å; L85-F96 HydrophobicContact CB-CG 4.38Å; L85-F96 HydrophobicContact CB-CZ 3.87Å; L85-F96 HydrophobicContact CD1-CD1 4.42Å; L85-F96 HydrophobicContact CD1-CE1 3.96Å; L85-F96 HydrophobicContact CD1-CZ 4.43Å; S86-F96 WeakPolarHBondContact OG-CB 3.41Å; Y89-F96 HydrophobicContact CD2-CZ 4.41Å; Q92-F96 HydrophobicContact CB-CD2 4.28Å; Q92-F96 HydrophobicContact CB-CE2 3.71Å; Q92-F96 HydrophobicContact CB-CZ 4.29Å; Q92-F96 VanDerWaalsContact O-CD2 3.32Å; Q92-F96 WeakPolarHBondContact O-CD2 3.25Å; Q92-F96 PolarHBondContact O-N 3.47Å; L93-F96 PolarHBondContact O-N 3.02Å; F96-F99 PolarHBondContact O-N 3.48Å; F96-A100 VanDerWaalsContact O-CB 3.27Å; F96-A100 WeakPolarHBondContact O-CB 3.29Å; F96-A100 PolarHBondContact O-N 2.92Å; F96-F161 HydrophobicContact CD1-CD1 4.39Å; F96-F161 AromaticContact CD1-CE1 3.99Å; F96-F161 HydrophobicContact CD1-CE1 3.99Å; F96-F161 HydrophobicContact CE1-CD1 4.21Å; F96-F161 HydrophobicContact CE1-CE1 4.02Å; F96-L164 HydrophobicContact CE1-CD1 4.19Å; F96-L164 HydrophobicContact CZ-CD1 4.33Å
97Q97.5Very high96.3Very high100 Ų10061.5 Ų61.547%0.46733%0.325SS..Hα-helixtrans-62.6-45.9175.9-74.9176.5-2600112.3L93 L94 F95 A100 A101L93-Q97 HydrophobicContact CD1-CG 4.07Å; L93-Q97 HydrophobicContact CG-CG 4.41Å; L93-Q97 WeakPolarHBondContact O-CG 3.37Å; L93-Q97 PolarHBondContact O-N 3.41Å; L94-Q97 PolarHBondContact O-N 3.49Å; F95-Q97 PolarHBondContact O-N 3.45Å; Q97-A100 PolarHBondContact O-N 2.95Å; Q97-A101 VanDerWaalsContact O-CB 3.29Å; Q97-A101 WeakPolarHBondContact O-CB 3.49Å; Q97-A101 PolarHBondContact O-N 3.29Å
98I97Very high96.1Very high97 Ų9762.7 Ų62.750%0.49732%0.318SS..Hα-helixtrans-63.7-44.6177.3-69.6169.5000110.3L94 F95 A101 L102L94-I98 HydrophobicContact CD1-CD1 3.94Å; L94-I98 HydrophobicContact CD1-CG1 4.15Å; L94-I98 HydrophobicContact CD2-CD1 4.49Å; L94-I98 HydrophobicContact CG-CD1 3.84Å; L94-I98 HydrophobicContact CG-CG1 4.44Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.37Å; L94-I98 PolarHBondContact O-N 3.43Å; F95-I98 PolarHBondContact O-N 3.41Å; I98-A101 PolarHBondContact O-N 2.93Å; I98-L102 WeakPolarHBondContact O-CB 3.29Å; I98-L102 PolarHBondContact O-N 3.47Å
99F96.9Very high95.9Very high16 Ų1662.2 Ų62.27%0.0732%0.317CS..Hα-helixtrans-58.6-49.5176.4-102.6-93.5000112.2F95 F96 L102 D103 F161 L195 S198F95-F99 HydrophobicContact CD1-CD2 4.4Å; F95-F99 HydrophobicContact CD2-CD2 4.05Å; F95-F99 AromaticContact CD2-CE2 3.98Å; F95-F99 HydrophobicContact CD2-CE2 3.98Å; F95-F99 HydrophobicContact CE1-CD2 4.02Å; F95-F99 HydrophobicContact CE1-CE2 4.14Å; F95-F99 AromaticContact CE2-CD2 3.67Å; F95-F99 HydrophobicContact CE2-CD2 3.67Å; F95-F99 AromaticContact CE2-CE2 3.21Å; F95-F99 HydrophobicContact CE2-CE2 3.21Å; F95-F99 HydrophobicContact CE2-CZ 4.17Å; F95-F99 HydrophobicContact CG-CD2 4.4Å; F95-F99 AromaticContact CZ-CD2 3.63Å; F95-F99 HydrophobicContact CZ-CD2 3.63Å; F95-F99 AromaticContact CZ-CE2 3.29Å; F95-F99 HydrophobicContact CZ-CE2 3.29Å; F95-F99 AromaticContact CZ-CZ 3.96Å; F95-F99 HydrophobicContact CZ-CZ 3.96Å; F95-F99 PolarHBondContact O-N 2.92Å; F96-F99 PolarHBondContact O-N 3.48Å; F99-L102 PolarHBondContact O-N 3.44Å; F99-D103 VanDerWaalsContact O-CB 3.29Å; F99-D103 WeakPolarHBondContact O-CB 3.34Å; F99-D103 PolarHBondContact O-N 2.83Å; F99-F161 HydrophobicContact CB-CZ 4.39Å; F99-F161 HydrophobicContact CD1-CE2 4.14Å; F99-F161 AromaticContact CD1-CZ 3.59Å; F99-F161 HydrophobicContact CD1-CZ 3.59Å; F99-F161 HydrophobicContact CE1-CE2 4.44Å; F99-F161 AromaticContact CE1-CZ 3.95Å; F99-F161 HydrophobicContact CE1-CZ 3.95Å; F99-F161 HydrophobicContact CG-CZ 4.01Å; F99-L195 HydrophobicContact CE2-CD2 4.37Å; F99-L195 HydrophobicContact CZ-CD2 4.17Å; F99-S198 VanDerWaalsContact CE1-CB 3.4Å; F99-S198 VanDerWaalsContact CZ-CB 3.49Å
100A97.1Very high95.5Very high13 Ų1362 Ų6211%0.10732%0.316CS..Hα-helixtrans-59.5-50.6178.300000111.9L79 L82 F96 Q97 L102 D103 V104L79-A100 HydrophobicContact CD1-CB 3.63Å; L82-A100 HydrophobicContact CD1-CB 3.76Å; F96-A100 VanDerWaalsContact O-CB 3.27Å; F96-A100 WeakPolarHBondContact O-CB 3.29Å; F96-A100 PolarHBondContact O-N 2.92Å; Q97-A100 PolarHBondContact O-N 2.95Å; A100-L102 PolarHBondContact O-N 2.97Å; A100-D103 PolarHBondContact O-N 3.24Å; A100-V104 WeakPolarHBondContact O-CB 3.44Å; A100-V104 WeakPolarHBondContact O-CG2 2.95Å; A100-V104 PolarHBondContact O-N 3.3Å
101A97.3Very high95Very high62 Ų6259.6 Ų59.651%0.51230%0.297SS..Hα-helixtrans-63.2-43.2-178.500000111.7Q97 I98 S105Q97-A101 VanDerWaalsContact O-CB 3.29Å; Q97-A101 WeakPolarHBondContact O-CB 3.49Å; Q97-A101 PolarHBondContact O-N 3.29Å; I98-A101 PolarHBondContact O-N 2.93Å; A101-S105 WeakPolarHBondContact O-CB 3.29Å; A101-S105 PolarHBondContact O-N 3.27Å; A101-S105 PolarHBondContact O-OG 3.4Å
102L96.9Very high94.6Very high24 Ų2453.4 Ų53.413%0.12627%0.271CS..Hα-helixtrans-65.5-45178.3177.261.3000111.9I98 F99 A100 S105 S106 S198 V202 L205I98-L102 WeakPolarHBondContact O-CB 3.29Å; I98-L102 PolarHBondContact O-N 3.47Å; F99-L102 PolarHBondContact O-N 3.44Å; A100-L102 PolarHBondContact O-N 2.97Å; L102-S105 PolarHBondContact O-OG 3.32Å; L102-S106 WeakPolarHBondContact O-CB 3.48Å; L102-S106 PolarHBondContact O-N 3.23Å; L102-S106 PolarHBondContact O-OG 2.9Å; L102-S198 WeakPolarHBondContact CD2-O 3.44Å; L102-S198 WeakPolarHBondContact CD2-OG 3.35Å; L102-V202 HydrophobicContact CD1-CB 4.46Å; L102-V202 HydrophobicContact CD1-CG2 3.81Å; L102-V202 HydrophobicContact CD2-CG2 3.56Å; L102-V202 HydrophobicContact CG-CG2 4.32Å; L102-L205 HydrophobicContact CD1-CD2 4.27Å
103D95.3Very high94.1Very high17 Ų1750 Ų509%0.09126%0.255CS..Hα-helixtrans-65.4-47.4-178.5-169.865.3000111.5R75 F99 A100 S106 H107R75-D103 WeakPolarHBondContact CD-OD2 3.47Å; R75-D103 IonicContact CZ-OD2 3.45Å; R75-D103 IonicContact NE-OD2 3.97Å; R75-D103 PolarHBondContact NE-OD2 3.05Å; R75-D103 IonicContact NH1-OD1 3.59Å; R75-D103 PolarHBondContact NH1-OD1 3.05Å; R75-D103 IonicContact NH1-OD2 3.1Å; R75-D103 PolarHBondContact NH1-OD2 3.48Å; F99-D103 VanDerWaalsContact O-CB 3.29Å; F99-D103 WeakPolarHBondContact O-CB 3.34Å; F99-D103 PolarHBondContact O-N 2.83Å; A100-D103 PolarHBondContact O-N 3.24Å; D103-S106 PolarHBondContact O-OG 3.07Å; D103-S106 VanDerWaalsContact O-OG 3.04Å; D103-H107 PolarHBondContact O-N 3.29Å; D103-H107 PolarHBondContact O-ND1 3.27Å; D103-H107 IonicContact OD1-CE1 3.23Å; D103-H107 PolarHBondContact OD1-CE1 3.26Å; D103-H107 VanDerWaalsContact OD1-CE1 3.23Å; D103-H107 IonicContact OD1-ND1 3.47Å; D103-H107 PolarHBondContact OD1-ND1 3.31Å
104V95.9Very high93.4Very high56 Ų5648.9 Ų48.934%0.33925%0.248SC..Hα-helixtrans-63.1-50.4176.6173.90000111.4R75 A100 S106 W108R75-V104 HydrophobicContact CB-CG2 4.47Å; A100-V104 WeakPolarHBondContact O-CB 3.44Å; A100-V104 WeakPolarHBondContact O-CG2 2.95Å; A100-V104 PolarHBondContact O-N 3.3Å; V104-S106 PolarHBondContact O-N 2.81Å; V104-W108 WeakPolarHBondContact O-CB 3.29Å; V104-W108 PolarHBondContact O-N 3.38Å
105S96Very high92.8Very high44 Ų4446.6 Ų46.631%0.30824%0.241SC..Hα-helixtrans-65.8-40.6-175.660.20000113A101 L102 L109A101-S105 WeakPolarHBondContact O-CB 3.29Å; A101-S105 PolarHBondContact O-N 3.27Å; A101-S105 PolarHBondContact O-OG 3.4Å; L102-S105 PolarHBondContact O-OG 3.32Å; S105-L109 WeakPolarHBondContact O-CB 3.29Å; S105-L109 PolarHBondContact O-N 3.49Å
106S94Very high92.2Very high0 Ų047.9 Ų47.90%025%0.25CS..Hα-helixtrans-64.2-45.8179.360.90000112.2L102 D103 V104 Y110 S201L102-S106 WeakPolarHBondContact O-CB 3.48Å; L102-S106 PolarHBondContact O-N 3.23Å; L102-S106 PolarHBondContact O-OG 2.9Å; D103-S106 PolarHBondContact O-OG 3.07Å; D103-S106 VanDerWaalsContact O-OG 3.04Å; V104-S106 PolarHBondContact O-N 2.81Å; S106-Y110 VanDerWaalsContact O-CB 3.24Å; S106-Y110 WeakPolarHBondContact O-CB 3.46Å; S106-Y110 PolarHBondContact O-N 2.7Å; S106-S201 WeakPolarHBondContact CB-O 3.44Å
107H92.1Very high91.4Very high22 Ų2251.4 Ų51.410%0.10227%0.265CS..Hα-helixtrans-71-40.8178.6-70.779.4000111.6M71 R75 D103 Y110 M111M71-H107 HydrophobicContact CG-CB 4.34Å; M71-H107 HydrophobicContact SD-CB 3.96Å; R75-H107 HydrophobicContact CG-CB 4.36Å; R75-H107 PolarHBondContact NH1-CE1 2.9Å; R75-H107 PolarHBondContact NH1-ND1 3.49Å; R75-H107 PolarHBondContact NH1-NE2 2.79Å; D103-H107 PolarHBondContact O-N 3.29Å; D103-H107 PolarHBondContact O-ND1 3.27Å; D103-H107 IonicContact OD1-CE1 3.23Å; D103-H107 PolarHBondContact OD1-CE1 3.26Å; D103-H107 VanDerWaalsContact OD1-CE1 3.23Å; D103-H107 IonicContact OD1-ND1 3.47Å; D103-H107 PolarHBondContact OD1-ND1 3.31Å; H107-Y110 PolarHBondContact O-N 2.68Å; H107-M111 WeakPolarHBondContact O-CB 3.33Å; H107-M111 PolarHBondContact O-N 2.9Å
108W92.1Very high90.3Very high136 Ų13648.8 Ų48.852%0.51526%0.255SS..Hα-helixtrans-58.4-51.1175.7-176.689.1000111.3V104 Y110 M111 H112V104-W108 WeakPolarHBondContact O-CB 3.29Å; V104-W108 PolarHBondContact O-N 3.38Å; W108-Y110 PolarHBondContact O-N 2.68Å; W108-M111 PolarHBondContact O-N 2.72Å; W108-H112 AromaticContact CD1-CE1 3.58Å; W108-H112 AromaticContact CD1-ND1 3.94Å; W108-H112 AromaticContact CD2-CE1 3.6Å; W108-H112 AromaticContact CD2-ND1 3.55Å; W108-H112 AromaticContact CE2-CE1 3.04Å; W108-H112 AromaticContact CE2-ND1 3.49Å; W108-H112 AromaticContact CE2-NE2 3.57Å; W108-H112 AromaticContact CG-CE1 3.91Å; W108-H112 AromaticContact CG-ND1 3.85Å; W108-H112 AromaticContact CZ2-CD2 3.95Å; W108-H112 AromaticContact CZ2-CE1 3.39Å; W108-H112 WeakPolarHBondContact CZ2-CE1 3.29Å; W108-H112 AromaticContact CZ2-ND1 3.91Å; W108-H112 AromaticContact CZ2-NE2 3.38Å; W108-H112 WeakPolarHBondContact CZ2-NE2 3.3Å; W108-H112 AromaticContact NE1-CE1 3.06Å; W108-H112 PolarHBondContact NE1-CE1 2.76Å; W108-H112 AromaticContact NE1-ND1 3.76Å; W108-H112 AromaticContact NE1-NE2 3.83Å; W108-H112 PolarHBondContact O-N 3.15Å; W108-H112 PolarHBondContact O-ND1 3.46Å
109L91.2Very high88.8Confident34 Ų3448.9 Ų48.918%0.17826%0.262CS..Hα-helixtrans-67.1-37-179.6-166.265.5000112.1S105 H112 R113 L205 A208 A209 I212S105-L109 WeakPolarHBondContact O-CB 3.29Å; S105-L109 PolarHBondContact O-N 3.49Å; L109-H112 PolarHBondContact O-N 3.1Å; L109-R113 WeakPolarHBondContact O-CB 3.48Å; L109-R113 PolarHBondContact O-N 3.11Å; L109-L205 HydrophobicContact CB-CD1 4.17Å; L109-L205 HydrophobicContact CD2-CD1 3.74Å; L109-A208 HydrophobicContact CB-CB 4.23Å; L109-A208 HydrophobicContact CD2-CB 4.02Å; L109-A208 HydrophobicContact CG-CB 3.85Å; L109-A209 HydrophobicContact CD2-CB 3.82Å; L109-I212 HydrophobicContact CD1-CD1 3.39Å; L109-I212 HydrophobicContact CG-CD1 3.81Å
110Y87.8Confident87Confident55 Ų5556 Ų5622%0.21630%0.295CS..Hα-helixtrans-61.4-46.5173.9-179.6-95.3000111.6S106 H107 W108 R113 Q114 Y144S106-Y110 VanDerWaalsContact O-CB 3.24Å; S106-Y110 WeakPolarHBondContact O-CB 3.46Å; S106-Y110 PolarHBondContact O-N 2.7Å; H107-Y110 PolarHBondContact O-N 2.68Å; W108-Y110 PolarHBondContact O-N 2.68Å; Y110-R113 WeakPolarHBondContact O-CB 2.96Å; Y110-R113 PolarHBondContact O-N 3.17Å; Y110-Q114 HydrophobicContact CD1-CG 4.19Å; Y110-Q114 HydrophobicContact CE1-CG 3.82Å; Y110-Q114 VanDerWaalsContact O-CG 3.31Å; Y110-Q114 WeakPolarHBondContact O-CG 3.43Å; Y110-Q114 PolarHBondContact O-N 3.33Å; Y110-Y144 HydrophobicContact CE2-CE2 4.34Å; Y110-Y144 AromaticContact CZ-CZ 3.91Å; Y110-Y144 VanDerWaalsContact CZ-OH 3.29Å
111M87.3Confident84.9Confident37 Ų3758.1 Ų58.118%0.18230%0.302CS..Hα-helixtrans-64-41.4177.4-173.9-17967.200111.9M68 M71 H107 W108 R113 Q114 S115M68-M111 HydrophobicContact CB-SD 3.99Å; M68-M111 HydrophobicContact CE-CE 3.92Å; M68-M111 HydrophobicContact CE-SD 3.99Å; M68-M111 HydrophobicContact CG-CE 3.94Å; M68-M111 HydrophobicContact CG-SD 3.66Å; M68-M111 HydrophobicContact SD-CE 4.27Å; M71-M111 HydrophobicContact CE-CB 4.23Å; M71-M111 HydrophobicContact CE-CE 3.44Å; M71-M111 VanDerWaalsContact CE-CE 3.44Å; M71-M111 HydrophobicContact CE-CG 4.4Å; M71-M111 HydrophobicContact CE-SD 3.3Å; M71-M111 WeakPolarHBondContact CE-SD 3.42Å; M71-M111 HydrophobicContact SD-CB 3.69Å; M71-M111 HydrophobicContact SD-CE 4.37Å; M71-M111 HydrophobicContact SD-CG 4.13Å; M71-M111 HydrophobicContact SD-SD 3.63Å; M71-M111 VanDerWaalsContact SD-SD 3.63Å; H107-M111 WeakPolarHBondContact O-CB 3.33Å; H107-M111 PolarHBondContact O-N 2.9Å; W108-M111 PolarHBondContact O-N 2.72Å; M111-R113 PolarHBondContact O-N 3.25Å; M111-Q114 PolarHBondContact O-N 3.43Å; M111-Q114 VanDerWaalsContact O-N 3.15Å; M111-S115 PolarHBondContact O-N 3.48Å
112H87.7Confident82.5Confident68 Ų6861.2 Ų61.232%0.31531%0.31SS..Hα-helixtrans-59.4-47174.7-79.767.5000111.5W108 L109 Q114 S115 I116W108-H112 AromaticContact CD1-CE1 3.58Å; W108-H112 AromaticContact CD1-ND1 3.94Å; W108-H112 AromaticContact CD2-CE1 3.6Å; W108-H112 AromaticContact CD2-ND1 3.55Å; W108-H112 AromaticContact CE2-CE1 3.04Å; W108-H112 AromaticContact CE2-ND1 3.49Å; W108-H112 AromaticContact CE2-NE2 3.57Å; W108-H112 AromaticContact CG-CE1 3.91Å; W108-H112 AromaticContact CG-ND1 3.85Å; W108-H112 AromaticContact CZ2-CD2 3.95Å; W108-H112 AromaticContact CZ2-CE1 3.39Å; W108-H112 WeakPolarHBondContact CZ2-CE1 3.29Å; W108-H112 AromaticContact CZ2-ND1 3.91Å; W108-H112 AromaticContact CZ2-NE2 3.38Å; W108-H112 WeakPolarHBondContact CZ2-NE2 3.3Å; W108-H112 AromaticContact NE1-CE1 3.06Å; W108-H112 PolarHBondContact NE1-CE1 2.76Å; W108-H112 AromaticContact NE1-ND1 3.76Å; W108-H112 AromaticContact NE1-NE2 3.83Å; W108-H112 PolarHBondContact O-N 3.15Å; W108-H112 PolarHBondContact O-ND1 3.46Å; L109-H112 PolarHBondContact O-N 3.1Å; H112-Q114 VanDerWaalsContact C-N 3.28Å; H112-Q114 PolarHBondContact O-N 2.97Å; H112-S115 PolarHBondContact O-N 2.93Å; H112-I116 VanDerWaalsContact O-CG1 3.32Å; H112-I116 WeakPolarHBondContact O-CG1 3.49Å; H112-I116 PolarHBondContact O-N 3.2Å
113R86.4Confident80.3Confident17 Ų1762.7 Ų62.76%0.06432%0.318CS..Hα-helixtrans-56.1-43174.4179.2-146.9160.6-172-9.7111.6L109 Y110 M111 I116 K117 S211 I212L109-R113 WeakPolarHBondContact O-CB 3.48Å; L109-R113 PolarHBondContact O-N 3.11Å; Y110-R113 WeakPolarHBondContact O-CB 2.96Å; Y110-R113 PolarHBondContact O-N 3.17Å; M111-R113 PolarHBondContact O-N 3.25Å; R113-I116 PolarHBondContact O-N 3.15Å; R113-K117 PolarHBondContact O-N 2.93Å; R113-S211 PolarHBondContact NE-OG 2.95Å; R113-S211 VanDerWaalsContact NE-OG 3.09Å; R113-I212 HydrophobicContact CB-CD1 4.06Å; R113-I212 HydrophobicContact CB-CG1 3.94Å; R113-I212 HydrophobicContact CG-CG1 4.26Å
114Q82.4Confident77.8Confident46 Ų4666.6 Ų66.622%0.21534%0.339CS..Hα-helixtrans-66.3-42-179.5-69.6-69.793.900111.9Y110 M111 H112 K117 N118Y110-Q114 HydrophobicContact CD1-CG 4.19Å; Y110-Q114 HydrophobicContact CE1-CG 3.82Å; Y110-Q114 VanDerWaalsContact O-CG 3.31Å; Y110-Q114 WeakPolarHBondContact O-CG 3.43Å; Y110-Q114 PolarHBondContact O-N 3.33Å; M111-Q114 PolarHBondContact O-N 3.43Å; M111-Q114 VanDerWaalsContact O-N 3.15Å; H112-Q114 VanDerWaalsContact C-N 3.28Å; H112-Q114 PolarHBondContact O-N 2.97Å; Q114-K117 PolarHBondContact O-N 3.4Å; Q114-N118 PolarHBondContact O-N 2.62Å
115S84Confident74.8Confident68 Ų6866.7 Ų66.748%0.47635%0.351SS..Hα-helixtrans-60.4-44.1175.4-175.80000112M111 H112M111-S115 PolarHBondContact O-N 3.48Å; H112-S115 PolarHBondContact O-N 2.93Å
116I84.4Confident71.7Confident87 Ų8768.4 Ų68.445%0.44636%0.362SS..Hα-helixtrans-66.4-42.9178.1-63.4164000111.8H112 R113 I215H112-I116 VanDerWaalsContact O-CG1 3.32Å; H112-I116 WeakPolarHBondContact O-CG1 3.49Å; H112-I116 PolarHBondContact O-N 3.2Å; R113-I116 PolarHBondContact O-N 3.15Å; I116-I215 HydrophobicContact CG2-CD1 3.94Å; I116-I215 HydrophobicContact CG2-CG2 4.1Å
117K80.4Confident68.7Low80 Ų8076 Ų7635%0.34840%0.396SS..Hα-helixtrans-75-30.9-175.6-79.6-166.2172-174.40114R113 Q114 S211 I215R113-K117 PolarHBondContact O-N 2.93Å; Q114-K117 PolarHBondContact O-N 3.4Å; K117-S211 WeakPolarHBondContact CE-OG 3.34Å; K117-S211 PolarHBondContact NZ-OG 3.4Å; K117-I215 HydrophobicContact CD-CD1 4.38Å; K117-I215 HydrophobicContact CG-CD1 3.67Å
118N73.2Confident66.2Low46 Ų4679.2 Ų79.225%0.24642%0.42CS..  trans-132.471.1-172.6-59.7-69.3000110.8Q114 H120 H121Q114-N118 PolarHBondContact O-N 2.62Å; N118-H120 PolarHBondContact O-N 3.38Å; N118-H121 HydrophobicContact CB-CB 4.45Å; N118-H121 PolarHBondContact O-N 3.39Å
119P65.7Low63.5Low98 Ų9879.9 Ų79.964%0.63643%0.429SS*.THydrogen-bonded Turntrans-62.3-24.8-177.423.3-33.1000113.6
120H59.3Low60.7Low167 Ų16786.2 Ų86.277%0.77346%0.455SS*.THydrogen-bonded Turntrans-11142.6-178.8-60.9-67000112.6N118 D122N118-H120 PolarHBondContact O-N 3.38Å; H120-D122 PolarHBondContact O-N 3.39Å
121H53.6Low58.6Low56 Ų5688.1 Ų88.126%0.25947%0.469SS..  trans-57.193.7-171.2-165-43.9000113.3Q64 N118 L123Q64-H121 HydrophobicContact CG-CB 4.2Å; Q64-H121 PolarHBondContact NE2-CD2 3.34Å; N118-H121 HydrophobicContact CB-CB 4.45Å; N118-H121 PolarHBondContact O-N 3.39Å; H121-L123 WeakPolarHBondContact CE1-CD2 3.26Å; H121-L123 WeakPolarHBondContact ND1-CA 3.42Å; H121-L123 VanDerWaalsContact ND1-CD2 3.32Å; H121-L123 WeakPolarHBondContact ND1-CD2 3.29Å; H121-L123 WeakPolarHBondContact ND1-CG 3.36Å; H121-L123 PolarHBondContact ND1-N 3.33Å; H121-L123 PolarHBondContact O-N 3.04Å
122D46.8Very low56.9Low128 Ų12887.9 Ų87.968%0.68447%0.469SS*.  trans-67.484.1161.6-78.5-24.5000108H120 L124 G125H120-D122 PolarHBondContact O-N 3.39Å; D122-L124 PolarHBondContact O-N 2.98Å; D122-L124 VanDerWaalsContact O-N 3.09Å; D122-G125 PolarHBondContact O-N 3.27Å
123L51.2Low54.7Low55 Ų5589.9 Ų89.929%0.28849%0.491SS..THydrogen-bonded Turntrans-59.2-16176.9-76.3159000112.7S63 H121S63-L123 WeakPolarHBondContact O-CD1 3.13Å; H121-L123 WeakPolarHBondContact CE1-CD2 3.26Å; H121-L123 WeakPolarHBondContact ND1-CA 3.42Å; H121-L123 VanDerWaalsContact ND1-CD2 3.32Å; H121-L123 WeakPolarHBondContact ND1-CD2 3.29Å; H121-L123 WeakPolarHBondContact ND1-CG 3.36Å; H121-L123 PolarHBondContact ND1-N 3.33Å; H121-L123 PolarHBondContact O-N 3.04Å
124L41.2Very low52.9Low99 Ų9992.5 Ų92.552%0.51851%0.512SS..THydrogen-bonded Turntrans-85.2-19.9-174.9-61.8176.2000114.2N60 D122N60-L124 HydrophobicContact CB-CD2 4.47Å; N60-L124 WeakPolarHBondContact ND2-CD1 3.23Å; N60-L124 WeakPolarHBondContact OD1-CD1 3.26Å; N60-L124 WeakPolarHBondContact OD1-CD2 3.47Å; D122-L124 PolarHBondContact O-N 2.98Å; D122-L124 VanDerWaalsContact O-N 3.09Å
125G33Very low51.6Low58 Ų5891.5 Ų91.560%0.59851%0.509SS*.THydrogen-bonded Turntrans-127.9-17.4-166.800000116.2D122 K127D122-G125 PolarHBondContact O-N 3.27Å; G125-K127 PolarHBondContact O-N 3.5Å
126S31.8Very low50.4Low79 Ų7993 Ų9355%0.55252%0.519SS*.  trans-78.992.3174.4-81.40000109.5S128S126-S128 PolarHBondContact O-N 2.88Å
127K30.9Very low50Low160 Ų16091.7 Ų91.770%0.69651%0.513SS*.  trans-31.3117.1153.9-70-177.7177.2-177.70107.7G125 H129 K130G125-K127 PolarHBondContact O-N 3.5Å; K127-H129 PolarHBondContact O-N 2.52Å; K127-K130 PolarHBondContact O-N 3.12Å
128S39.9Very low50Low89 Ų8993 Ų9362%0.62253%0.53SS*.THydrogen-bonded Turntrans-49.23.8170.2-174.60000114.1S126S126-S128 PolarHBondContact O-N 2.88Å
129H35Very low50.3Low151 Ų15194.2 Ų94.270%0.69954%0.537SS*.THydrogen-bonded Turntrans-108.11.3-175.6-66.2-73.5000116.1K127K127-H129 PolarHBondContact O-N 2.52Å
130K33.2Very low51Low167 Ų16789.7 Ų89.773%0.72651%0.507SS*.SBendtrans-114-8.1179.1-75.8-168.8175.9-174.70117K127 S133K127-K130 PolarHBondContact O-N 3.12Å; K130-S133 PolarHBondContact O-OG 3.5Å
131N43.1Very low52Low95 Ų9586.2 Ų86.251%0.50849%0.491SS..SBendtrans-111.6-0.9179.5-78.9-24.9000115.2
132V51.4Low53.4Low31 Ų3187.5 Ų87.519%0.18850%0.499CS..SBendtrans-89.1-6.7172.5-170.80000111.9S134 T135V132-S134 PolarHBondContact O-N 3.05Å; V132-S134 VanDerWaalsContact O-N 3.09Å; V132-T135 PolarHBondContact O-N 3.29Å
133S40.8Very low55.2Low110 Ų11081.8 Ų81.877%0.76947%0.468SS*.THydrogen-bonded Turntrans-70.9-2179.757.10000114.9K130K130-S133 PolarHBondContact O-OG 3.5Å
134S49.9Very low56.5Low73 Ų7382.2 Ų82.251%0.5147%0.466SS..THydrogen-bonded Turntrans-1118174.7-165.60000113.3V132 S136V132-S134 PolarHBondContact O-N 3.05Å; V132-S134 VanDerWaalsContact O-N 3.09Å; S134-S136 PolarHBondContact O-N 2.64Å
135T54.6Low58.4Low24 Ų2480.8 Ų80.815%0.14746%0.462CS..  trans-95.497.5174.9-45.40000109V132 N137 L140 T207V132-T135 PolarHBondContact O-N 3.29Å; T135-N137 PolarHBondContact O-N 2.93Å; T135-L140 HydrophobicContact CG2-CB 3.65Å; T135-L140 HydrophobicContact CG2-CD1 3.51Å; T135-L140 HydrophobicContact CG2-CG 4.21Å; T135-T207 HydrophobicContact CG2-CG2 4.11Å
136S59.3Low61.1Low99 Ų9980 Ų8069%0.69245%0.447SS*.  trans-64.9-0.2-178.443.40000115.1S134S134-S136 PolarHBondContact O-N 2.64Å
137N75.3Confident63.6Low60 Ų6084.9 Ų84.932%0.32146%0.459SS..  trans-103115.7-177.4-71.8-35.5000110.9T135 L139 L140 H141 V203 T207T135-N137 PolarHBondContact O-N 2.93Å; N137-L139 PolarHBondContact O-N 3.47Å; N137-L140 HydrophobicContact CB-CB 4.35Å; N137-L140 HydrophobicContact CB-CD1 4.37Å; N137-L140 HydrophobicContact CB-CG 4.24Å; N137-L140 PolarHBondContact O-N 2.71Å; N137-L140 VanDerWaalsContact O-N 3.15Å; N137-H141 PolarHBondContact O-N 3.3Å; N137-H141 VanDerWaalsContact O-N 3.14Å; N137-V203 HydrophobicContact CB-CG1 4.23Å; N137-V203 WeakPolarHBondContact ND2-CG1 3.46Å; N137-T207 PolarHBondContact ND2-OG1 3.18Å
138P80.8Confident66.5Low108 Ų10880.7 Ų80.770%0.70145%0.454SS*.Hα-helixtrans-61.2-31.2-177.423.9-33.8000112.7H141 L142P138-H141 WeakPolarHBondContact O-CB 3.3Å; P138-H141 PolarHBondContact O-N 2.91Å; P138-L142 PolarHBondContact O-N 3.25Å
139L79.9Confident68.9Low72 Ų7278.6 Ų78.638%0.37743%0.433SS..Hα-helixtrans-64.5-43.4177.4-174.663.7000112.2N137 H141 L142 Y143 I200N137-L139 PolarHBondContact O-N 3.47Å; L139-H141 VanDerWaalsContact C-N 3.32Å; L139-L142 PolarHBondContact O-N 3.45Å; L139-Y143 WeakPolarHBondContact O-CB 3.3Å; L139-Y143 PolarHBondContact O-N 3.49Å; L139-I200 HydrophobicContact CD1-CG1 4.48Å; L139-I200 HydrophobicContact CD2-CG1 3.85Å; L139-I200 HydrophobicContact CG-CG1 4.07Å
140L79.9Confident71.5Confident3 Ų374 Ų742%0.01641%0.414CS..Hα-helixtrans-68.5-35.3175.7-70.6-173.5000111.7T135 N137 Y143 Y144 I200 V203 H204 T207T135-L140 HydrophobicContact CG2-CB 3.65Å; T135-L140 HydrophobicContact CG2-CD1 3.51Å; T135-L140 HydrophobicContact CG2-CG 4.21Å; N137-L140 HydrophobicContact CB-CB 4.35Å; N137-L140 HydrophobicContact CB-CD1 4.37Å; N137-L140 HydrophobicContact CB-CG 4.24Å; N137-L140 PolarHBondContact O-N 2.71Å; N137-L140 VanDerWaalsContact O-N 3.15Å; L140-Y143 PolarHBondContact O-N 3.38Å; L140-Y144 PolarHBondContact O-N 2.92Å; L140-Y144 VanDerWaalsContact O-N 3.09Å; L140-I200 HydrophobicContact CD2-CG2 4.01Å; L140-V203 HydrophobicContact CD1-CG1 3.76Å; L140-V203 HydrophobicContact CD2-CB 4.33Å; L140-V203 HydrophobicContact CD2-CG1 4.1Å; L140-V203 HydrophobicContact CG-CB 4.45Å; L140-V203 HydrophobicContact CG-CG1 3.68Å; L140-H204 WeakPolarHBondContact CD2-CD2 3.46Å; L140-H204 WeakPolarHBondContact CD2-NE2 3.45Å; L140-T207 HydrophobicContact CD1-CG2 4.03Å; L140-T207 WeakPolarHBondContact CD1-OG1 3.48Å
141H80.9Confident74.2Confident94 Ų9472.5 Ų72.544%0.43541%0.407SS..Hα-helixtrans-61.3-47173.8-177.2-88000110.8N137 P138 L139 Y143 Y144 T145N137-H141 PolarHBondContact O-N 3.3Å; N137-H141 VanDerWaalsContact O-N 3.14Å; P138-H141 WeakPolarHBondContact O-CB 3.3Å; P138-H141 PolarHBondContact O-N 2.91Å; L139-H141 VanDerWaalsContact C-N 3.32Å; H141-Y143 VanDerWaalsContact C-N 3.35Å; H141-Y143 PolarHBondContact O-N 3.24Å; H141-Y144 PolarHBondContact O-N 3.45Å; H141-T145 PolarHBondContact CE1-OG1 2.91Å; H141-T145 WeakPolarHBondContact O-CB 3.31Å; H141-T145 PolarHBondContact O-N 2.91Å; H141-T145 PolarHBondContact O-OG1 3.24Å
142L82.6Confident76.6Confident83 Ų8371.9 Ų71.944%0.43540%0.404SS..Hα-helixtrans-60.2-45.2174.7179.762.2000111.7P138 L139 Y144 T145 S146 F149P138-L142 PolarHBondContact O-N 3.25Å; L139-L142 PolarHBondContact O-N 3.45Å; L142-Y144 VanDerWaalsContact C-N 3.34Å; L142-Y144 PolarHBondContact O-N 3.45Å; L142-T145 PolarHBondContact O-N 3.28Å; L142-S146 PolarHBondContact O-N 3.32Å; L142-S146 VanDerWaalsContact O-N 3.08Å; L142-F149 HydrophobicContact CD2-CD2 4.46Å; L142-F149 HydrophobicContact CD2-CE1 4.47Å; L142-F149 HydrophobicContact CD2-CE2 4.3Å; L142-F149 HydrophobicContact CD2-CZ 4.29Å; L142-F149 HydrophobicContact CG-CD1 4.27Å; L142-F149 HydrophobicContact CG-CE1 4.4Å; L142-F149 HydrophobicContact CG-CG 4.34Å
143Y83.9Confident78.7Confident7 Ų770.8 Ų70.83%0.02740%0.397CS..Hα-helixtrans-56.3-43.6-179.2-172.4-103.1000113.4L139 L140 H141 F149 L150 M153 K197 I200 H204L139-Y143 WeakPolarHBondContact O-CB 3.3Å; L139-Y143 PolarHBondContact O-N 3.49Å; L140-Y143 PolarHBondContact O-N 3.38Å; H141-Y143 VanDerWaalsContact C-N 3.35Å; H141-Y143 PolarHBondContact O-N 3.24Å; Y143-F149 HydrophobicContact CD2-CD1 4.03Å; Y143-F149 AromaticContact CD2-CE1 3.87Å; Y143-F149 HydrophobicContact CD2-CE1 3.87Å; Y143-L150 HydrophobicContact CD1-CD1 4.01Å; Y143-L150 HydrophobicContact CD2-CD1 4.42Å; Y143-L150 HydrophobicContact CE1-CD1 3.38Å; Y143-L150 HydrophobicContact CE2-CD1 3.9Å; Y143-M153 HydrophobicContact CD2-CB 4.46Å; Y143-M153 HydrophobicContact CD2-CG 4.21Å; Y143-M153 HydrophobicContact CE2-CB 3.77Å; Y143-M153 HydrophobicContact CE2-CG 4Å; Y143-K197 PolarHBondContact OH-NZ 3.1Å; Y143-K197 VanDerWaalsContact OH-NZ 3.1Å; Y143-I200 HydrophobicContact CD1-CG2 4.21Å; Y143-I200 HydrophobicContact CD2-CD1 3.71Å; Y143-I200 HydrophobicContact CD2-CG2 3.97Å; Y143-I200 HydrophobicContact CE1-CG2 4.41Å; Y143-I200 HydrophobicContact CE2-CD1 4.15Å; Y143-I200 HydrophobicContact CE2-CG2 4.15Å; Y143-I200 HydrophobicContact CG-CD1 4.47Å; Y143-I200 HydrophobicContact CG-CG2 3.98Å; Y143-H204 AromaticContact CD1-CE1 3.94Å; Y143-H204 AromaticContact CE1-CE1 3.73Å
144Y79.3Confident81.1Confident64 Ų6467.5 Ų67.525%0.25137%0.373SS..Hα-helixtrans-91.7-21.5180-74.6-62.3000115Y110 L140 H141 L142 H204Y110-Y144 HydrophobicContact CE2-CE2 4.34Å; Y110-Y144 AromaticContact CZ-CZ 3.91Å; Y110-Y144 VanDerWaalsContact CZ-OH 3.29Å; L140-Y144 PolarHBondContact O-N 2.92Å; L140-Y144 VanDerWaalsContact O-N 3.09Å; H141-Y144 PolarHBondContact O-N 3.45Å; L142-Y144 VanDerWaalsContact C-N 3.34Å; L142-Y144 PolarHBondContact O-N 3.45Å; Y144-H204 AromaticContact CE2-CE1 3.74Å; Y144-H204 AromaticContact CE2-NE2 3.02Å; Y144-H204 WeakPolarHBondContact CE2-NE2 3.48Å; Y144-H204 AromaticContact CZ-CE1 3.55Å; Y144-H204 AromaticContact CZ-NE2 3.32Å; Y144-H204 VanDerWaalsContact CZ-NE2 3.32Å; Y144-H204 PolarHBondContact OH-CE1 3.25Å; Y144-H204 PolarHBondContact OH-NE2 3.02Å
145T81.3Confident83.2Confident70 Ų7069.9 Ų69.943%0.42938%0.375SS..Hα-helixtrans-80.5-38-179.3-57.70000111.5H141 L142H141-T145 PolarHBondContact CE1-OG1 2.91Å; H141-T145 WeakPolarHBondContact O-CB 3.31Å; H141-T145 PolarHBondContact O-N 2.91Å; H141-T145 PolarHBondContact O-OG1 3.24Å; L142-T145 PolarHBondContact O-N 3.28Å
146S88.9Confident85.2Confident41 Ų4168.9 Ų68.929%0.28737%0.369SS..  trans-96.8104.9-179177.80000111.1L142 A148 F149 L150L142-S146 PolarHBondContact O-N 3.32Å; L142-S146 VanDerWaalsContact O-N 3.08Å; S146-A148 PolarHBondContact O-N 2.92Å; S146-F149 PolarHBondContact O-N 3.31Å; S146-F149 VanDerWaalsContact O-N 3.12Å; S146-F149 WeakPolarHBondContact OG-CB 3.13Å; S146-F149 PolarHBondContact OG-N 3.24Å; S146-L150 PolarHBondContact O-N 3.2Å
147K85.5Confident86.9Confident182 Ų18264.4 Ų64.479%0.79134%0.337SS*.Hα-helixtrans-56.1-36.8173.8-66.7-175.8-178.9178.80112.3F151K147-F151 VanDerWaalsContact O-CB 3.31Å; K147-F151 WeakPolarHBondContact O-CB 3.4Å; K147-F151 PolarHBondContact O-N 2.96Å
148A90Very high87.9Confident72 Ų7263 Ų6360%0.59533%0.329SS*.Hα-helixtrans-66.5-41.9177.900000111.7S146 L152S146-A148 PolarHBondContact O-N 2.92Å; A148-L152 VanDerWaalsContact O-CB 3.29Å; A148-L152 WeakPolarHBondContact O-CB 3.4Å; A148-L152 PolarHBondContact O-N 3.23Å
149F90.8Very high88.7Confident44 Ų4458.3 Ų58.319%0.19330%0.299CS..Hα-helixtrans-68.5-43176.9-174-95.7000111.5L142 Y143 S146 F151 L152 M153 I200L142-F149 HydrophobicContact CD2-CD2 4.46Å; L142-F149 HydrophobicContact CD2-CE1 4.47Å; L142-F149 HydrophobicContact CD2-CE2 4.3Å; L142-F149 HydrophobicContact CD2-CZ 4.29Å; L142-F149 HydrophobicContact CG-CD1 4.27Å; L142-F149 HydrophobicContact CG-CE1 4.4Å; L142-F149 HydrophobicContact CG-CG 4.34Å; Y143-F149 HydrophobicContact CD2-CD1 4.03Å; Y143-F149 AromaticContact CD2-CE1 3.87Å; Y143-F149 HydrophobicContact CD2-CE1 3.87Å; S146-F149 PolarHBondContact O-N 3.31Å; S146-F149 VanDerWaalsContact O-N 3.12Å; S146-F149 WeakPolarHBondContact OG-CB 3.13Å; S146-F149 PolarHBondContact OG-N 3.24Å; F149-F151 PolarHBondContact O-N 3.03Å; F149-L152 PolarHBondContact O-N 3.35Å; F149-M153 HydrophobicContact CD1-CG 4.03Å; F149-M153 HydrophobicContact CE1-CG 3.77Å; F149-M153 HydrophobicContact CE1-SD 4.4Å; F149-M153 HydrophobicContact CE2-CE 4.08Å; F149-M153 HydrophobicContact CE2-CG 4.42Å; F149-M153 HydrophobicContact CE2-SD 4.37Å; F149-M153 HydrophobicContact CZ-CE 4.33Å; F149-M153 HydrophobicContact CZ-CG 3.97Å; F149-M153 HydrophobicContact CZ-SD 4.02Å; F149-M153 VanDerWaalsContact O-CG 3.28Å; F149-M153 WeakPolarHBondContact O-CG 3.44Å; F149-M153 PolarHBondContact O-N 3.11Å; F149-I200 HydrophobicContact CE1-CD1 4.03Å; F149-I200 HydrophobicContact CZ-CD1 4.33Å
150L89.5Confident89.5Confident56 Ų5655.5 Ų55.529%0.29328%0.284SS..Hα-helixtrans-55.4-51.5173.4179.664.2000111.2Y143 S146 M153 C154Y143-L150 HydrophobicContact CD1-CD1 4.01Å; Y143-L150 HydrophobicContact CD2-CD1 4.42Å; Y143-L150 HydrophobicContact CE1-CD1 3.38Å; Y143-L150 HydrophobicContact CE2-CD1 3.9Å; S146-L150 PolarHBondContact O-N 3.2Å; L150-M153 PolarHBondContact O-N 3.32Å; L150-C154 PolarHBondContact O-N 3.48Å; L150-C154 PolarHBondContact O-SG 3.28Å; L150-C154 VanDerWaalsContact O-SG 3.42Å
151F90.6Very high90.4Very high134 Ų13455.4 Ų55.459%0.58828%0.283SS*.Hα-helixtrans-60.4-47.1178.8179.8-96.2000111.5K147 F149 M153 C154 F155K147-F151 VanDerWaalsContact O-CB 3.31Å; K147-F151 WeakPolarHBondContact O-CB 3.4Å; K147-F151 PolarHBondContact O-N 2.96Å; F149-F151 PolarHBondContact O-N 3.03Å; F151-M153 VanDerWaalsContact C-N 3.33Å; F151-M153 PolarHBondContact O-N 3.11Å; F151-C154 PolarHBondContact O-N 3.27Å; F151-F155 HydrophobicContact CD1-CB 4.48Å; F151-F155 HydrophobicContact CE1-CB 4.16Å; F151-F155 HydrophobicContact CE1-CG 4.37Å; F151-F155 HydrophobicContact CZ-CB 4.26Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 HydrophobicContact CZ-CG 4.4Å; F151-F155 WeakPolarHBondContact O-CB 3.11Å; F151-F155 PolarHBondContact O-N 2.96Å
152L94Very high91.2Very high82 Ų8253.6 Ų53.643%0.42927%0.273SS..Hα-helixtrans-57.9-45.1178.1178.766.6000111.9A148 F149 G156 I193A148-L152 VanDerWaalsContact O-CB 3.29Å; A148-L152 WeakPolarHBondContact O-CB 3.4Å; A148-L152 PolarHBondContact O-N 3.23Å; F149-L152 PolarHBondContact O-N 3.35Å; L152-G156 WeakPolarHBondContact O-CA 3.31Å; L152-G156 PolarHBondContact O-N 2.92Å; L152-I193 HydrophobicContact CD1-CD1 4.13Å; L152-I193 HydrophobicContact CG-CD1 4.49Å
153M94.5Very high91.9Very high9 Ų949.6 Ų49.64%0.04425%0.252CS..Hα-helixtrans-66-46179.5-68-59.8100.200111.6Y143 F149 L150 F151 N157 I193 V196 K197 I200Y143-M153 HydrophobicContact CD2-CB 4.46Å; Y143-M153 HydrophobicContact CD2-CG 4.21Å; Y143-M153 HydrophobicContact CE2-CB 3.77Å; Y143-M153 HydrophobicContact CE2-CG 4Å; F149-M153 HydrophobicContact CD1-CG 4.03Å; F149-M153 HydrophobicContact CE1-CG 3.77Å; F149-M153 HydrophobicContact CE1-SD 4.4Å; F149-M153 HydrophobicContact CE2-CE 4.08Å; F149-M153 HydrophobicContact CE2-CG 4.42Å; F149-M153 HydrophobicContact CE2-SD 4.37Å; F149-M153 HydrophobicContact CZ-CE 4.33Å; F149-M153 HydrophobicContact CZ-CG 3.97Å; F149-M153 HydrophobicContact CZ-SD 4.02Å; F149-M153 VanDerWaalsContact O-CG 3.28Å; F149-M153 WeakPolarHBondContact O-CG 3.44Å; F149-M153 PolarHBondContact O-N 3.11Å; L150-M153 PolarHBondContact O-N 3.32Å; F151-M153 VanDerWaalsContact C-N 3.33Å; F151-M153 PolarHBondContact O-N 3.11Å; M153-N157 WeakPolarHBondContact O-CB 3.32Å; M153-N157 PolarHBondContact O-N 3.36Å; M153-N157 VanDerWaalsContact O-N 3.11Å; M153-I193 HydrophobicContact CE-CG2 3.61Å; M153-I193 HydrophobicContact SD-CG2 4.01Å; M153-V196 HydrophobicContact SD-CB 4.27Å; M153-V196 HydrophobicContact SD-CG1 3.8Å; M153-K197 HydrophobicContact CB-CB 4.46Å; M153-K197 HydrophobicContact CB-CG 4.43Å; M153-K197 WeakPolarHBondContact O-CD 3.36Å; M153-I200 HydrophobicContact CG-CD1 4.36Å; M153-I200 HydrophobicContact SD-CD1 4.42Å
154C92.5Very high92.5Very high41 Ų4150.9 Ų50.928%0.27726%0.259SS..Hα-helixtrans-62.2-55.7175.8-67.80000111.5L150 F151 G156 N157 E158 K197L150-C154 PolarHBondContact O-N 3.48Å; L150-C154 PolarHBondContact O-SG 3.28Å; L150-C154 VanDerWaalsContact O-SG 3.42Å; F151-C154 PolarHBondContact O-N 3.27Å; C154-G156 VanDerWaalsContact C-N 3.34Å; C154-G156 PolarHBondContact O-N 3.39Å; C154-N157 PolarHBondContact O-N 3.32Å; C154-E158 WeakPolarHBondContact O-CG 3.5Å; C154-E158 PolarHBondContact O-N 3.04Å; C154-K197 PolarHBondContact SG-NZ 2.89Å
155F94Very high93.4Very high123 Ų12348 Ų4854%0.53925%0.248SC..Hα-helixtrans-58.6-44.6-179.1179.4-97.7000112.1F151 N157 E158 A159F151-F155 HydrophobicContact CD1-CB 4.48Å; F151-F155 HydrophobicContact CE1-CB 4.16Å; F151-F155 HydrophobicContact CE1-CG 4.37Å; F151-F155 HydrophobicContact CZ-CB 4.26Å; F151-F155 HydrophobicContact CZ-CD2 4.33Å; F151-F155 HydrophobicContact CZ-CG 4.4Å; F151-F155 WeakPolarHBondContact O-CB 3.11Å; F151-F155 PolarHBondContact O-N 2.96Å; F155-N157 VanDerWaalsContact C-N 3.35Å; F155-N157 PolarHBondContact O-N 3.03Å; F155-E158 PolarHBondContact O-N 3.02Å; F155-A159 HydrophobicContact CE1-CB 4.37Å; F155-A159 WeakPolarHBondContact O-CB 3.49Å; F155-A159 PolarHBondContact O-N 3.1Å
156G95.6Very high94.1Very high3 Ų345.3 Ų45.33%0.03123%0.231CC..Hα-helixtrans-64.8-36.5178.500000113.1L152 C154 F160 S190L152-G156 WeakPolarHBondContact O-CA 3.31Å; L152-G156 PolarHBondContact O-N 2.92Å; C154-G156 VanDerWaalsContact C-N 3.34Å; C154-G156 PolarHBondContact O-N 3.39Å; G156-F160 PolarHBondContact O-N 2.94Å; G156-S190 WeakPolarHBondContact O-CB 3Å
157N96.3Very high94.4Very high5 Ų544 Ų443%0.02722%0.223CC..Hα-helixtrans-65.4-48.2173.5179.885.8000112.5M153 C154 F155 A159 F160 F161 K197M153-N157 WeakPolarHBondContact O-CB 3.32Å; M153-N157 PolarHBondContact O-N 3.36Å; M153-N157 VanDerWaalsContact O-N 3.11Å; C154-N157 PolarHBondContact O-N 3.32Å; F155-N157 VanDerWaalsContact C-N 3.35Å; F155-N157 PolarHBondContact O-N 3.03Å; N157-A159 VanDerWaalsContact C-N 3.34Å; N157-A159 PolarHBondContact O-N 3.32Å; N157-F160 WeakPolarHBondContact O-CB 3.3Å; N157-F160 PolarHBondContact O-N 3.46Å; N157-F161 VanDerWaalsContact O-CD2 3.31Å; N157-F161 WeakPolarHBondContact O-CD2 3.45Å; N157-F161 PolarHBondContact O-N 2.92Å; N157-F161 WeakPolarHBondContact OD1-CE2 3.32Å; N157-K197 HydrophobicContact CB-CB 4.49Å; N157-K197 HydrophobicContact CB-CD 3.26Å; N157-K197 HydrophobicContact CB-CG 4.49Å
158E96.1Very high94.9Very high31 Ų3139.1 Ų39.115%0.14520%0.203CC..Hα-helixtrans-63.7-42.6177.9-63-44.6119.300111Y42 T78 C154 F155 F160 F161 W162Y42-E158 PolarHBondContact OH-OE2 3.41Å; T78-E158 PolarHBondContact OG1-OE1 3.45Å; T78-E158 PolarHBondContact OG1-OE2 3.16Å; T78-E158 VanDerWaalsContact OG1-OE2 3.12Å; C154-E158 WeakPolarHBondContact O-CG 3.5Å; C154-E158 PolarHBondContact O-N 3.04Å; F155-E158 PolarHBondContact O-N 3.02Å; E158-F160 VanDerWaalsContact C-N 3.27Å; E158-F160 PolarHBondContact O-N 3.39Å; E158-F161 PolarHBondContact O-N 3.48Å; E158-W162 WeakPolarHBondContact O-CB 3.37Å; E158-W162 PolarHBondContact O-N 2.86Å
159A96.5Very high95.2Very high9 Ų939.4 Ų39.47%0.07419%0.191CC..Hα-helixtrans-59.7-37.117700000112F155 N157 A163F155-A159 HydrophobicContact CE1-CB 4.37Å; F155-A159 WeakPolarHBondContact O-CB 3.49Å; F155-A159 PolarHBondContact O-N 3.1Å; N157-A159 VanDerWaalsContact C-N 3.34Å; N157-A159 PolarHBondContact O-N 3.32Å; A159-A163 WeakPolarHBondContact O-CB 3.27Å; A159-A163 PolarHBondContact O-N 3.41Å
160F97.6Very high95.3Very high12 Ų1240.2 Ų40.25%0.05320%0.197CC..Hα-helixtrans-62.3-55.8177.1172.5-116.1000112.2F95 G156 N157 E158 A163 L164 A187 S190 F191 A194F95-F160 HydrophobicContact CE1-CE1 4.13Å; F95-F160 HydrophobicContact CZ-CE1 4.14Å; F95-F160 HydrophobicContact CZ-CZ 4.48Å; G156-F160 PolarHBondContact O-N 2.94Å; N157-F160 WeakPolarHBondContact O-CB 3.3Å; N157-F160 PolarHBondContact O-N 3.46Å; E158-F160 VanDerWaalsContact C-N 3.27Å; E158-F160 PolarHBondContact O-N 3.39Å; F160-A163 PolarHBondContact O-N 3.15Å; F160-L164 HydrophobicContact CD1-CD1 4.43Å; F160-L164 HydrophobicContact CD2-CD1 4.35Å; F160-L164 HydrophobicContact CD2-CG 4.37Å; F160-L164 HydrophobicContact CE1-CD1 3.79Å; F160-L164 HydrophobicContact CE2-CD1 3.69Å; F160-L164 HydrophobicContact CE2-CD2 4.38Å; F160-L164 HydrophobicContact CE2-CG 3.95Å; F160-L164 HydrophobicContact CZ-CD1 3.37Å; F160-L164 HydrophobicContact CZ-CG 4.16Å; F160-L164 WeakPolarHBondContact O-CG 3.17Å; F160-L164 PolarHBondContact O-N 3.36Å; F160-A187 HydrophobicContact CD2-CB 4.36Å; F160-A187 VanDerWaalsContact CD2-O 3.3Å; F160-A187 WeakPolarHBondContact CD2-O 3.26Å; F160-S190 WeakPolarHBondContact CA-OG 3.44Å; F160-S190 WeakPolarHBondContact CB-OG 3.47Å; F160-S190 PolarHBondContact N-OG 3.29Å; F160-F191 HydrophobicContact CD2-CB 3.8Å; F160-F191 HydrophobicContact CD2-CD2 4.21Å; F160-F191 AromaticContact CE1-CD2 3.93Å; F160-F191 HydrophobicContact CE1-CD2 3.93Å; F160-F191 HydrophobicContact CE1-CE2 4.48Å; F160-F191 HydrophobicContact CE2-CB 3.65Å; F160-F191 AromaticContact CE2-CD2 3.52Å; F160-F191 HydrophobicContact CE2-CD2 3.52Å; F160-F191 AromaticContact CE2-CG 3.98Å; F160-F191 HydrophobicContact CE2-CG 3.98Å; F160-F191 HydrophobicContact CZ-CB 4.38Å; F160-F191 AromaticContact CZ-CD2 3.34Å; F160-F191 HydrophobicContact CZ-CD2 3.34Å; F160-F191 AromaticContact CZ-CE2 3.97Å; F160-F191 HydrophobicContact CZ-CE2 3.97Å; F160-F191 HydrophobicContact CZ-CG 4.25Å; F160-A194 HydrophobicContact CB-CB 3.93Å; F160-A194 HydrophobicContact CD1-CB 3.67Å; F160-A194 HydrophobicContact CE1-CB 4.46Å; F160-A194 HydrophobicContact CG-CB 3.94Å
161F97.5Very high95.4Very high1 Ų139 Ų390%0.00419%0.193CC..Hα-helixtrans-68.4-39-178-65.3-59.1000111.9T78 L81 L82 L85 F95 F96 F99 N157 E158 L164 Y165T78-F161 HydrophobicContact CG2-CD2 4.39Å; L81-F161 HydrophobicContact CD2-CB 3.6Å; L81-F161 HydrophobicContact CG-CB 4.28Å; L82-F161 HydrophobicContact CD2-CD1 3.45Å; L82-F161 VanDerWaalsContact CD2-CD1 3.45Å; L82-F161 HydrophobicContact CD2-CD2 4.24Å; L82-F161 HydrophobicContact CD2-CE1 3.33Å; L82-F161 HydrophobicContact CD2-CE2 4.13Å; L82-F161 HydrophobicContact CD2-CG 3.93Å; L82-F161 HydrophobicContact CD2-CZ 3.69Å; L85-F161 HydrophobicContact CD1-CB 3.94Å; L85-F161 HydrophobicContact CD1-CD1 3.71Å; L85-F161 HydrophobicContact CD1-CG 4.27Å; F95-F161 HydrophobicContact CE1-CE1 4.26Å; F96-F161 HydrophobicContact CD1-CD1 4.39Å; F96-F161 AromaticContact CD1-CE1 3.99Å; F96-F161 HydrophobicContact CD1-CE1 3.99Å; F96-F161 HydrophobicContact CE1-CD1 4.21Å; F96-F161 HydrophobicContact CE1-CE1 4.02Å; F99-F161 HydrophobicContact CB-CZ 4.39Å; F99-F161 HydrophobicContact CD1-CE2 4.14Å; F99-F161 AromaticContact CD1-CZ 3.59Å; F99-F161 HydrophobicContact CD1-CZ 3.59Å; F99-F161 HydrophobicContact CE1-CE2 4.44Å; F99-F161 AromaticContact CE1-CZ 3.95Å; F99-F161 HydrophobicContact CE1-CZ 3.95Å; F99-F161 HydrophobicContact CG-CZ 4.01Å; N157-F161 VanDerWaalsContact O-CD2 3.31Å; N157-F161 WeakPolarHBondContact O-CD2 3.45Å; N157-F161 PolarHBondContact O-N 2.92Å; N157-F161 WeakPolarHBondContact OD1-CE2 3.32Å; E158-F161 PolarHBondContact O-N 3.48Å; F161-L164 PolarHBondContact O-N 3.15Å; F161-Y165 PolarHBondContact O-N 2.84Å
162W97.4Very high95.3Very high56 Ų5633.1 Ų33.121%0.21217%0.169CC..Hα-helixtrans-63.5-44176-178.289.5000111.3A39 Y42 V43 E158 L164 Y165 V166 M183 L186A39-W162 HydrophobicContact CB-CZ2 4.16Å; A39-W162 PolarHBondContact O-NE1 3.23Å; Y42-W162 AromaticContact CD1-CD1 3.66Å; Y42-W162 HydrophobicContact CD1-CG 4.49Å; V43-W162 HydrophobicContact CG2-CD2 4.45Å; V43-W162 HydrophobicContact CG2-CZ2 4.09Å; E158-W162 WeakPolarHBondContact O-CB 3.37Å; E158-W162 PolarHBondContact O-N 2.86Å; W162-L164 PolarHBondContact O-N 3.17Å; W162-Y165 WeakPolarHBondContact O-CB 3.38Å; W162-Y165 PolarHBondContact O-N 3.19Å; W162-V166 HydrophobicContact CD2-CG2 4.02Å; W162-V166 HydrophobicContact CE3-CG2 4.26Å; W162-V166 HydrophobicContact CH2-CG2 4Å; W162-V166 HydrophobicContact CZ2-CG2 3.74Å; W162-V166 HydrophobicContact CZ3-CG2 4.24Å; W162-V166 WeakPolarHBondContact O-CG2 3.32Å; W162-V166 PolarHBondContact O-N 3.11Å; W162-M183 HydrophobicContact CH2-SD 4.35Å; W162-M183 HydrophobicContact CZ3-SD 3.89Å; W162-L186 HydrophobicContact CE3-CD2 4.42Å; W162-L186 HydrophobicContact CZ3-CD2 4.19Å
163A97.4Very high95.2Very high0 Ų033.9 Ų33.90%018%0.18CC..Hα-helixtrans-64.8-39.517700000112A159 F160 Y165 V166 A167 L186 A187A159-A163 WeakPolarHBondContact O-CB 3.27Å; A159-A163 PolarHBondContact O-N 3.41Å; F160-A163 PolarHBondContact O-N 3.15Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 3.32Å; A163-V166 PolarHBondContact O-N 2.89Å; A163-A167 WeakPolarHBondContact O-CB 3.39Å; A163-A167 PolarHBondContact O-N 3.08Å; A163-L186 HydrophobicContact CB-CB 4.08Å; A163-L186 HydrophobicContact CB-CD2 3.88Å; A163-L186 HydrophobicContact CB-CG 3.84Å; A163-A187 HydrophobicContact CB-CB 3.94Å
164L97Very high95Very high34 Ų3438.4 Ų38.418%0.17820%0.203CC..Hα-helixtrans-61.2-38.6173.4-77.4-178.8000112.8L85 Y89 F96 F160 F161 W162 H168 A187L85-L164 HydrophobicContact CD1-CB 4.39Å; L85-L164 HydrophobicContact CD2-CB 3.85Å; Y89-L164 PolarHBondContact OH-O 3.25Å; Y89-L164 VanDerWaalsContact OH-O 3.06Å; F96-L164 HydrophobicContact CE1-CD1 4.19Å; F96-L164 HydrophobicContact CZ-CD1 4.33Å; F160-L164 HydrophobicContact CD1-CD1 4.43Å; F160-L164 HydrophobicContact CD2-CD1 4.35Å; F160-L164 HydrophobicContact CD2-CG 4.37Å; F160-L164 HydrophobicContact CE1-CD1 3.79Å; F160-L164 HydrophobicContact CE2-CD1 3.69Å; F160-L164 HydrophobicContact CE2-CD2 4.38Å; F160-L164 HydrophobicContact CE2-CG 3.95Å; F160-L164 HydrophobicContact CZ-CD1 3.37Å; F160-L164 HydrophobicContact CZ-CG 4.16Å; F160-L164 WeakPolarHBondContact O-CG 3.17Å; F160-L164 PolarHBondContact O-N 3.36Å; F161-L164 PolarHBondContact O-N 3.15Å; W162-L164 PolarHBondContact O-N 3.17Å; L164-H168 PolarHBondContact O-N 2.94Å; L164-A187 HydrophobicContact CD2-CB 4.01Å; L164-A187 HydrophobicContact CG-CB 4.26Å
165Y97.6Very high94.7Very high3 Ų339.1 Ų39.11%0.01220%0.203CC..Hα-helixtrans-67.1-51.1177.8171.4-93.3000111M31 Y35 A38 A39 L81 F88 F161 W162 A163 A167 H168 F169M31-Y165 VanDerWaalsContact CA-OH 3.27Å; M31-Y165 WeakPolarHBondContact CA-OH 3.3Å; M31-Y165 HydrophobicContact CB-CE2 4.27Å; M31-Y165 HydrophobicContact CG-CE2 4.02Å; M31-Y165 PolarHBondContact O-OH 3.05Å; Y35-Y165 VanDerWaalsContact CA-OH 3.31Å; Y35-Y165 WeakPolarHBondContact CA-OH 3.26Å; A38-Y165 HydrophobicContact CB-CE1 4.24Å; A38-Y165 WeakPolarHBondContact CB-OH 3.42Å; A39-Y165 HydrophobicContact CB-CE1 4.32Å; L81-Y165 HydrophobicContact CD1-CD1 4.47Å; L81-Y165 HydrophobicContact CD1-CD2 3.81Å; L81-Y165 HydrophobicContact CD1-CG 3.71Å; F88-Y165 HydrophobicContact CD2-CD2 4.38Å; F88-Y165 AromaticContact CE2-CD2 3.7Å; F88-Y165 HydrophobicContact CE2-CD2 3.7Å; F88-Y165 AromaticContact CE2-CE2 3.62Å; F88-Y165 HydrophobicContact CE2-CE2 3.62Å; F88-Y165 HydrophobicContact CZ-CE2 4.26Å; F161-Y165 PolarHBondContact O-N 2.84Å; W162-Y165 WeakPolarHBondContact O-CB 3.38Å; W162-Y165 PolarHBondContact O-N 3.19Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 3.32Å; Y165-A167 VanDerWaalsContact C-N 3.34Å; Y165-A167 PolarHBondContact O-N 2.85Å; Y165-H168 WeakPolarHBondContact O-CB 3.41Å; Y165-H168 PolarHBondContact O-N 3.21Å; Y165-F169 HydrophobicContact CD2-CE2 4.32Å; Y165-F169 HydrophobicContact CE1-CE2 4.41Å; Y165-F169 AromaticContact CE2-CE2 3.76Å; Y165-F169 HydrophobicContact CE2-CE2 3.76Å; Y165-F169 AromaticContact CZ-CE2 3.77Å; Y165-F169 WeakPolarHBondContact O-CD2 3.34Å
166V97.1Very high94.2Very high14 Ų1438.9 Ų38.99%0.08521%0.214CC..Hα-helixtrans-63.8-42.3178.21800000110.5A39 W162 A163 H168 F169 D170 M183A39-V166 HydrophobicContact CB-CG2 3.9Å; W162-V166 HydrophobicContact CD2-CG2 4.02Å; W162-V166 HydrophobicContact CE3-CG2 4.26Å; W162-V166 HydrophobicContact CH2-CG2 4Å; W162-V166 HydrophobicContact CZ2-CG2 3.74Å; W162-V166 HydrophobicContact CZ3-CG2 4.24Å; W162-V166 WeakPolarHBondContact O-CG2 3.32Å; W162-V166 PolarHBondContact O-N 3.11Å; A163-V166 PolarHBondContact O-N 2.89Å; V166-H168 PolarHBondContact O-N 3.48Å; V166-F169 PolarHBondContact O-N 3.44Å; V166-D170 CarbonylContact O-C 3.59Å; V166-D170 PolarHBondContact O-N 2.81Å; V166-M183 HydrophobicContact CB-CG 4.34Å; V166-M183 HydrophobicContact CB-SD 4.23Å; V166-M183 HydrophobicContact CG1-CG 3.84Å; V166-M183 HydrophobicContact CG1-SD 3.93Å
167A95.8Very high93.8Very high14 Ų1446.2 Ų46.212%0.11625%0.251CS..Hα-helixtrans-62.5-24179.800000114.2A163 Y165 F169 P171 M183A163-A167 WeakPolarHBondContact O-CB 3.39Å; A163-A167 PolarHBondContact O-N 3.08Å; Y165-A167 VanDerWaalsContact C-N 3.34Å; Y165-A167 PolarHBondContact O-N 2.85Å; A167-F169 VanDerWaalsContact C-N 3.3Å; A167-P171 HydrophobicContact CB-CB 4.32Å; A167-P171 WeakPolarHBondContact O-CD 3.43Å; A167-M183 HydrophobicContact CB-CB 3.76Å
168H95.4Very high93.2Very high79 Ų7951 Ų5137%0.36628%0.276SS..Hα-helixtrans-62.6-38.8173.8-176.867.9000111.9F88 Y89 L164 Y165 V166F88-H168 AromaticContact CD1-NE2 3.77Å; F88-H168 HydrophobicContact CD2-CB 4.32Å; F88-H168 AromaticContact CD2-CD2 3.7Å; F88-H168 AromaticContact CD2-CG 3.94Å; F88-H168 AromaticContact CG-CD2 3.67Å; F88-H168 AromaticContact CG-NE2 3.7Å; Y89-H168 HydrophobicContact CE2-CB 4.34Å; Y89-H168 WeakPolarHBondContact OH-CB 3.49Å; L164-H168 PolarHBondContact O-N 2.94Å; Y165-H168 WeakPolarHBondContact O-CB 3.41Å; Y165-H168 PolarHBondContact O-N 3.21Å; V166-H168 PolarHBondContact O-N 3.48Å
169F95.2Very high92.7Very high77 Ų7757.7 Ų57.734%0.33831%0.307SS..Hα-helixtrans-97-44-176.6-62.8-82.8000113Y35 F88 Y165 V166 A167Y35-F169 HydrophobicContact CD1-CB 3.53Å; Y35-F169 HydrophobicContact CD1-CD1 4.08Å; Y35-F169 HydrophobicContact CD1-CD2 4.43Å; Y35-F169 AromaticContact CD1-CG 3.78Å; Y35-F169 HydrophobicContact CD1-CG 3.78Å; Y35-F169 HydrophobicContact CD2-CB 3.85Å; Y35-F169 HydrophobicContact CD2-CD2 4.35Å; Y35-F169 HydrophobicContact CD2-CG 4.3Å; Y35-F169 HydrophobicContact CE1-CB 3.87Å; Y35-F169 HydrophobicContact CE2-CB 4.18Å; Y35-F169 HydrophobicContact CG-CB 3.52Å; Y35-F169 HydrophobicContact CG-CD1 4.27Å; Y35-F169 AromaticContact CG-CD2 3.82Å; Y35-F169 HydrophobicContact CG-CD2 3.82Å; Y35-F169 AromaticContact CG-CG 3.62Å; Y35-F169 HydrophobicContact CG-CG 3.62Å; F88-F169 HydrophobicContact CD2-CE2 4.46Å; F88-F169 HydrophobicContact CE1-CZ 4.31Å; F88-F169 AromaticContact CE2-CE2 3.65Å; F88-F169 HydrophobicContact CE2-CE2 3.65Å; F88-F169 AromaticContact CE2-CZ 3.8Å; F88-F169 HydrophobicContact CE2-CZ 3.8Å; F88-F169 AromaticContact CZ-CE2 3.93Å; F88-F169 HydrophobicContact CZ-CE2 3.93Å; F88-F169 AromaticContact CZ-CZ 3.58Å; F88-F169 HydrophobicContact CZ-CZ 3.58Å; Y165-F169 HydrophobicContact CD2-CE2 4.32Å; Y165-F169 HydrophobicContact CE1-CE2 4.41Å; Y165-F169 AromaticContact CE2-CE2 3.76Å; Y165-F169 HydrophobicContact CE2-CE2 3.76Å; Y165-F169 AromaticContact CZ-CE2 3.77Å; Y165-F169 WeakPolarHBondContact O-CD2 3.34Å; V166-F169 PolarHBondContact O-N 3.44Å; A167-F169 VanDerWaalsContact C-N 3.3Å
170D93.4Very high92.3Very high61 Ų6160 Ų6033%0.32632%0.32SS..  trans-145.394.6-179.4-173.8-3.9000109Y35 V166 G172Y35-D170 HydrophobicContact CE2-CB 4.05Å; Y35-D170 WeakPolarHBondContact OH-CB 3.34Å; Y35-D170 PolarHBondContact OH-OD2 2.69Å; V166-D170 CarbonylContact O-C 3.59Å; V166-D170 PolarHBondContact O-N 2.81Å; D170-G172 PolarHBondContact O-N 3.49Å; D170-G172 WeakPolarHBondContact OD1-CA 3.46Å; D170-G172 PolarHBondContact OD1-N 2.98Å
171P91.2Very high92.1Very high32 Ų3265 Ų6521%0.20834%0.338CS..  trans-66.4-6.3177.719.8-23.5000113.7A167 R181 C182 M183A167-P171 HydrophobicContact CB-CB 4.32Å; A167-P171 WeakPolarHBondContact O-CD 3.43Å; P171-R181 HydrophobicContact CB-CB 3.97Å; P171-R181 VanDerWaalsContact CB-CD 3.44Å; P171-R181 HydrophobicContact CB-CG 4.39Å; P171-R181 VanDerWaalsContact CG-CD 3.47Å; P171-R181 VanDerWaalsContact O-CB 3.32Å; P171-R181 WeakPolarHBondContact O-CB 3.34Å; P171-C182 PolarHBondContact O-N 3.43Å; P171-M183 WeakPolarHBondContact O-CB 3.42Å; P171-M183 PolarHBondContact O-N 2.95Å
172G90.3Very high91.9Very high9 Ų967 Ų679%0.09335%0.352CS..  trans85.3-178.417200000113.8D170 R181D170-G172 PolarHBondContact O-N 3.49Å; D170-G172 WeakPolarHBondContact OD1-CA 3.46Å; D170-G172 PolarHBondContact OD1-N 2.98Å; G172-R181 PolarHBondContact O-NH1 3.23Å; G172-R181 VanDerWaalsContact O-NH1 3.09Å
173P90.4Very high91.7Very high99 Ų9966 Ų6664%0.64335%0.35SS*.SBendtrans-65.5153.2179.528.5-34.6000111C182P173-C182 PolarHBondContact O-N 3.39Å
174I90.1Very high91.5Very high104 Ų10469.1 Ų69.153%0.53337%0.369SS..EExtended strand (participates in β ladder)trans-73129.5174.7-59.6171.7000108P176 R181I174-P176 VanDerWaalsContact O-CD 3.31Å; I174-P176 WeakPolarHBondContact O-CD 3.42Å; I174-R181 HydrophobicContact CG1-CG 4.32Å
175I87.4Confident91.3Very high56 Ų5667.9 Ų67.929%0.28736%0.364SS..EExtended strand (participates in β ladder)trans-80112.9171.3-61.1172.7000107I177 L178 E179 V180 C182 A185I175-I177 PolarHBondContact O-N 3.09Å; I175-L178 PolarHBondContact O-N 3.05Å; I175-L178 VanDerWaalsContact O-N 3.1Å; I175-E179 PolarHBondContact O-N 3.03Å; I175-V180 PolarHBondContact N-O 3.02Å; I175-C182 HydrophobicContact CD1-CB 4.23Å; I175-C182 HydrophobicContact CG1-CB 4.27Å; I175-A185 HydrophobicContact CD1-CB 4.03Å
176P83.4Confident91.2Very high118 Ų11870.5 Ų70.577%0.76638%0.378SS*.THydrogen-bonded Turntrans-58.6-26.7-170-26.735.5000114.8I174I174-P176 VanDerWaalsContact O-CD 3.31Å; I174-P176 WeakPolarHBondContact O-CD 3.42Å
177I86.8Confident91.2Very high157 Ų15770.2 Ų70.281%0.80538%0.377SS*.THydrogen-bonded Turntrans-76.9-33-177.8-59.7170.6000112.1I175I175-I177 PolarHBondContact O-N 3.09Å
178L83.7Confident91.1Very high105 Ų10577.1 Ų77.155%0.5541%0.405SS..THydrogen-bonded Turntrans-107.3-12.7-172.9-67.4173.9000113.1I175 V180I175-L178 PolarHBondContact O-N 3.05Å; I175-L178 VanDerWaalsContact O-N 3.1Å; L178-V180 HydrophobicContact CB-CB 4.42Å; L178-V180 HydrophobicContact CB-CG2 4.47Å; L178-V180 WeakPolarHBondContact O-CG2 3.46Å; L178-V180 PolarHBondContact O-N 3.23Å
179E86.6Confident91.1Very high172 Ų17279 Ų7980%0.80442%0.417SS*.THydrogen-bonded Turntrans55.317.3-170.3-58.8-172.8170.800114I175I175-E179 PolarHBondContact O-N 3.03Å
180V87.7Confident91.2Very high57 Ų5775.6 Ų75.635%0.34540%0.403SS..EExtended strand (participates in β ladder)trans-108.4145.9177.1-175.60000109.8I175 L178 T184 A185I175-V180 PolarHBondContact N-O 3.02Å; L178-V180 HydrophobicContact CB-CB 4.42Å; L178-V180 HydrophobicContact CB-CG2 4.47Å; L178-V180 WeakPolarHBondContact O-CG2 3.46Å; L178-V180 PolarHBondContact O-N 3.23Å; V180-T184 HydrophobicContact CG1-CG2 3.99Å; V180-A185 HydrophobicContact CB-CB 4.4Å; V180-A185 HydrophobicContact CG1-CB 4.03Å
181R92.3Very high91.4Very high116 Ų11676.2 Ų76.244%0.43840%0.403SS..EExtended strand (participates in β ladder)trans-70.2140.6175.6-61.2-175.6169.8-98.96111.3P171 G172 I174 M183 T184 A185P171-R181 HydrophobicContact CB-CB 3.97Å; P171-R181 VanDerWaalsContact CB-CD 3.44Å; P171-R181 HydrophobicContact CB-CG 4.39Å; P171-R181 VanDerWaalsContact CG-CD 3.47Å; P171-R181 VanDerWaalsContact O-CB 3.32Å; P171-R181 WeakPolarHBondContact O-CB 3.34Å; G172-R181 PolarHBondContact O-NH1 3.23Å; G172-R181 VanDerWaalsContact O-NH1 3.09Å; I174-R181 HydrophobicContact CG1-CG 4.32Å; R181-M183 PolarHBondContact O-N 3.25Å; R181-T184 WeakPolarHBondContact O-CB 3.47Å; R181-T184 PolarHBondContact O-N 3.38Å; R181-A185 PolarHBondContact O-N 2.86Å
182C93Very high91.7Very high43 Ų4378.2 Ų78.229%0.29142%0.416SS..Hα-helixtrans-53.1-45.9-169-177.30000114.4P171 P173 I175 A185 L186P171-C182 PolarHBondContact O-N 3.43Å; P173-C182 PolarHBondContact O-N 3.39Å; I175-C182 HydrophobicContact CD1-CB 4.23Å; I175-C182 HydrophobicContact CG1-CB 4.27Å; C182-A185 PolarHBondContact O-N 3.29Å; C182-L186 PolarHBondContact O-N 3.33Å
183M94.3Very high92Very high36 Ų3679.6 Ų79.618%0.17742%0.421CS..Hα-helixtrans-71.9-34.6-179.4-61.7-64.213000112W162 V166 A167 P171 R181 L186 A187W162-M183 HydrophobicContact CH2-SD 4.35Å; W162-M183 HydrophobicContact CZ3-SD 3.89Å; V166-M183 HydrophobicContact CB-CG 4.34Å; V166-M183 HydrophobicContact CB-SD 4.23Å; V166-M183 HydrophobicContact CG1-CG 3.84Å; V166-M183 HydrophobicContact CG1-SD 3.93Å; A167-M183 HydrophobicContact CB-CB 3.76Å; P171-M183 WeakPolarHBondContact O-CB 3.42Å; P171-M183 PolarHBondContact O-N 2.95Å; R181-M183 PolarHBondContact O-N 3.25Å; M183-L186 PolarHBondContact O-N 3.3Å; M183-A187 WeakPolarHBondContact O-CB 3.39Å; M183-A187 PolarHBondContact O-N 2.92Å
184T92.6Very high92.3Very high65 Ų6574.9 Ų74.940%0.39939%0.39SS..Hα-helixtrans-65.8-41.1173.3-49.60000111.3V180 R181 A187 F188V180-T184 HydrophobicContact CG1-CG2 3.99Å; R181-T184 WeakPolarHBondContact O-CB 3.47Å; R181-T184 PolarHBondContact O-N 3.38Å; T184-A187 PolarHBondContact O-N 3.17Å; T184-F188 WeakPolarHBondContact O-CB 3.47Å; T184-F188 PolarHBondContact O-N 3.42Å
185A94.1Very high92.6Very high8 Ų873.7 Ų73.77%0.06638%0.384CS..Hα-helixtrans-63.4-43.9174.800000111.1I175 V180 R181 C182 F188 L189I175-A185 HydrophobicContact CD1-CB 4.03Å; V180-A185 HydrophobicContact CB-CB 4.4Å; V180-A185 HydrophobicContact CG1-CB 4.03Å; R181-A185 PolarHBondContact O-N 2.86Å; C182-A185 PolarHBondContact O-N 3.29Å; A185-F188 PolarHBondContact O-N 3.37Å; A185-L189 WeakPolarHBondContact O-CB 3.4Å; A185-L189 VanDerWaalsContact O-CG 3.26Å; A185-L189 WeakPolarHBondContact O-CG 3.05Å; A185-L189 PolarHBondContact O-N 2.89Å
186L95.5Very high92.9Very high58 Ų5874.4 Ų74.430%0.30439%0.391SS..Hα-helixtrans-60.6-45.8175.7-179.360.2000111.7W162 A163 C182 M183 F188 L189 S190W162-L186 HydrophobicContact CE3-CD2 4.42Å; W162-L186 HydrophobicContact CZ3-CD2 4.19Å; A163-L186 HydrophobicContact CB-CB 4.08Å; A163-L186 HydrophobicContact CB-CD2 3.88Å; A163-L186 HydrophobicContact CB-CG 3.84Å; C182-L186 PolarHBondContact O-N 3.33Å; M183-L186 PolarHBondContact O-N 3.3Å; L186-F188 PolarHBondContact O-N 3.32Å; L186-L189 PolarHBondContact O-N 2.9Å; L186-S190 VanDerWaalsContact O-CB 3.31Å; L186-S190 WeakPolarHBondContact O-CB 3.35Å; L186-S190 PolarHBondContact O-N 2.73Å; L186-S190 PolarHBondContact O-OG 3.45Å
187A96Very high93.5Very high8 Ų868.9 Ų68.97%0.06636%0.355CS..Hα-helixtrans-60.2-44.1175.400000111.5F160 A163 L164 M183 T184 S190 F191F160-A187 HydrophobicContact CD2-CB 4.36Å; F160-A187 VanDerWaalsContact CD2-O 3.3Å; F160-A187 WeakPolarHBondContact CD2-O 3.26Å; A163-A187 HydrophobicContact CB-CB 3.94Å; L164-A187 HydrophobicContact CD2-CB 4.01Å; L164-A187 HydrophobicContact CG-CB 4.26Å; M183-A187 WeakPolarHBondContact O-CB 3.39Å; M183-A187 PolarHBondContact O-N 2.92Å; T184-A187 PolarHBondContact O-N 3.17Å; A187-S190 WeakPolarHBondContact CA-OG 3.48Å; A187-S190 PolarHBondContact O-N 3.24Å; A187-S190 PolarHBondContact O-OG 3.08Å; A187-F191 VanDerWaalsContact O-CB 3.3Å; A187-F191 WeakPolarHBondContact O-CB 3.43Å; A187-F191 PolarHBondContact O-N 3.31Å
188F94.5Very high93.9Very high159 Ų15962.3 Ų62.370%0.69732%0.323SS*.Hα-helixtrans-65.3-42.2178.8-169.1-95.7000112.7T184 A185 L186 P192T184-F188 WeakPolarHBondContact O-CB 3.47Å; T184-F188 PolarHBondContact O-N 3.42Å; A185-F188 PolarHBondContact O-N 3.37Å; L186-F188 PolarHBondContact O-N 3.32Å; F188-P192 VanDerWaalsContact O-CD 3.25Å; F188-P192 WeakPolarHBondContact O-CD 3.46Å
189L95.6Very high94.4Very high120 Ų12059 Ų5963%0.62832%0.315SS*.Hα-helixtrans-67.9-34.2178.5-71.2172000112.8A185 L186A185-L189 WeakPolarHBondContact O-CB 3.4Å; A185-L189 VanDerWaalsContact O-CG 3.26Å; A185-L189 WeakPolarHBondContact O-CG 3.05Å; A185-L189 PolarHBondContact O-N 2.89Å; L186-L189 PolarHBondContact O-N 2.9Å
190S96.9Very high94.7Very high5 Ų550.9 Ų50.94%0.03528%0.277CS..Hα-helixtrans-87.8-19.5-178.555.30000113.7G156 F160 L186 A187 I193 A194G156-S190 WeakPolarHBondContact O-CB 3Å; F160-S190 WeakPolarHBondContact CA-OG 3.44Å; F160-S190 WeakPolarHBondContact CB-OG 3.47Å; F160-S190 PolarHBondContact N-OG 3.29Å; L186-S190 VanDerWaalsContact O-CB 3.31Å; L186-S190 WeakPolarHBondContact O-CB 3.35Å; L186-S190 PolarHBondContact O-N 2.73Å; L186-S190 PolarHBondContact O-OG 3.45Å; A187-S190 WeakPolarHBondContact CA-OG 3.48Å; A187-S190 PolarHBondContact O-N 3.24Å; A187-S190 PolarHBondContact O-OG 3.08Å; S190-I193 WeakPolarHBondContact O-CA 3.23Å; S190-I193 WeakPolarHBondContact O-CB 3.5Å; S190-I193 PolarHBondContact O-N 2.98Å; S190-A194 PolarHBondContact O-N 3.1Å
191F96.9Very high94.9Very high73 Ų7348.4 Ų48.432%0.3226%0.262SS..Hα-helixtrans-55.9-46.4-179.9176-117.4000114.3F95 F160 A187 I193 A194 L195F95-F191 HydrophobicContact CE2-CE2 4.22Å; F95-F191 AromaticContact CZ-CE2 3.98Å; F95-F191 HydrophobicContact CZ-CE2 3.98Å; F160-F191 HydrophobicContact CD2-CB 3.8Å; F160-F191 HydrophobicContact CD2-CD2 4.21Å; F160-F191 AromaticContact CE1-CD2 3.93Å; F160-F191 HydrophobicContact CE1-CD2 3.93Å; F160-F191 HydrophobicContact CE1-CE2 4.48Å; F160-F191 HydrophobicContact CE2-CB 3.65Å; F160-F191 AromaticContact CE2-CD2 3.52Å; F160-F191 HydrophobicContact CE2-CD2 3.52Å; F160-F191 AromaticContact CE2-CG 3.98Å; F160-F191 HydrophobicContact CE2-CG 3.98Å; F160-F191 HydrophobicContact CZ-CB 4.38Å; F160-F191 AromaticContact CZ-CD2 3.34Å; F160-F191 HydrophobicContact CZ-CD2 3.34Å; F160-F191 AromaticContact CZ-CE2 3.97Å; F160-F191 HydrophobicContact CZ-CE2 3.97Å; F160-F191 HydrophobicContact CZ-CG 4.25Å; A187-F191 VanDerWaalsContact O-CB 3.3Å; A187-F191 WeakPolarHBondContact O-CB 3.43Å; A187-F191 PolarHBondContact O-N 3.31Å; F191-I193 PolarHBondContact O-N 3.12Å; F191-A194 PolarHBondContact O-N 3.34Å; F191-L195 HydrophobicContact CD1-CD1 4.14Å; F191-L195 HydrophobicContact CD2-CG 4.28Å; F191-L195 HydrophobicContact CE1-CD1 3.57Å; F191-L195 HydrophobicContact CE1-CG 4.23Å; F191-L195 HydrophobicContact CE2-CD1 4.12Å; F191-L195 HydrophobicContact CE2-CD2 3.95Å; F191-L195 HydrophobicContact CE2-CG 3.87Å; F191-L195 HydrophobicContact CZ-CD1 3.58Å; F191-L195 HydrophobicContact CZ-CD2 3.97Å; F191-L195 HydrophobicContact CZ-CG 3.86Å; F191-L195 PolarHBondContact O-N 2.96Å
192P97.2Very high95.1Very high74 Ų7445.7 Ų45.748%0.48126%0.258SS..Hα-helixtrans-58.3-36174.8-25.234.7000112.9F188 L195 V196F188-P192 VanDerWaalsContact O-CD 3.25Å; F188-P192 WeakPolarHBondContact O-CD 3.46Å; P192-L195 PolarHBondContact O-N 3.4Å; P192-V196 VanDerWaalsContact O-CG2 3.31Å; P192-V196 WeakPolarHBondContact O-CG2 3.37Å; P192-V196 PolarHBondContact O-N 3.24Å
193I96.8Very high95Very high39 Ų3945.4 Ų45.420%0.226%0.255CS..Hα-helixtrans-67.7-44.4177.7-60.7171000110.4L152 M153 S190 F191 L195 V196 K197L152-I193 HydrophobicContact CD1-CD1 4.13Å; L152-I193 HydrophobicContact CG-CD1 4.49Å; M153-I193 HydrophobicContact CE-CG2 3.61Å; M153-I193 HydrophobicContact SD-CG2 4.01Å; S190-I193 WeakPolarHBondContact O-CA 3.23Å; S190-I193 WeakPolarHBondContact O-CB 3.5Å; S190-I193 PolarHBondContact O-N 2.98Å; F191-I193 PolarHBondContact O-N 3.12Å; I193-L195 VanDerWaalsContact C-N 3.32Å; I193-L195 PolarHBondContact O-N 3.23Å; I193-V196 PolarHBondContact O-N 2.93Å; I193-K197 WeakPolarHBondContact O-CB 3.48Å; I193-K197 PolarHBondContact O-N 3.24Å
194A96.5Very high94.7Very high0 Ų043.8 Ų43.80%025%0.247CC..Hα-helixtrans-59.9-41.6175.700000111.9F160 S190 F191 K197 S198F160-A194 HydrophobicContact CB-CB 3.93Å; F160-A194 HydrophobicContact CD1-CB 3.67Å; F160-A194 HydrophobicContact CE1-CB 4.46Å; F160-A194 HydrophobicContact CG-CB 3.94Å; S190-A194 PolarHBondContact O-N 3.1Å; F191-A194 PolarHBondContact O-N 3.34Å; A194-K197 PolarHBondContact O-N 2.92Å; A194-S198 WeakPolarHBondContact O-CB 3.3Å; A194-S198 PolarHBondContact O-N 3.31Å
195L96.2Very high94.7Very high78 Ų7843.1 Ų43.141%0.40824%0.24SC..Hα-helixtrans-62.6-46.2174.5-72.1179.9000112.4F99 F191 P192 I193 S198 G199F99-L195 HydrophobicContact CE2-CD2 4.37Å; F99-L195 HydrophobicContact CZ-CD2 4.17Å; F191-L195 HydrophobicContact CD1-CD1 4.14Å; F191-L195 HydrophobicContact CD2-CG 4.28Å; F191-L195 HydrophobicContact CE1-CD1 3.57Å; F191-L195 HydrophobicContact CE1-CG 4.23Å; F191-L195 HydrophobicContact CE2-CD1 4.12Å; F191-L195 HydrophobicContact CE2-CD2 3.95Å; F191-L195 HydrophobicContact CE2-CG 3.87Å; F191-L195 HydrophobicContact CZ-CD1 3.58Å; F191-L195 HydrophobicContact CZ-CD2 3.97Å; F191-L195 HydrophobicContact CZ-CG 3.86Å; F191-L195 PolarHBondContact O-N 2.96Å; P192-L195 PolarHBondContact O-N 3.4Å; I193-L195 VanDerWaalsContact C-N 3.32Å; I193-L195 PolarHBondContact O-N 3.23Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 3.47Å; L195-G199 PolarHBondContact O-N 2.88Å
196V95.3Very high94.7Very high72 Ų7246.6 Ų46.644%0.43626%0.257SS..Hα-helixtrans-62.6-44177.7171.90000110.8M153 P192 I193 S198 G199 I200M153-V196 HydrophobicContact SD-CB 4.27Å; M153-V196 HydrophobicContact SD-CG1 3.8Å; P192-V196 VanDerWaalsContact O-CG2 3.31Å; P192-V196 WeakPolarHBondContact O-CG2 3.37Å; P192-V196 PolarHBondContact O-N 3.24Å; I193-V196 PolarHBondContact O-N 2.93Å; V196-S198 VanDerWaalsContact C-N 3.34Å; V196-S198 PolarHBondContact O-N 2.93Å; V196-G199 PolarHBondContact O-N 3.45Å; V196-I200 HydrophobicContact CG1-CD1 4.09Å; V196-I200 WeakPolarHBondContact O-CG1 3.32Å; V196-I200 PolarHBondContact O-N 3.37Å
197K94.9Very high94.4Very high2 Ų244.8 Ų44.81%0.00925%0.249CC..Hα-helixtrans-60.4-43.9175.8-171.9-167.5178.367.20111.4Y143 M153 C154 N157 I193 A194 G199 I200 S201Y143-K197 PolarHBondContact OH-NZ 3.1Å; Y143-K197 VanDerWaalsContact OH-NZ 3.1Å; M153-K197 HydrophobicContact CB-CB 4.46Å; M153-K197 HydrophobicContact CB-CG 4.43Å; M153-K197 WeakPolarHBondContact O-CD 3.36Å; C154-K197 PolarHBondContact SG-NZ 2.89Å; N157-K197 HydrophobicContact CB-CB 4.49Å; N157-K197 HydrophobicContact CB-CD 3.26Å; N157-K197 HydrophobicContact CB-CG 4.49Å; I193-K197 WeakPolarHBondContact O-CB 3.48Å; I193-K197 PolarHBondContact O-N 3.24Å; A194-K197 PolarHBondContact O-N 2.92Å; K197-G199 VanDerWaalsContact C-N 3.32Å; K197-G199 PolarHBondContact O-N 3.45Å; K197-I200 CarbonylContact O-C 3.45Å; K197-I200 WeakPolarHBondContact O-CA 3.43Å; K197-I200 WeakPolarHBondContact O-CB 3.3Å; K197-I200 PolarHBondContact O-N 2.86Å; K197-I200 VanDerWaalsContact O-N 3.09Å; K197-S201 PolarHBondContact O-N 3.18Å; K197-S201 PolarHBondContact O-OG 3.28Å
198S94.8Very high94Very high19 Ų1944.4 Ų44.413%0.13325%0.245CC..Hα-helixtrans-58.5-44.5175.3-1660000111.6F99 L102 A194 L195 V196 I200 S201 V202F99-S198 VanDerWaalsContact CE1-CB 3.4Å; F99-S198 VanDerWaalsContact CZ-CB 3.49Å; L102-S198 WeakPolarHBondContact CD2-O 3.44Å; L102-S198 WeakPolarHBondContact CD2-OG 3.35Å; A194-S198 WeakPolarHBondContact O-CB 3.3Å; A194-S198 PolarHBondContact O-N 3.31Å; L195-S198 WeakPolarHBondContact O-CB 3.44Å; L195-S198 PolarHBondContact O-N 3.47Å; V196-S198 VanDerWaalsContact C-N 3.34Å; V196-S198 PolarHBondContact O-N 2.93Å; S198-I200 VanDerWaalsContact C-N 3.33Å; S198-I200 PolarHBondContact O-N 3.05Å; S198-S201 WeakPolarHBondContact O-CA 3.38Å; S198-S201 WeakPolarHBondContact O-CB 3.31Å; S198-S201 PolarHBondContact O-N 2.94Å; S198-S201 VanDerWaalsContact O-N 3.07Å; S198-V202 PolarHBondContact O-N 2.83Å; S198-V202 VanDerWaalsContact O-N 3.08Å
199G94.6Very high93.9Very high36 Ų3639 Ų3937%0.37123%0.23SC..Hα-helixtrans-57.9-42.2172.200000113.1L195 V196 K197 S201 V202 V203L195-G199 PolarHBondContact O-N 2.88Å; V196-G199 PolarHBondContact O-N 3.45Å; K197-G199 VanDerWaalsContact C-N 3.32Å; K197-G199 PolarHBondContact O-N 3.45Å; G199-S201 VanDerWaalsContact C-N 3.32Å; G199-S201 PolarHBondContact O-N 2.79Å; G199-V202 WeakPolarHBondContact O-CB 3.48Å; G199-V202 PolarHBondContact O-N 3.06Å; G199-V203 WeakPolarHBondContact O-CG2 3.36Å; G199-V203 PolarHBondContact O-N 3.46Å
200I92.6Very high93.7Very high1 Ų139.3 Ų39.31%0.00523%0.226CC..Hα-helixtrans-62.1-39.8174.1-67.5166.3000111L139 L140 Y143 F149 M153 V196 K197 S198 V202 V203 H204L139-I200 HydrophobicContact CD1-CG1 4.48Å; L139-I200 HydrophobicContact CD2-CG1 3.85Å; L139-I200 HydrophobicContact CG-CG1 4.07Å; L140-I200 HydrophobicContact CD2-CG2 4.01Å; Y143-I200 HydrophobicContact CD1-CG2 4.21Å; Y143-I200 HydrophobicContact CD2-CD1 3.71Å; Y143-I200 HydrophobicContact CD2-CG2 3.97Å; Y143-I200 HydrophobicContact CE1-CG2 4.41Å; Y143-I200 HydrophobicContact CE2-CD1 4.15Å; Y143-I200 HydrophobicContact CE2-CG2 4.15Å; Y143-I200 HydrophobicContact CG-CD1 4.47Å; Y143-I200 HydrophobicContact CG-CG2 3.98Å; F149-I200 HydrophobicContact CE1-CD1 4.03Å; F149-I200 HydrophobicContact CZ-CD1 4.33Å; M153-I200 HydrophobicContact CG-CD1 4.36Å; M153-I200 HydrophobicContact SD-CD1 4.42Å; V196-I200 HydrophobicContact CG1-CD1 4.09Å; V196-I200 WeakPolarHBondContact O-CG1 3.32Å; V196-I200 PolarHBondContact O-N 3.37Å; K197-I200 CarbonylContact O-C 3.45Å; K197-I200 WeakPolarHBondContact O-CA 3.43Å; K197-I200 WeakPolarHBondContact O-CB 3.3Å; K197-I200 PolarHBondContact O-N 2.86Å; K197-I200 VanDerWaalsContact O-N 3.09Å; S198-I200 VanDerWaalsContact C-N 3.33Å; S198-I200 PolarHBondContact O-N 3.05Å; I200-V202 VanDerWaalsContact C-N 3.31Å; I200-V202 PolarHBondContact O-N 3.44Å; I200-V203 CarbonylContact O-C 3.59Å; I200-V203 PolarHBondContact O-N 3.3Å; I200-V203 VanDerWaalsContact O-N 3.09Å; I200-H204 PolarHBondContact O-N 3.35Å
201S93.4Very high93.3Very high4 Ų439.4 Ų39.43%0.02823%0.227CC..Hα-helixtrans-60.6-36.7174.9-64.70000112.4S106 K197 S198 G199 H204 L205S106-S201 WeakPolarHBondContact CB-O 3.44Å; K197-S201 PolarHBondContact O-N 3.18Å; K197-S201 PolarHBondContact O-OG 3.28Å; S198-S201 WeakPolarHBondContact O-CA 3.38Å; S198-S201 WeakPolarHBondContact O-CB 3.31Å; S198-S201 PolarHBondContact O-N 2.94Å; S198-S201 VanDerWaalsContact O-N 3.07Å; G199-S201 VanDerWaalsContact C-N 3.32Å; G199-S201 PolarHBondContact O-N 2.79Å; S201-H204 WeakPolarHBondContact O-CB 3.38Å; S201-H204 PolarHBondContact O-N 3.21Å; S201-L205 PolarHBondContact O-N 2.94Å
202V94.6Very high92.9Very high60 Ų6037.3 Ų37.336%0.36422%0.219SC..Hα-helixtrans-61.6-47170.9-178.60000111L102 S198 G199 I200 H204 L205 I206L102-V202 HydrophobicContact CD1-CB 4.46Å; L102-V202 HydrophobicContact CD1-CG2 3.81Å; L102-V202 HydrophobicContact CD2-CG2 3.56Å; L102-V202 HydrophobicContact CG-CG2 4.32Å; S198-V202 PolarHBondContact O-N 2.83Å; S198-V202 VanDerWaalsContact O-N 3.08Å; G199-V202 WeakPolarHBondContact O-CB 3.48Å; G199-V202 PolarHBondContact O-N 3.06Å; I200-V202 VanDerWaalsContact C-N 3.31Å; I200-V202 PolarHBondContact O-N 3.44Å; V202-H204 VanDerWaalsContact C-N 3.28Å; V202-H204 PolarHBondContact O-N 3.4Å; V202-L205 PolarHBondContact O-N 3.27Å; V202-I206 HydrophobicContact CG1-CD1 3.85Å; V202-I206 HydrophobicContact CG1-CG1 4.46Å; V202-I206 WeakPolarHBondContact O-CG1 3.36Å; V202-I206 PolarHBondContact O-N 3.2Å
203V91.9Very high92.6Very high36 Ų3636.6 Ų36.622%0.21822%0.219CC..Hα-helixtrans-63.6-37.1179.1-175.70000110.9N137 L140 G199 I200 T207N137-V203 HydrophobicContact CB-CG1 4.23Å; N137-V203 WeakPolarHBondContact ND2-CG1 3.46Å; L140-V203 HydrophobicContact CD1-CG1 3.76Å; L140-V203 HydrophobicContact CD2-CB 4.33Å; L140-V203 HydrophobicContact CD2-CG1 4.1Å; L140-V203 HydrophobicContact CG-CB 4.45Å; L140-V203 HydrophobicContact CG-CG1 3.68Å; G199-V203 WeakPolarHBondContact O-CG2 3.36Å; G199-V203 PolarHBondContact O-N 3.46Å; I200-V203 CarbonylContact O-C 3.59Å; I200-V203 PolarHBondContact O-N 3.3Å; I200-V203 VanDerWaalsContact O-N 3.09Å; V203-T207 WeakPolarHBondContact O-CB 3.2Å; V203-T207 PolarHBondContact O-N 2.82Å; V203-T207 PolarHBondContact O-OG1 2.92Å
204H88.7Confident92.2Very high3 Ų341.6 Ų41.61%0.01424%0.236CC..Hα-helixtrans-59.5-50.4171.5-90.3166000112.3L140 Y143 Y144 I200 S201 V202 I206 T207 A208L140-H204 WeakPolarHBondContact CD2-CD2 3.46Å; L140-H204 WeakPolarHBondContact CD2-NE2 3.45Å; Y143-H204 AromaticContact CD1-CE1 3.94Å; Y143-H204 AromaticContact CE1-CE1 3.73Å; Y144-H204 AromaticContact CE2-CE1 3.74Å; Y144-H204 AromaticContact CE2-NE2 3.02Å; Y144-H204 WeakPolarHBondContact CE2-NE2 3.48Å; Y144-H204 AromaticContact CZ-CE1 3.55Å; Y144-H204 AromaticContact CZ-NE2 3.32Å; Y144-H204 VanDerWaalsContact CZ-NE2 3.32Å; Y144-H204 PolarHBondContact OH-CE1 3.25Å; Y144-H204 PolarHBondContact OH-NE2 3.02Å; I200-H204 PolarHBondContact O-N 3.35Å; S201-H204 WeakPolarHBondContact O-CB 3.38Å; S201-H204 PolarHBondContact O-N 3.21Å; V202-H204 VanDerWaalsContact C-N 3.28Å; V202-H204 PolarHBondContact O-N 3.4Å; H204-I206 PolarHBondContact O-N 2.91Å; H204-T207 PolarHBondContact O-N 3.06Å; H204-A208 VanDerWaalsContact O-CB 3.27Å; H204-A208 WeakPolarHBondContact O-CB 3.49Å; H204-A208 PolarHBondContact O-N 3.14Å
205L92.5Very high91.6Very high50 Ų5043.5 Ų43.526%0.26225%0.245SC..Hα-helixtrans-58-50.2-179.6-176.665.9000111.1L102 L109 S201 V202 T207 A208 A209L102-L205 HydrophobicContact CD1-CD2 4.27Å; L109-L205 HydrophobicContact CB-CD1 4.17Å; L109-L205 HydrophobicContact CD2-CD1 3.74Å; S201-L205 PolarHBondContact O-N 2.94Å; V202-L205 PolarHBondContact O-N 3.27Å; L205-T207 PolarHBondContact O-N 3.49Å; L205-A208 PolarHBondContact O-N 3.46Å; L205-A209 WeakPolarHBondContact O-CB 3.34Å; L205-A209 PolarHBondContact O-N 3.43Å
206I92.9Very high91.2Very high81 Ų8144.5 Ų44.542%0.41525%0.251SS..Hα-helixtrans-63.1-43.4179.5-64.9170.2000111.2V202 H204 A209 K210V202-I206 HydrophobicContact CG1-CD1 3.85Å; V202-I206 HydrophobicContact CG1-CG1 4.46Å; V202-I206 WeakPolarHBondContact O-CG1 3.36Å; V202-I206 PolarHBondContact O-N 3.2Å; H204-I206 PolarHBondContact O-N 2.91Å; I206-A209 PolarHBondContact O-N 3.08Å; I206-K210 HydrophobicContact CG2-CD 4.07Å; I206-K210 HydrophobicContact CG2-CG 4.47Å; I206-K210 WeakPolarHBondContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CG 3.5Å; I206-K210 PolarHBondContact O-N 3.08Å
207T88.9Confident90.8Very high21 Ų2142.5 Ų42.513%0.12924%0.242CC..Hα-helixtrans-66.9-40-179.2-58.40000111.2T135 N137 L140 V203 H204 L205 S211T135-T207 HydrophobicContact CG2-CG2 4.11Å; N137-T207 PolarHBondContact ND2-OG1 3.18Å; L140-T207 HydrophobicContact CD1-CG2 4.03Å; L140-T207 WeakPolarHBondContact CD1-OG1 3.48Å; V203-T207 WeakPolarHBondContact O-CB 3.2Å; V203-T207 PolarHBondContact O-N 2.82Å; V203-T207 PolarHBondContact O-OG1 2.92Å; H204-T207 PolarHBondContact O-N 3.06Å; L205-T207 PolarHBondContact O-N 3.49Å; T207-S211 WeakPolarHBondContact O-CB 3.38Å; T207-S211 PolarHBondContact O-N 3.33Å
208A88.7Confident90.3Very high0 Ų049.5 Ų49.50%027%0.273CS..Hα-helixtrans-65.6-47.1175.800000111.3L109 H204 L205 K210 S211 I212L109-A208 HydrophobicContact CB-CB 4.23Å; L109-A208 HydrophobicContact CD2-CB 4.02Å; L109-A208 HydrophobicContact CG-CB 3.85Å; H204-A208 VanDerWaalsContact O-CB 3.27Å; H204-A208 WeakPolarHBondContact O-CB 3.49Å; H204-A208 PolarHBondContact O-N 3.14Å; L205-A208 PolarHBondContact O-N 3.46Å; A208-K210 PolarHBondContact O-N 3.01Å; A208-S211 PolarHBondContact O-N 3.27Å; A208-S211 VanDerWaalsContact O-N 3.1Å; A208-I212 WeakPolarHBondContact O-CG1 3.46Å; A208-I212 PolarHBondContact O-N 3.45Å
209A92.3Very high89.5Confident46 Ų4652.5 Ų52.538%0.3829%0.291SS..Hα-helixtrans-57.5-50.217600000112.1L109 L205 I206 S211 I212 A213L109-A209 HydrophobicContact CD2-CB 3.82Å; L205-A209 WeakPolarHBondContact O-CB 3.34Å; L205-A209 PolarHBondContact O-N 3.43Å; I206-A209 PolarHBondContact O-N 3.08Å; A209-S211 VanDerWaalsContact C-N 3.27Å; A209-S211 PolarHBondContact O-N 3.49Å; A209-I212 PolarHBondContact O-N 2.87Å; A209-A213 WeakPolarHBondContact O-CB 3.37Å; A209-A213 PolarHBondContact O-N 3.45Å
210K91.4Very high88.6Confident125 Ų12557 Ų5754%0.54331%0.305SS..Hα-helixtrans-59.7-37.8175.4-74.6179.1179.9179.30112I206 A208 R214I206-K210 HydrophobicContact CG2-CD 4.07Å; I206-K210 HydrophobicContact CG2-CG 4.47Å; I206-K210 WeakPolarHBondContact O-CB 3.28Å; I206-K210 WeakPolarHBondContact O-CG 3.5Å; I206-K210 PolarHBondContact O-N 3.08Å; A208-K210 PolarHBondContact O-N 3.01Å; K210-R214 WeakPolarHBondContact O-CB 3.41Å; K210-R214 WeakPolarHBondContact O-CG 3.35Å; K210-R214 PolarHBondContact O-N 3.14Å; K210-R214 VanDerWaalsContact O-N 3.12Å
211S87.5Confident87.3Confident8 Ų867.3 Ų67.36%0.05634%0.344CS..Hα-helixtrans-70.3-36.7179-176.60000112.8R113 K117 T207 A208 A209 I215R113-S211 PolarHBondContact NE-OG 2.95Å; R113-S211 VanDerWaalsContact NE-OG 3.09Å; K117-S211 WeakPolarHBondContact CE-OG 3.34Å; K117-S211 PolarHBondContact NZ-OG 3.4Å; T207-S211 WeakPolarHBondContact O-CB 3.38Å; T207-S211 PolarHBondContact O-N 3.33Å; A208-S211 PolarHBondContact O-N 3.27Å; A208-S211 VanDerWaalsContact O-N 3.1Å; A209-S211 VanDerWaalsContact C-N 3.27Å; A209-S211 PolarHBondContact O-N 3.49Å; S211-I215 WeakPolarHBondContact O-CG1 3.04Å; S211-I215 PolarHBondContact O-N 3.09Å
212I88.3Confident85.9Confident28 Ų2871.9 Ų71.914%0.14438%0.377CS..Hα-helixtrans-70-48.9177.5-68.8165.5000109.5L109 R113 A208 A209 R214 I215 D216L109-I212 HydrophobicContact CD1-CD1 3.39Å; L109-I212 HydrophobicContact CG-CD1 3.81Å; R113-I212 HydrophobicContact CB-CD1 4.06Å; R113-I212 HydrophobicContact CB-CG1 3.94Å; R113-I212 HydrophobicContact CG-CG1 4.26Å; A208-I212 WeakPolarHBondContact O-CG1 3.46Å; A208-I212 PolarHBondContact O-N 3.45Å; A209-I212 PolarHBondContact O-N 2.87Å; I212-R214 PolarHBondContact O-N 3.45Å; I212-R214 VanDerWaalsContact O-N 3.13Å; I212-I215 WeakPolarHBondContact O-CA 3.43Å; I212-I215 WeakPolarHBondContact O-CB 3.38Å; I212-I215 PolarHBondContact O-N 3.04Å; I212-D216 PolarHBondContact O-N 3.17Å
213A91.2Very high84Confident59 Ų5976.6 Ų76.649%0.48841%0.412SS..Hα-helixtrans-56.3-34.517600000113A209 A217A209-A213 WeakPolarHBondContact O-CB 3.37Å; A209-A213 PolarHBondContact O-N 3.45Å; A213-A217 WeakPolarHBondContact O-CB 3.43Å; A213-A217 PolarHBondContact O-N 3.07Å
214R88.3Confident83.6Confident145 Ų14578.6 Ų78.655%0.54742%0.422SS..Hα-helixtrans-68-32.5173.3-77.1172.1-172.2169.11.6113.4K210 I212 K218K210-R214 WeakPolarHBondContact O-CB 3.41Å; K210-R214 WeakPolarHBondContact O-CG 3.35Å; K210-R214 PolarHBondContact O-N 3.14Å; K210-R214 VanDerWaalsContact O-N 3.12Å; I212-R214 PolarHBondContact O-N 3.45Å; I212-R214 VanDerWaalsContact O-N 3.13Å; R214-K218 WeakPolarHBondContact O-CG 3.36Å
215I84.8Confident83.4Confident39 Ų3982.6 Ų82.620%0.244%0.443CS..Hα-helixtrans-69.6-46.6175.8-66.7163.1000108.8I116 K117 S211 I212 A217 K218 P219I116-I215 HydrophobicContact CG2-CD1 3.94Å; I116-I215 HydrophobicContact CG2-CG2 4.1Å; K117-I215 HydrophobicContact CD-CD1 4.38Å; K117-I215 HydrophobicContact CG-CD1 3.67Å; S211-I215 WeakPolarHBondContact O-CG1 3.04Å; S211-I215 PolarHBondContact O-N 3.09Å; I212-I215 WeakPolarHBondContact O-CA 3.43Å; I212-I215 WeakPolarHBondContact O-CB 3.38Å; I212-I215 PolarHBondContact O-N 3.04Å; I215-A217 VanDerWaalsContact C-N 3.26Å; I215-A217 PolarHBondContact O-N 2.7Å; I215-K218 WeakPolarHBondContact O-CB 3.43Å; I215-K218 PolarHBondContact O-N 3.06Å; I215-K218 VanDerWaalsContact O-N 3.1Å; I215-P219 WeakPolarHBondContact O-CD 3.31Å
216D86.7Confident82.9Confident100 Ų10084.4 Ų84.454%0.53545%0.453SS..Hα-helixtrans-64.4-30179.5-60.3-18.8000112.7I212 P219I212-D216 PolarHBondContact O-N 3.17Å; D216-P219 WeakPolarHBondContact O-CD 3.27Å
217A88.5Confident82.3Confident29 Ų2984.6 Ų84.624%0.2446%0.455CS..Hα-helixtrans-77-14.5176.300000114.3A213 I215 I220 R221A213-A217 WeakPolarHBondContact O-CB 3.43Å; A213-A217 PolarHBondContact O-N 3.07Å; I215-A217 VanDerWaalsContact C-N 3.26Å; I215-A217 PolarHBondContact O-N 2.7Å; A217-I220 PolarHBondContact O-N 2.89Å; A217-R221 WeakPolarHBondContact O-CG 3.47Å; A217-R221 PolarHBondContact O-N 3.05Å
218K83.4Confident81.9Confident150 Ų15088.6 Ų88.665%0.65248%0.476SS*.Hα-helixtrans-63.7-48.5-177.7-77.3179.8179.6-172.60113R214 I215 I220 R221 S222R214-K218 WeakPolarHBondContact O-CG 3.36Å; I215-K218 WeakPolarHBondContact O-CB 3.43Å; I215-K218 PolarHBondContact O-N 3.06Å; I215-K218 VanDerWaalsContact O-N 3.1Å; K218-I220 VanDerWaalsContact C-N 3.26Å; K218-I220 PolarHBondContact O-N 2.94Å; K218-R221 PolarHBondContact O-N 3.38Å; K218-S222 PolarHBondContact O-N 3.48Å; K218-S222 PolarHBondContact O-OG 3.34Å
219P78.7Confident81.4Confident81 Ų8194.5 Ų94.553%0.52651%0.507SS..Hα-helixtrans-62-33.1177.2-22.434.2000113I215 D216 R221 S222 S223I215-P219 WeakPolarHBondContact O-CD 3.31Å; D216-P219 WeakPolarHBondContact O-CD 3.27Å; P219-R221 VanDerWaalsContact C-N 3.31Å; P219-R221 PolarHBondContact O-N 3.17Å; P219-S222 WeakPolarHBondContact CA-OG 3.15Å; P219-S222 PolarHBondContact O-N 3.06Å; P219-S222 PolarHBondContact O-OG 3.29Å; P219-S223 PolarHBondContact O-OG 2.92Å
220I75.5Confident80.6Confident130 Ų13097.9 Ų97.967%0.66752%0.516SS*.Hα-helixtrans-69.4-30.5-179.6-58.6173.9000111.4A217 K218A217-I220 PolarHBondContact O-N 2.89Å; K218-I220 VanDerWaalsContact C-N 3.26Å; K218-I220 PolarHBondContact O-N 2.94Å
221R65.5Low79.8Confident218 Ų21895.8 Ų95.882%0.82351%0.514SS*.Hα-helixtrans-86.6-11.2-179.6-69.8178.8-179-163.6-2.2114.1A217 K218 P219A217-R221 WeakPolarHBondContact O-CG 3.47Å; A217-R221 PolarHBondContact O-N 3.05Å; K218-R221 PolarHBondContact O-N 3.38Å; P219-R221 VanDerWaalsContact C-N 3.31Å; P219-R221 PolarHBondContact O-N 3.17Å
222S63.8Low79.2Confident101 Ų101103.2 Ų103.271%0.70655%0.553SS**THydrogen-bonded Turntrans-96.91.9177.2530000113.7K218 P219K218-S222 PolarHBondContact O-N 3.48Å; K218-S222 PolarHBondContact O-OG 3.34Å; P219-S222 WeakPolarHBondContact CA-OG 3.15Å; P219-S222 PolarHBondContact O-N 3.06Å; P219-S222 PolarHBondContact O-OG 3.29Å
223S55.5Low78.3Confident158 Ų158110 Ų110100%1.10559%0.59SS**  trans-107.60173.4-58.90000110P219P219-S223 PolarHBondContact O-OG 2.92Å

Retrieved 223 of 223 residues in 1769.5 ms (Link to these results)

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