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14-3-3-like protein GF14-F

Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes.

AlphaFold DB , UniProt , Accession Q06967, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene GF14F, Length 260 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
1M71.7Confident89.8Confident148 Ų14872.4 Ų72.473%0.72941%0.407SS*.  0123.10-167.3175.5-77.600108.6E5 A6 E9M1-E5 WeakPolarHBondContact CA-OE2 3.47Å; M1-E5 HydrophobicContact CG-CB 3.57Å; M1-A6 HydrophobicContact CG-CB 4.16Å; M1-A6 HydrophobicContact SD-CB 3.72Å; M1-E9 WeakPolarHBondContact CE-OE1 3.44Å; M1-E9 WeakPolarHBondContact CE-OE2 3.41Å
2S84.4Confident90.5Very high45 Ų4567.4 Ų67.432%0.31538%0.38SS..  trans-73.8160.2172.875.70000110.6A4 E5 A6S2-A4 PolarHBondContact O-N 3.14Å; S2-A4 PolarHBondContact OG-N 3.33Å; S2-E5 PolarHBondContact N-OE2 3.12Å; S2-E5 PolarHBondContact O-N 3.13Å; S2-E5 WeakPolarHBondContact OG-CG 3.37Å; S2-E5 PolarHBondContact OG-N 3.48Å; S2-E5 VanDerWaalsContact OG-N 3.12Å; S2-A6 PolarHBondContact O-N 2.97Å
3P85.5Confident91.1Very high119 Ų11973.1 Ų73.177%0.77339%0.393SS*.Hα-helixtrans-56.5-31.9172.8-26.135.3000113.6S7P3-S7 WeakPolarHBondContact O-CB 3.19Å; P3-S7 PolarHBondContact O-N 2.71Å; P3-S7 VanDerWaalsContact O-N 3.11Å
4A87.1Confident91.6Very high37 Ų3772.6 Ų72.631%0.30639%0.388SS..Hα-helixtrans-71.3-42.4177.700000112.1S2 S7 R8 V40S2-A4 PolarHBondContact O-N 3.14Å; S2-A4 PolarHBondContact OG-N 3.33Å; A4-S7 PolarHBondContact O-N 3.49Å; A4-R8 PolarHBondContact O-N 2.97Å; A4-V40 HydrophobicContact CB-CG2 3.73Å
5E87.2Confident92.1Very high80 Ų8067.7 Ų67.737%0.37436%0.362SS..Hα-helixtrans-61.3-45.8174.3-72.8167.617100111.4M1 S2 S7 R8 E9 V40M1-E5 WeakPolarHBondContact CA-OE2 3.47Å; M1-E5 HydrophobicContact CG-CB 3.57Å; S2-E5 PolarHBondContact N-OE2 3.12Å; S2-E5 PolarHBondContact O-N 3.13Å; S2-E5 WeakPolarHBondContact OG-CG 3.37Å; S2-E5 PolarHBondContact OG-N 3.48Å; S2-E5 VanDerWaalsContact OG-N 3.12Å; E5-S7 VanDerWaalsContact C-N 3.32Å; E5-S7 PolarHBondContact O-N 3.14Å; E5-R8 WeakPolarHBondContact O-CB 3.46Å; E5-R8 PolarHBondContact O-N 2.84Å; E5-R8 VanDerWaalsContact O-N 3.15Å; E5-E9 PolarHBondContact O-N 2.72Å; E5-V40 HydrophobicContact CG-CG1 3.49Å; E5-V40 VanDerWaalsContact CG-CG1 3.49Å
6A89.8Confident92.5Very high43 Ų4367.1 Ų67.136%0.35536%0.355SS..Hα-helixtrans-61.1-41.2177.900000111.9M1 S2 E10M1-A6 HydrophobicContact CG-CB 4.16Å; M1-A6 HydrophobicContact SD-CB 3.72Å; S2-A6 PolarHBondContact O-N 2.97Å; A6-E10 WeakPolarHBondContact O-CB 3.44Å; A6-E10 PolarHBondContact O-N 3.38Å
7S93.7Very high92.9Very high52 Ų5267 Ų6736%0.36435%0.354SS..Hα-helixtrans-67.7-36175.9-170.30000112.4P3 A4 E5 E10 N11P3-S7 WeakPolarHBondContact O-CB 3.19Å; P3-S7 PolarHBondContact O-N 2.71Å; P3-S7 VanDerWaalsContact O-N 3.11Å; A4-S7 PolarHBondContact O-N 3.49Å; E5-S7 VanDerWaalsContact C-N 3.32Å; E5-S7 PolarHBondContact O-N 3.14Å; S7-E10 PolarHBondContact O-N 3.34Å; S7-N11 PolarHBondContact O-N 2.98Å; S7-N11 PolarHBondContact O-ND2 2.99Å; S7-N11 PolarHBondContact OG-ND2 3.37Å
8R96.5Very high93.2Very high21 Ų2163.6 Ų63.68%0.07934%0.337CS..Hα-helixtrans-62.9-49.1175.4-175176.7176159.7-16.8110.9A4 E5 E10 N11 V12 V34 T37 G41 E42 E47A4-R8 PolarHBondContact O-N 2.97Å; E5-R8 WeakPolarHBondContact O-CB 3.46Å; E5-R8 PolarHBondContact O-N 2.84Å; E5-R8 VanDerWaalsContact O-N 3.15Å; R8-E10 VanDerWaalsContact C-N 3.35Å; R8-E10 PolarHBondContact O-N 3.17Å; R8-N11 PolarHBondContact O-N 3.21Å; R8-V12 WeakPolarHBondContact O-CG2 3.39Å; R8-V12 PolarHBondContact O-N 3.05Å; R8-V34 HydrophobicContact CG-CG1 4.09Å; R8-V34 HydrophobicContact CG-CG2 4.46Å; R8-T37 WeakPolarHBondContact CD-OG1 3.45Å; R8-T37 PolarHBondContact NH1-O 2.91Å; R8-G41 PolarHBondContact NH1-O 2.99Å; R8-E42 PolarHBondContact NH2-O 3.14Å; R8-E47 IonicContact CZ-OE1 3.17Å; R8-E47 IonicContact CZ-OE2 2.82Å; R8-E47 IonicContact NE-OE1 2.91Å; R8-E47 PolarHBondContact NE-OE1 3.3Å; R8-E47 IonicContact NE-OE2 3.03Å; R8-E47 IonicContact NH2-OE1 3.28Å; R8-E47 PolarHBondContact NH2-OE1 3.18Å; R8-E47 IonicContact NH2-OE2 2.68Å; R8-E47 PolarHBondContact NH2-OE2 3.34Å
9E96.1Very high93.5Very high113 Ų11363.9 Ų63.953%0.52834%0.337SS..Hα-helixtrans-60.3-42.4177.2-71.7-175.8-179.400112.4M1 E5 V12 Y13M1-E9 WeakPolarHBondContact CE-OE1 3.44Å; M1-E9 WeakPolarHBondContact CE-OE2 3.41Å; E5-E9 PolarHBondContact O-N 2.72Å; E9-V12 PolarHBondContact O-N 3.29Å; E9-Y13 WeakPolarHBondContact O-CB 3.46Å; E9-Y13 PolarHBondContact O-N 3.5Å
10E97.4Very high93.7Very high125 Ų12568.6 Ų68.658%0.58436%0.357SS*.Hα-helixtrans-61-46.2175.7-175.4-179.3-16900111.6A6 S7 R8 V12 Y13 M14A6-E10 WeakPolarHBondContact O-CB 3.44Å; A6-E10 PolarHBondContact O-N 3.38Å; S7-E10 PolarHBondContact O-N 3.34Å; R8-E10 VanDerWaalsContact C-N 3.35Å; R8-E10 PolarHBondContact O-N 3.17Å; E10-V12 PolarHBondContact O-N 2.66Å; E10-Y13 PolarHBondContact O-N 3.08Å; E10-M14 WeakPolarHBondContact O-CB 2.88Å; E10-M14 VanDerWaalsContact O-CG 3.31Å; E10-M14 WeakPolarHBondContact O-CG 3.44Å; E10-M14 PolarHBondContact O-N 2.9Å
11N98.3Very high93.9Very high13 Ų1368.2 Ų68.27%0.0736%0.364CS..Hα-helixtrans-65.5-38177.9-74.1-63.8000112.1S7 R8 M14 A15 F30 K33 V34S7-N11 PolarHBondContact O-N 2.98Å; S7-N11 PolarHBondContact O-ND2 2.99Å; S7-N11 PolarHBondContact OG-ND2 3.37Å; R8-N11 PolarHBondContact O-N 3.21Å; N11-M14 PolarHBondContact O-N 3.31Å; N11-A15 WeakPolarHBondContact O-CB 3.36Å; N11-A15 PolarHBondContact O-N 3.16Å; N11-F30 HydrophobicContact CB-CB 4.42Å; N11-K33 WeakPolarHBondContact OD1-CD 3.36Å; N11-V34 HydrophobicContact CB-CG2 3.61Å
12V98.4Very high95.2Very high13 Ų1368 Ų688%0.07936%0.361CS..Hα-helixtrans-62.7-43.5174171.60000110.9R8 E9 E10 A15 K16 V34 E47 L50R8-V12 WeakPolarHBondContact O-CG2 3.39Å; R8-V12 PolarHBondContact O-N 3.05Å; E9-V12 PolarHBondContact O-N 3.29Å; E10-V12 PolarHBondContact O-N 2.66Å; V12-A15 PolarHBondContact O-N 2.8Å; V12-K16 HydrophobicContact CG1-CD 4.46Å; V12-K16 WeakPolarHBondContact O-CG 3.21Å; V12-K16 PolarHBondContact O-N 3.22Å; V12-V34 HydrophobicContact CG2-CG1 4.2Å; V12-V34 HydrophobicContact CG2-CG2 3.75Å; V12-E47 HydrophobicContact CG2-CG 3.76Å; V12-L50 HydrophobicContact CG1-CD1 3.96Å
13Y98.4Very high95.8Very high141 Ų14172.3 Ų72.355%0.55337%0.37SS*.Hα-helixtrans-61.6-46175.8179-108000111.8E9 E10 A15 K16 L17E9-Y13 WeakPolarHBondContact O-CB 3.46Å; E9-Y13 PolarHBondContact O-N 3.5Å; E10-Y13 PolarHBondContact O-N 3.08Å; Y13-A15 VanDerWaalsContact C-N 3.34Å; Y13-A15 PolarHBondContact O-N 3.47Å; Y13-K16 WeakPolarHBondContact O-CB 3.21Å; Y13-K16 PolarHBondContact O-N 2.96Å; Y13-L17 HydrophobicContact CD1-CD1 4.09Å; Y13-L17 HydrophobicContact CE1-CD1 3.53Å; Y13-L17 HydrophobicContact CE1-CG 4.15Å; Y13-L17 PolarHBondContact O-N 3.44Å
14M98.7Very high96.5Very high66 Ų6669 Ų6933%0.32534%0.343SS..Hα-helixtrans-64.2-36.6177.1-69.7-57.3-61.100112.6E10 N11 L17 A18 F30E10-M14 WeakPolarHBondContact O-CB 2.88Å; E10-M14 VanDerWaalsContact O-CG 3.31Å; E10-M14 WeakPolarHBondContact O-CG 3.44Å; E10-M14 PolarHBondContact O-N 2.9Å; N11-M14 PolarHBondContact O-N 3.31Å; M14-L17 PolarHBondContact O-N 2.73Å; M14-L17 HydrophobicContact SD-CD1 4.02Å; M14-A18 WeakPolarHBondContact O-CB 3.47Å; M14-A18 PolarHBondContact O-N 3.16Å; M14-F30 HydrophobicContact CB-CD1 3.66Å; M14-F30 HydrophobicContact CB-CD2 3.78Å; M14-F30 HydrophobicContact CB-CE1 3.62Å; M14-F30 HydrophobicContact CB-CE2 3.74Å; M14-F30 HydrophobicContact CB-CG 3.76Å; M14-F30 HydrophobicContact CB-CZ 3.68Å; M14-F30 HydrophobicContact CE-CE1 4.34Å; M14-F30 HydrophobicContact CE-CE2 4.24Å; M14-F30 HydrophobicContact CE-CZ 3.72Å; M14-F30 HydrophobicContact CG-CD1 4.42Å; M14-F30 HydrophobicContact CG-CE1 4.07Å; M14-F30 HydrophobicContact CG-CZ 4.25Å
15A98.7Very high97Very high0 Ų071.5 Ų71.50%035%0.348CS..Hα-helixtrans-62.4-41173.500000112N11 V12 Y13 A18 E19 M27 F30 M31N11-A15 WeakPolarHBondContact O-CB 3.36Å; N11-A15 PolarHBondContact O-N 3.16Å; V12-A15 PolarHBondContact O-N 2.8Å; Y13-A15 VanDerWaalsContact C-N 3.34Å; Y13-A15 PolarHBondContact O-N 3.47Å; A15-A18 PolarHBondContact O-N 3.28Å; A15-E19 WeakPolarHBondContact O-CB 3.46Å; A15-E19 PolarHBondContact O-N 3.37Å; A15-M27 HydrophobicContact CB-CG 4.09Å; A15-F30 HydrophobicContact CB-CB 4.03Å; A15-M31 HydrophobicContact CB-CG 3.8Å; A15-M31 HydrophobicContact CB-SD 3.53Å; A15-M31 VanDerWaalsContact CB-SD 3.53Å
16K98.6Very high97.5Very high58 Ų5870.1 Ų70.125%0.25234%0.341SS..Hα-helixtrans-64.5-38.2174.8-69.2173-179.7-1780112.3V12 Y13 Q20 E46 L50V12-K16 HydrophobicContact CG1-CD 4.46Å; V12-K16 WeakPolarHBondContact O-CG 3.21Å; V12-K16 PolarHBondContact O-N 3.22Å; Y13-K16 WeakPolarHBondContact O-CB 3.21Å; Y13-K16 PolarHBondContact O-N 2.96Å; K16-Q20 WeakPolarHBondContact O-CG 3.46Å; K16-Q20 PolarHBondContact O-N 3.36Å; K16-Q20 VanDerWaalsContact O-N 3.15Å; K16-E46 WeakPolarHBondContact CE-OE1 3.38Å; K16-E46 IonicContact NZ-OE1 2.7Å; K16-E46 PolarHBondContact NZ-OE1 3.19Å; K16-E46 IonicContact NZ-OE2 2.8Å; K16-E46 PolarHBondContact NZ-OE2 3.48Å; K16-L50 HydrophobicContact CG-CD1 4.03Å; K16-L50 HydrophobicContact CG-CD2 4.15Å
17L98.7Very high97.9Very high65 Ų6568 Ų6834%0.3433%0.325SS..Hα-helixtrans-66.3-42.8173.7-67.6-178.8000111.7Y13 M14 E19 Q20 A21Y13-L17 HydrophobicContact CD1-CD1 4.09Å; Y13-L17 HydrophobicContact CE1-CD1 3.53Å; Y13-L17 HydrophobicContact CE1-CG 4.15Å; Y13-L17 PolarHBondContact O-N 3.44Å; M14-L17 PolarHBondContact O-N 2.73Å; M14-L17 HydrophobicContact SD-CD1 4.02Å; L17-E19 VanDerWaalsContact C-N 3.34Å; L17-Q20 PolarHBondContact O-N 2.87Å; L17-A21 WeakPolarHBondContact O-CB 3.34Å; L17-A21 PolarHBondContact O-N 3.15Å; L17-A21 VanDerWaalsContact O-N 3.09Å
18A98.6Very high98.1Very high6 Ų666.3 Ų66.35%0.0531%0.312CS..Hα-helixtrans-63.7-39.3176.900000111.9M14 A15 A21 E22 R23 E26 M27 F30M14-A18 WeakPolarHBondContact O-CB 3.47Å; M14-A18 PolarHBondContact O-N 3.16Å; A15-A18 PolarHBondContact O-N 3.28Å; A18-A21 CarbonylContact O-C 3.48Å; A18-A21 PolarHBondContact O-N 2.85Å; A18-E22 PolarHBondContact O-N 3.04Å; A18-R23 PolarHBondContact O-N 3.48Å; A18-E26 HydrophobicContact CB-CB 4.3Å; A18-M27 HydrophobicContact CB-CB 3.98Å; A18-F30 HydrophobicContact CB-CD2 4.36Å; A18-F30 HydrophobicContact CB-CE2 4.36Å
19E98.3Very high98.2Very high69 Ų6970.8 Ų70.832%0.32233%0.334SS..Hα-helixtrans-59.2-49.4173.5-177.3-178.5-157.800111.7A15 L17 A21 E22 M27 L50A15-E19 WeakPolarHBondContact O-CB 3.46Å; A15-E19 PolarHBondContact O-N 3.37Å; L17-E19 VanDerWaalsContact C-N 3.34Å; E19-A21 PolarHBondContact O-N 3.22Å; E19-E22 PolarHBondContact O-N 2.96Å; E19-M27 HydrophobicContact CB-CE 3.94Å; E19-M27 HydrophobicContact CB-SD 3.94Å; E19-M27 HydrophobicContact CG-CE 4.25Å; E19-M27 HydrophobicContact CG-SD 4.39Å; E19-L50 WeakPolarHBondContact OE2-CD2 3.47Å
20Q98Very high98.3Very high157 Ų15766.8 Ų66.873%0.73432%0.315SS*.Hα-helixtrans-63.5-26.8178.4-71.7176.541.600113.2K16 L17K16-Q20 WeakPolarHBondContact O-CG 3.46Å; K16-Q20 PolarHBondContact O-N 3.36Å; K16-Q20 VanDerWaalsContact O-N 3.15Å; L17-Q20 PolarHBondContact O-N 2.87Å
21A98.1Very high98.4Very high61 Ų6160.9 Ų60.950%0.50429%0.287SS..THydrogen-bonded Turntrans-923.9175.700000113.4L17 A18 E19 R23L17-A21 WeakPolarHBondContact O-CB 3.34Å; L17-A21 PolarHBondContact O-N 3.15Å; L17-A21 VanDerWaalsContact O-N 3.09Å; A18-A21 CarbonylContact O-C 3.48Å; A18-A21 PolarHBondContact O-N 2.85Å; E19-A21 PolarHBondContact O-N 3.22Å; A21-R23 HydrophobicContact CB-CG 4.01Å; A21-R23 WeakPolarHBondContact O-CG 3.37Å; A21-R23 PolarHBondContact O-N 3.21Å; A21-R23 VanDerWaalsContact O-N 3.15Å
22E97.9Very high98.4Very high143 Ų14362.8 Ų62.867%0.66830%0.295SS*.THydrogen-bonded Turntrans54.427.4-175.1-56.8-175.616200113.9A18 E19 Y24A18-E22 PolarHBondContact O-N 3.04Å; E19-E22 PolarHBondContact O-N 2.96Å; E22-Y24 HydrophobicContact CB-CE2 4.04Å; E22-Y24 WeakPolarHBondContact O-CD2 3.35Å; E22-Y24 PolarHBondContact O-N 2.94Å
23R98.5Very high98.4Very high136 Ų13666.9 Ų66.951%0.51331%0.312SS..  trans-9466.8178.3-57.3-170.174.8-147.5-13.7110.5A18 A21 E25 E26 M27A18-R23 PolarHBondContact O-N 3.48Å; A21-R23 HydrophobicContact CB-CG 4.01Å; A21-R23 WeakPolarHBondContact O-CG 3.37Å; A21-R23 PolarHBondContact O-N 3.21Å; A21-R23 VanDerWaalsContact O-N 3.15Å; R23-E25 VanDerWaalsContact C-N 3.29Å; R23-E25 PolarHBondContact O-N 2.92Å; R23-E26 WeakPolarHBondContact CB-OE1 3.29Å; R23-E26 WeakPolarHBondContact CD-OE1 3.48Å; R23-E26 IonicContact CZ-OE1 3.35Å; R23-E26 IonicContact CZ-OE2 3.49Å; R23-E26 IonicContact NE-OE1 3.46Å; R23-E26 PolarHBondContact NE-OE1 3.31Å; R23-E26 IonicContact NH1-OE1 3.79Å; R23-E26 PolarHBondContact NH1-OE1 3.05Å; R23-E26 IonicContact NH1-OE2 2.97Å; R23-E26 PolarHBondContact NH1-OE2 3.31Å; R23-E26 IonicContact NH2-OE1 2.99Å; R23-E26 PolarHBondContact NH2-OE1 2.72Å; R23-E26 VanDerWaalsContact NH2-OE1 3.17Å; R23-E26 IonicContact NH2-OE2 3.92Å; R23-E26 PolarHBondContact NH2-OE2 3.05Å; R23-E26 PolarHBondContact O-N 3.32Å; R23-M27 PolarHBondContact O-N 3.02Å
24Y98.4Very high98.3Very high50 Ų5060.1 Ų60.120%0.19629%0.286CS..Hα-helixtrans-65.7-26.7-171-58-68.1000114.4E22 M27 V28 V53 N57 V58E22-Y24 HydrophobicContact CB-CE2 4.04Å; E22-Y24 WeakPolarHBondContact O-CD2 3.35Å; E22-Y24 PolarHBondContact O-N 2.94Å; Y24-M27 HydrophobicContact CD1-SD 4.02Å; Y24-M27 WeakPolarHBondContact O-CB 3.38Å; Y24-M27 PolarHBondContact O-N 3.45Å; Y24-V28 WeakPolarHBondContact O-CG2 3.45Å; Y24-V28 PolarHBondContact O-N 3.18Å; Y24-V53 HydrophobicContact CE1-CG1 4.41Å; Y24-N57 HydrophobicContact CD1-CB 3.61Å; Y24-N57 HydrophobicContact CD2-CB 3.45Å; Y24-N57 VanDerWaalsContact CD2-CB 3.45Å; Y24-N57 HydrophobicContact CE1-CB 3.93Å; Y24-N57 VanDerWaalsContact CE1-ND2 3.35Å; Y24-N57 WeakPolarHBondContact CE1-ND2 3.46Å; Y24-N57 HydrophobicContact CE2-CB 3.75Å; Y24-N57 HydrophobicContact CG-CB 3.35Å; Y24-N57 VanDerWaalsContact CZ-CG 3.47Å; Y24-V58 WeakPolarHBondContact O-CG2 3.48Å
25E98Very high98.2Very high90 Ų9057 Ų5742%0.42127%0.27SS..Hα-helixtrans-62.8-43.9173.2-68.979.1-176.700111.6R23 V28 E29 V58 R62R23-E25 VanDerWaalsContact C-N 3.29Å; R23-E25 PolarHBondContact O-N 2.92Å; E25-V28 WeakPolarHBondContact O-CB 3.49Å; E25-V28 PolarHBondContact O-N 2.98Å; E25-E29 PolarHBondContact O-N 3.47Å; E25-V58 HydrophobicContact CG-CG2 4.3Å; E25-R62 IonicContact OE1-CZ 2.68Å; E25-R62 VanDerWaalsContact OE1-CZ 3.28Å; E25-R62 IonicContact OE1-NH1 3.31Å; E25-R62 PolarHBondContact OE1-NH1 3.34Å; E25-R62 IonicContact OE1-NH2 3.7Å; E25-R62 PolarHBondContact OE1-NH2 3.38Å
26E98.3Very high98.1Very high50 Ų5061.6 Ų61.623%0.23429%0.29CS..Hα-helixtrans-68.9-37.3173.5-70.8174.1-56.500111.4A18 R23 V28 E29 F30A18-E26 HydrophobicContact CB-CB 4.3Å; R23-E26 WeakPolarHBondContact CB-OE1 3.29Å; R23-E26 WeakPolarHBondContact CD-OE1 3.48Å; R23-E26 IonicContact CZ-OE1 3.35Å; R23-E26 IonicContact CZ-OE2 3.49Å; R23-E26 IonicContact NE-OE1 3.46Å; R23-E26 PolarHBondContact NE-OE1 3.31Å; R23-E26 IonicContact NH1-OE1 3.79Å; R23-E26 PolarHBondContact NH1-OE1 3.05Å; R23-E26 IonicContact NH1-OE2 2.97Å; R23-E26 PolarHBondContact NH1-OE2 3.31Å; R23-E26 IonicContact NH2-OE1 2.99Å; R23-E26 PolarHBondContact NH2-OE1 2.72Å; R23-E26 VanDerWaalsContact NH2-OE1 3.17Å; R23-E26 IonicContact NH2-OE2 3.92Å; R23-E26 PolarHBondContact NH2-OE2 3.05Å; R23-E26 PolarHBondContact O-N 3.32Å; E26-V28 PolarHBondContact O-N 3.25Å; E26-E29 WeakPolarHBondContact O-CB 3.09Å; E26-E29 PolarHBondContact O-N 2.9Å; E26-F30 HydrophobicContact CB-CD2 4.42Å; E26-F30 HydrophobicContact CB-CE2 3.97Å; E26-F30 WeakPolarHBondContact O-CD2 3.4Å; E26-F30 PolarHBondContact O-N 3.45Å
27M98.4Very high97.9Very high0 Ų060 Ų600%029%0.285CS..Hα-helixtrans-56.8-41.4174.4-164.3-170.6-18000111.1A15 A18 E19 R23 Y24 M31 L50 V53 A54A15-M27 HydrophobicContact CB-CG 4.09Å; A18-M27 HydrophobicContact CB-CB 3.98Å; E19-M27 HydrophobicContact CB-CE 3.94Å; E19-M27 HydrophobicContact CB-SD 3.94Å; E19-M27 HydrophobicContact CG-CE 4.25Å; E19-M27 HydrophobicContact CG-SD 4.39Å; R23-M27 PolarHBondContact O-N 3.02Å; Y24-M27 HydrophobicContact CD1-SD 4.02Å; Y24-M27 WeakPolarHBondContact O-CB 3.38Å; Y24-M27 PolarHBondContact O-N 3.45Å; M27-M31 WeakPolarHBondContact O-CB 3.4Å; M27-M31 VanDerWaalsContact O-CG 3.28Å; M27-M31 WeakPolarHBondContact O-CG 3.41Å; M27-M31 PolarHBondContact O-N 3.44Å; M27-L50 HydrophobicContact CE-CB 3.94Å; M27-L50 HydrophobicContact CE-CD2 3.52Å; M27-L50 HydrophobicContact CE-CG 4.35Å; M27-L50 WeakPolarHBondContact CE-O 3.43Å; M27-V53 HydrophobicContact CE-CB 4.16Å; M27-V53 HydrophobicContact CE-CG1 4.08Å; M27-V53 HydrophobicContact SD-CG1 4.23Å; M27-A54 HydrophobicContact CB-CB 3.9Å; M27-A54 HydrophobicContact CE-CB 4.23Å; M27-A54 HydrophobicContact CG-CB 3.59Å; M27-A54 VanDerWaalsContact SD-CA 3.58Å; M27-A54 HydrophobicContact SD-CB 3.57Å; M27-A54 VanDerWaalsContact SD-CB 3.57Å
28V98.6Very high97.4Very high16 Ų1658.1 Ų58.110%0.09728%0.277CS..Hα-helixtrans-59.7-51.2172.2167.40000110Y24 E25 E26 F30 M31 E32 A54 Y55 V58Y24-V28 WeakPolarHBondContact O-CG2 3.45Å; Y24-V28 PolarHBondContact O-N 3.18Å; E25-V28 WeakPolarHBondContact O-CB 3.49Å; E25-V28 PolarHBondContact O-N 2.98Å; E26-V28 PolarHBondContact O-N 3.25Å; V28-F30 VanDerWaalsContact C-N 3.32Å; V28-F30 PolarHBondContact O-N 2.89Å; V28-M31 CarbonylContact O-C 3.59Å; V28-M31 PolarHBondContact O-N 2.66Å; V28-M31 VanDerWaalsContact O-N 3.11Å; V28-E32 HydrophobicContact CG1-CG 3.95Å; V28-E32 VanDerWaalsContact O-CG 3.22Å; V28-E32 WeakPolarHBondContact O-CG 3.35Å; V28-E32 PolarHBondContact O-N 3.04Å; V28-A54 HydrophobicContact CG2-CB 3.79Å; V28-Y55 HydrophobicContact CG1-CD1 4.47Å; V28-Y55 HydrophobicContact CG1-CD2 4.44Å; V28-Y55 HydrophobicContact CG1-CE1 3.86Å; V28-Y55 HydrophobicContact CG1-CE2 3.84Å; V28-Y55 HydrophobicContact CG2-CD1 4.19Å; V28-Y55 HydrophobicContact CG2-CD2 4.06Å; V28-Y55 HydrophobicContact CG2-CE1 4.4Å; V28-Y55 HydrophobicContact CG2-CE2 4.28Å; V28-Y55 HydrophobicContact CG2-CG 4.02Å; V28-V58 HydrophobicContact CG2-CB 4.4Å; V28-V58 HydrophobicContact CG2-CG2 3.85Å
29E98.4Very high96.9Very high115 Ų11564.3 Ų64.354%0.53731%0.309SS..Hα-helixtrans-55.9-41.8-179.5-67.5178.9-167.700113.7E25 E26 K33E25-E29 PolarHBondContact O-N 3.47Å; E26-E29 WeakPolarHBondContact O-CB 3.09Å; E26-E29 PolarHBondContact O-N 2.9Å; E29-K33 WeakPolarHBondContact O-CG 3.42Å
30F98.5Very high96.3Very high29 Ų2963.4 Ų63.413%0.12731%0.308CS..Hα-helixtrans-68.3-46.2175.3-63.9-56.3000111.6N11 M14 A15 A18 E26 V28 E32 K33 V34N11-F30 HydrophobicContact CB-CB 4.42Å; M14-F30 HydrophobicContact CB-CD1 3.66Å; M14-F30 HydrophobicContact CB-CD2 3.78Å; M14-F30 HydrophobicContact CB-CE1 3.62Å; M14-F30 HydrophobicContact CB-CE2 3.74Å; M14-F30 HydrophobicContact CB-CG 3.76Å; M14-F30 HydrophobicContact CB-CZ 3.68Å; M14-F30 HydrophobicContact CE-CE1 4.34Å; M14-F30 HydrophobicContact CE-CE2 4.24Å; M14-F30 HydrophobicContact CE-CZ 3.72Å; M14-F30 HydrophobicContact CG-CD1 4.42Å; M14-F30 HydrophobicContact CG-CE1 4.07Å; M14-F30 HydrophobicContact CG-CZ 4.25Å; A15-F30 HydrophobicContact CB-CB 4.03Å; A18-F30 HydrophobicContact CB-CD2 4.36Å; A18-F30 HydrophobicContact CB-CE2 4.36Å; E26-F30 HydrophobicContact CB-CD2 4.42Å; E26-F30 HydrophobicContact CB-CE2 3.97Å; E26-F30 WeakPolarHBondContact O-CD2 3.4Å; E26-F30 PolarHBondContact O-N 3.45Å; V28-F30 VanDerWaalsContact C-N 3.32Å; V28-F30 PolarHBondContact O-N 2.89Å; F30-E32 VanDerWaalsContact C-N 3.33Å; F30-E32 PolarHBondContact O-N 2.99Å; F30-K33 WeakPolarHBondContact O-CB 3.49Å; F30-K33 PolarHBondContact O-N 2.99Å; F30-K33 VanDerWaalsContact O-N 3.12Å; F30-V34 PolarHBondContact O-N 3.07Å
31M98.4Very high96Very high0 Ų057.3 Ų57.30%029%0.287CS..Hα-helixtrans-71.3-25.6-178.2-68.3-52-53.700113.3A15 M27 V28 K33 V34 A35 E47 L50 L51A15-M31 HydrophobicContact CB-CG 3.8Å; A15-M31 HydrophobicContact CB-SD 3.53Å; A15-M31 VanDerWaalsContact CB-SD 3.53Å; M27-M31 WeakPolarHBondContact O-CB 3.4Å; M27-M31 VanDerWaalsContact O-CG 3.28Å; M27-M31 WeakPolarHBondContact O-CG 3.41Å; M27-M31 PolarHBondContact O-N 3.44Å; V28-M31 CarbonylContact O-C 3.59Å; V28-M31 PolarHBondContact O-N 2.66Å; V28-M31 VanDerWaalsContact O-N 3.11Å; M31-K33 VanDerWaalsContact C-N 3.29Å; M31-K33 PolarHBondContact O-N 3.03Å; M31-V34 HydrophobicContact CE-CB 3.97Å; M31-V34 HydrophobicContact CE-CG1 3.93Å; M31-V34 HydrophobicContact CE-CG2 4.27Å; M31-V34 PolarHBondContact O-N 2.8Å; M31-V34 HydrophobicContact SD-CB 4.47Å; M31-V34 HydrophobicContact SD-CG2 4.19Å; M31-A35 VanDerWaalsContact O-CB 3.32Å; M31-A35 WeakPolarHBondContact O-CB 3.13Å; M31-A35 PolarHBondContact O-N 3.29Å; M31-E47 HydrophobicContact CE-CB 4.3Å; M31-E47 WeakPolarHBondContact CE-O 3.48Å; M31-L50 HydrophobicContact CE-CB 4Å; M31-L50 HydrophobicContact CG-CB 4.35Å; M31-L50 HydrophobicContact SD-CB 3.84Å; M31-L50 HydrophobicContact SD-CD1 4.46Å; M31-L51 HydrophobicContact CB-CB 4.32Å; M31-L51 HydrophobicContact CB-CD1 3.7Å; M31-L51 HydrophobicContact CE-CB 3.99Å
32E98.1Very high95.8Very high53 Ų5356.6 Ų56.625%0.24827%0.273CS..Hα-helixtrans-64.4-36169.7-64.2-153168.500111.7V28 F30 K36 Y55 L109V28-E32 HydrophobicContact CG1-CG 3.95Å; V28-E32 VanDerWaalsContact O-CG 3.22Å; V28-E32 WeakPolarHBondContact O-CG 3.35Å; V28-E32 PolarHBondContact O-N 3.04Å; F30-E32 VanDerWaalsContact C-N 3.33Å; F30-E32 PolarHBondContact O-N 2.99Å; E32-K36 WeakPolarHBondContact O-CD 3.29Å; E32-K36 VanDerWaalsContact O-CG 3.22Å; E32-K36 WeakPolarHBondContact O-CG 3.44Å; E32-K36 PolarHBondContact O-N 3.46Å; E32-K36 IonicContact OE2-NZ 4Å; E32-K36 PolarHBondContact OE2-NZ 3.26Å; E32-K36 VanDerWaalsContact OE2-NZ 3.15Å; E32-Y55 WeakPolarHBondContact CG-OH 3.44Å; E32-Y55 PolarHBondContact OE1-OH 2.87Å; E32-L109 HydrophobicContact CB-CD1 4.15Å; E32-L109 HydrophobicContact CG-CD1 3.82Å
33K97.5Very high95.8Very high99 Ų9950.1 Ų50.143%0.4324%0.243SC..Hα-helixtrans-67.6-44176.2-65.4164.6-176.2169.50110N11 E29 F30 M31 A35 K36 T37N11-K33 WeakPolarHBondContact OD1-CD 3.36Å; E29-K33 WeakPolarHBondContact O-CG 3.42Å; F30-K33 WeakPolarHBondContact O-CB 3.49Å; F30-K33 PolarHBondContact O-N 2.99Å; F30-K33 VanDerWaalsContact O-N 3.12Å; M31-K33 VanDerWaalsContact C-N 3.29Å; M31-K33 PolarHBondContact O-N 3.03Å; K33-A35 PolarHBondContact O-N 3.34Å; K33-K36 PolarHBondContact O-N 3.36Å; K33-T37 WeakPolarHBondContact O-CG2 3.48Å
34V97.9Very high95.7Very high0 Ų047.1 Ų47.10%024%0.24CC..Hα-helixtrans-58.4-48.3173.5176.30000110.7R8 N11 V12 F30 M31 K36 T37 L43 E47R8-V34 HydrophobicContact CG-CG1 4.09Å; R8-V34 HydrophobicContact CG-CG2 4.46Å; N11-V34 HydrophobicContact CB-CG2 3.61Å; V12-V34 HydrophobicContact CG2-CG1 4.2Å; V12-V34 HydrophobicContact CG2-CG2 3.75Å; F30-V34 PolarHBondContact O-N 3.07Å; M31-V34 HydrophobicContact CE-CB 3.97Å; M31-V34 HydrophobicContact CE-CG1 3.93Å; M31-V34 HydrophobicContact CE-CG2 4.27Å; M31-V34 PolarHBondContact O-N 2.8Å; M31-V34 HydrophobicContact SD-CB 4.47Å; M31-V34 HydrophobicContact SD-CG2 4.19Å; V34-K36 PolarHBondContact O-N 3.17Å; V34-K36 VanDerWaalsContact O-N 3.15Å; V34-T37 PolarHBondContact O-N 2.82Å; V34-T37 PolarHBondContact O-OG1 3.03Å; V34-L43 HydrophobicContact CG1-CG 4.5Å; V34-E47 HydrophobicContact CG1-CB 4.38Å; V34-E47 HydrophobicContact CG1-CG 4.35Å
35A97Very high95.6Very high0 Ų048.5 Ų48.50%025%0.253CS..Hα-helixtrans-60.9-24.9179.700000113.8M31 K33 T37 T38 L109 H113 L114M31-A35 VanDerWaalsContact O-CB 3.32Å; M31-A35 WeakPolarHBondContact O-CB 3.13Å; M31-A35 PolarHBondContact O-N 3.29Å; K33-A35 PolarHBondContact O-N 3.34Å; A35-T37 VanDerWaalsContact C-N 3.33Å; A35-T38 WeakPolarHBondContact O-CG2 3.49Å; A35-L109 HydrophobicContact CB-CD1 4.22Å; A35-L109 HydrophobicContact CB-CD2 4.23Å; A35-H113 WeakPolarHBondContact O-CB 3.43Å; A35-L114 HydrophobicContact CB-CD2 3.97Å; A35-L114 HydrophobicContact CB-CG 4.44Å
36K96.3Very high95.5Very high97 Ų9749.1 Ų49.142%0.42226%0.256SS..THydrogen-bonded Turntrans-84.1-4.3176.8-70.5163.6-168.6157.60113.6E32 K33 V34 L109E32-K36 WeakPolarHBondContact O-CD 3.29Å; E32-K36 VanDerWaalsContact O-CG 3.22Å; E32-K36 WeakPolarHBondContact O-CG 3.44Å; E32-K36 PolarHBondContact O-N 3.46Å; E32-K36 IonicContact OE2-NZ 4Å; E32-K36 PolarHBondContact OE2-NZ 3.26Å; E32-K36 VanDerWaalsContact OE2-NZ 3.15Å; K33-K36 PolarHBondContact O-N 3.36Å; V34-K36 PolarHBondContact O-N 3.17Å; V34-K36 VanDerWaalsContact O-N 3.15Å; K36-L109 HydrophobicContact CG-CD2 4.06Å
37T94Very high95.5Very high23 Ų2347.5 Ų47.514%0.14125%0.249CC..  trans-100.829.4178.963.50000113.1R8 K33 V34 A35 D39 V40R8-T37 WeakPolarHBondContact CD-OG1 3.45Å; R8-T37 PolarHBondContact NH1-O 2.91Å; K33-T37 WeakPolarHBondContact O-CG2 3.48Å; V34-T37 PolarHBondContact O-N 2.82Å; V34-T37 PolarHBondContact O-OG1 3.03Å; A35-T37 VanDerWaalsContact C-N 3.33Å; T37-D39 VanDerWaalsContact CA-OD1 3.28Å; T37-D39 WeakPolarHBondContact CA-OD1 3.41Å; T37-D39 PolarHBondContact O-N 2.68Å; T37-V40 VanDerWaalsContact O-CB 3.3Å; T37-V40 WeakPolarHBondContact O-CB 3.34Å; T37-V40 PolarHBondContact O-N 3.15Å
38T87.4Confident95.5Very high27 Ų2748.1 Ų48.117%0.16625%0.251CS..THydrogen-bonded Turntrans-68.4-13.6179.949.50000113.7A35 V40 G41 L43 H113 L114 S117A35-T38 WeakPolarHBondContact O-CG2 3.49Å; T38-V40 VanDerWaalsContact C-N 3.28Å; T38-G41 WeakPolarHBondContact CA-O 3.47Å; T38-G41 CarbonylContact O-C 3.48Å; T38-G41 PolarHBondContact O-N 3.27Å; T38-L43 HydrophobicContact CG2-CD1 3.63Å; T38-H113 HydrophobicContact CG2-CB 4.2Å; T38-L114 HydrophobicContact CG2-CD2 4.39Å; T38-S117 WeakPolarHBondContact CG2-OG 3.41Å
39D88.7Confident95.4Very high136 Ų13650.8 Ų50.873%0.72727%0.265SS*.THydrogen-bonded Turntrans-67.2-27.2168.163-49.6000112.9T37 G41T37-D39 VanDerWaalsContact CA-OD1 3.28Å; T37-D39 WeakPolarHBondContact CA-OD1 3.41Å; T37-D39 PolarHBondContact O-N 2.68Å; D39-G41 VanDerWaalsContact C-N 3.34Å
40V84.7Confident95.4Very high49 Ų4945.8 Ų45.830%0.29724%0.242SC..THydrogen-bonded Turntrans-75.2-28.5171.9-177.10000111A4 E5 T37 T38A4-V40 HydrophobicContact CB-CG2 3.73Å; E5-V40 HydrophobicContact CG-CG1 3.49Å; E5-V40 VanDerWaalsContact CG-CG1 3.49Å; T37-V40 VanDerWaalsContact O-CB 3.3Å; T37-V40 WeakPolarHBondContact O-CB 3.34Å; T37-V40 PolarHBondContact O-N 3.15Å; T38-V40 VanDerWaalsContact C-N 3.28Å
41G91.8Very high95.4Very high29 Ų2944.4 Ų44.430%0.29924%0.236SC..  trans154.8161.1177.700000112.3R8 T38 D39R8-G41 PolarHBondContact NH1-O 2.99Å; T38-G41 WeakPolarHBondContact CA-O 3.47Å; T38-G41 CarbonylContact O-C 3.48Å; T38-G41 PolarHBondContact O-N 3.27Å; D39-G41 VanDerWaalsContact C-N 3.34Å
42E95.3Very high95.4Very high47 Ų4746 Ų4622%0.2225%0.247CC..PPolyproline II helixtrans-53.9149.5173.2-169.6175.4162.600111.1R8 T44 T119 S123R8-E42 PolarHBondContact NH2-O 3.14Å; E42-T44 PolarHBondContact O-N 3.08Å; E42-T119 PolarHBondContact OE2-N 3.32Å; E42-T119 PolarHBondContact OE2-OG1 2.89Å; E42-S123 WeakPolarHBondContact OE1-CB 2.88Å; E42-S123 PolarHBondContact OE1-OG 2.76Å
43L97.4Very high95.4Very high6 Ų645.7 Ų45.73%0.03125%0.248CC..PPolyproline II helixtrans-64.3133.2174.4-79.965.4000109.9V34 T38 E47 R48 L51 L114V34-L43 HydrophobicContact CG1-CG 4.5Å; T38-L43 HydrophobicContact CG2-CD1 3.63Å; L43-E47 HydrophobicContact CB-CB 4.16Å; L43-E47 HydrophobicContact CD2-CB 4.38Å; L43-E47 HydrophobicContact CG-CB 4.22Å; L43-R48 HydrophobicContact CB-CB 4.42Å; L43-L51 HydrophobicContact CD2-CD2 4.3Å; L43-L114 HydrophobicContact CD1-CD2 3.61Å; L43-L114 HydrophobicContact CD2-CD2 3.7Å; L43-L114 HydrophobicContact CG-CD2 4.28Å
44T96.6Very high95.5Very high74 Ų7441 Ų4145%0.45423%0.228SC..PPolyproline II helixtrans-64.3164169630000110.6E42 E46 E47 R48E42-T44 PolarHBondContact O-N 3.08Å; T44-E46 PolarHBondContact O-N 3.42Å; T44-E47 WeakPolarHBondContact CB-OE2 3.41Å; T44-E47 WeakPolarHBondContact CG2-OE2 3.36Å; T44-E47 PolarHBondContact N-OE2 3.19Å; T44-E47 PolarHBondContact O-N 2.98Å; T44-E47 VanDerWaalsContact OG1-CD 3.27Å; T44-E47 VanDerWaalsContact OG1-CG 3.24Å; T44-E47 WeakPolarHBondContact OG1-CG 3.43Å; T44-E47 PolarHBondContact OG1-N 3.42Å; T44-E47 PolarHBondContact OG1-OE2 3.29Å; T44-R48 VanDerWaalsContact O-CB 3.28Å; T44-R48 WeakPolarHBondContact O-CB 3.03Å; T44-R48 PolarHBondContact O-N 3.48Å
45V95.5Very high95.5Very high78 Ų7841.1 Ų41.147%0.47323%0.229SC..Hα-helixtrans-55.3-41.8175.6170.80000111.5N49V45-N49 VanDerWaalsContact O-CB 3.3Å; V45-N49 WeakPolarHBondContact O-CB 3.45Å; V45-N49 PolarHBondContact O-N 3.49Å; V45-N49 PolarHBondContact O-ND2 3.26Å; V45-N49 PolarHBondContact O-OD1 2.75Å
46E97.1Very high95.5Very high103 Ų10348 Ų4848%0.48126%0.259SS..Hα-helixtrans-63.2-50178-174.3178.5-145.900111.5K16 T44 R48 N49 L50K16-E46 WeakPolarHBondContact CE-OE1 3.38Å; K16-E46 IonicContact NZ-OE1 2.7Å; K16-E46 PolarHBondContact NZ-OE1 3.19Å; K16-E46 IonicContact NZ-OE2 2.8Å; K16-E46 PolarHBondContact NZ-OE2 3.48Å; T44-E46 PolarHBondContact O-N 3.42Å; E46-R48 PolarHBondContact O-N 3.01Å; E46-N49 PolarHBondContact O-N 2.9Å; E46-L50 HydrophobicContact CG-CD1 4.23Å; E46-L50 WeakPolarHBondContact O-CG 3.41Å; E46-L50 PolarHBondContact O-N 2.91Å
47E98.1Very high95.6Very high16 Ų1646.1 Ų46.18%0.07525%0.253CS..Hα-helixtrans-63.5-42.7-179.5-68.4165.5135.200112.1R8 V12 M31 V34 L43 T44 N49 L50 L51R8-E47 IonicContact CZ-OE1 3.17Å; R8-E47 IonicContact CZ-OE2 2.82Å; R8-E47 IonicContact NE-OE1 2.91Å; R8-E47 PolarHBondContact NE-OE1 3.3Å; R8-E47 IonicContact NE-OE2 3.03Å; R8-E47 IonicContact NH2-OE1 3.28Å; R8-E47 PolarHBondContact NH2-OE1 3.18Å; R8-E47 IonicContact NH2-OE2 2.68Å; R8-E47 PolarHBondContact NH2-OE2 3.34Å; V12-E47 HydrophobicContact CG2-CG 3.76Å; M31-E47 HydrophobicContact CE-CB 4.3Å; M31-E47 WeakPolarHBondContact CE-O 3.48Å; V34-E47 HydrophobicContact CG1-CB 4.38Å; V34-E47 HydrophobicContact CG1-CG 4.35Å; L43-E47 HydrophobicContact CB-CB 4.16Å; L43-E47 HydrophobicContact CD2-CB 4.38Å; L43-E47 HydrophobicContact CG-CB 4.22Å; T44-E47 WeakPolarHBondContact CB-OE2 3.41Å; T44-E47 WeakPolarHBondContact CG2-OE2 3.36Å; T44-E47 PolarHBondContact N-OE2 3.19Å; T44-E47 PolarHBondContact O-N 2.98Å; T44-E47 VanDerWaalsContact OG1-CD 3.27Å; T44-E47 VanDerWaalsContact OG1-CG 3.24Å; T44-E47 WeakPolarHBondContact OG1-CG 3.43Å; T44-E47 PolarHBondContact OG1-N 3.42Å; T44-E47 PolarHBondContact OG1-OE2 3.29Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 2.83Å; E47-L50 PolarHBondContact O-N 2.85Å; E47-L51 PolarHBondContact O-N 2.85Å
48R97.7Very high95.9Very high14 Ų1445.6 Ų45.65%0.05325%0.25CC..Hα-helixtrans-60-42175-177.9-166.471.6-156.2-1111.2L43 T44 E46 S52 F126 Y127L43-R48 HydrophobicContact CB-CB 4.42Å; T44-R48 VanDerWaalsContact O-CB 3.28Å; T44-R48 WeakPolarHBondContact O-CB 3.03Å; T44-R48 PolarHBondContact O-N 3.48Å; E46-R48 PolarHBondContact O-N 3.01Å; R48-S52 PolarHBondContact O-N 3.3Å; R48-S52 VanDerWaalsContact O-N 3.09Å; R48-F126 HydrophobicContact CG-CD1 3.57Å; R48-F126 HydrophobicContact CG-CD2 4.42Å; R48-F126 HydrophobicContact CG-CE1 3.35Å; R48-F126 HydrophobicContact CG-CE2 4.23Å; R48-F126 HydrophobicContact CG-CG 4.1Å; R48-F126 HydrophobicContact CG-CZ 3.69Å; R48-Y127 HydrophobicContact CG-CE1 3.88Å
49N96.8Very high96.4Very high71 Ų7144.4 Ų44.438%0.3824%0.242SC..Hα-helixtrans-67.6-42.4177.9-70.8-8.2000111.4V45 E46 E47 L51 S52 V53V45-N49 VanDerWaalsContact O-CB 3.3Å; V45-N49 WeakPolarHBondContact O-CB 3.45Å; V45-N49 PolarHBondContact O-N 3.49Å; V45-N49 PolarHBondContact O-ND2 3.26Å; V45-N49 PolarHBondContact O-OD1 2.75Å; E46-N49 PolarHBondContact O-N 2.9Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 2.83Å; N49-L51 PolarHBondContact O-N 3.49Å; N49-S52 WeakPolarHBondContact O-CB 3.39Å; N49-S52 PolarHBondContact O-N 3.05Å; N49-V53 WeakPolarHBondContact O-CG2 3.47Å; N49-V53 PolarHBondContact O-N 3.22Å
50L98.5Very high96.8Very high10 Ų1039.3 Ų39.35%0.05222%0.222CC..Hα-helixtrans-59.5-46.3174.7-72.7169.2000111.8V12 K16 E19 M27 M31 E46 E47 S52 V53 A54V12-L50 HydrophobicContact CG1-CD1 3.96Å; K16-L50 HydrophobicContact CG-CD1 4.03Å; K16-L50 HydrophobicContact CG-CD2 4.15Å; E19-L50 WeakPolarHBondContact OE2-CD2 3.47Å; M27-L50 HydrophobicContact CE-CB 3.94Å; M27-L50 HydrophobicContact CE-CD2 3.52Å; M27-L50 HydrophobicContact CE-CG 4.35Å; M27-L50 WeakPolarHBondContact CE-O 3.43Å; M31-L50 HydrophobicContact CE-CB 4Å; M31-L50 HydrophobicContact CG-CB 4.35Å; M31-L50 HydrophobicContact SD-CB 3.84Å; M31-L50 HydrophobicContact SD-CD1 4.46Å; E46-L50 HydrophobicContact CG-CD1 4.23Å; E46-L50 WeakPolarHBondContact O-CG 3.41Å; E46-L50 PolarHBondContact O-N 2.91Å; E47-L50 PolarHBondContact O-N 2.85Å; L50-S52 VanDerWaalsContact C-N 3.27Å; L50-S52 PolarHBondContact O-N 2.95Å; L50-V53 PolarHBondContact O-N 3.39Å; L50-A54 WeakPolarHBondContact O-CB 3.42Å; L50-A54 PolarHBondContact O-N 3.17Å
51L98.6Very high97.5Very high0 Ų039.2 Ų39.20%023%0.226CC..Hα-helixtrans-56.9-43.9175.6178.270.6000111.2M31 L43 E47 N49 A54 Y55 I106 L114M31-L51 HydrophobicContact CB-CB 4.32Å; M31-L51 HydrophobicContact CB-CD1 3.7Å; M31-L51 HydrophobicContact CE-CB 3.99Å; L43-L51 HydrophobicContact CD2-CD2 4.3Å; E47-L51 PolarHBondContact O-N 2.85Å; N49-L51 PolarHBondContact O-N 3.49Å; L51-A54 PolarHBondContact O-N 3.33Å; L51-Y55 HydrophobicContact CD1-CD2 3.72Å; L51-Y55 HydrophobicContact CD1-CE2 3.6Å; L51-Y55 HydrophobicContact CG-CD2 4.31Å; L51-Y55 PolarHBondContact O-N 3.34Å; L51-Y55 VanDerWaalsContact O-N 3.16Å; L51-I106 HydrophobicContact CD2-CD1 4.36Å; L51-L114 HydrophobicContact CD2-CD1 3.51Å; L51-L114 HydrophobicContact CD2-CD2 4.37Å
52S98.1Very high97.8Very high34 Ų3440.2 Ų40.224%0.23822%0.221CC..Hα-helixtrans-65.1-45.8178.3-176.50000112.6R48 N49 L50 A54 K56R48-S52 PolarHBondContact O-N 3.3Å; R48-S52 VanDerWaalsContact O-N 3.09Å; N49-S52 WeakPolarHBondContact O-CB 3.39Å; N49-S52 PolarHBondContact O-N 3.05Å; L50-S52 VanDerWaalsContact C-N 3.27Å; L50-S52 PolarHBondContact O-N 2.95Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.34Å; S52-K56 WeakPolarHBondContact O-CB 3.43Å; S52-K56 PolarHBondContact O-N 3.03Å
53V98.4Very high97.9Very high46 Ų4639.6 Ų39.628%0.27922%0.217SC..Hα-helixtrans-59.5-45.1176.2169.60000111Y24 M27 N49 L50 K56 N57Y24-V53 HydrophobicContact CE1-CG1 4.41Å; M27-V53 HydrophobicContact CE-CB 4.16Å; M27-V53 HydrophobicContact CE-CG1 4.08Å; M27-V53 HydrophobicContact SD-CG1 4.23Å; N49-V53 WeakPolarHBondContact O-CG2 3.47Å; N49-V53 PolarHBondContact O-N 3.22Å; L50-V53 PolarHBondContact O-N 3.39Å; V53-K56 PolarHBondContact O-N 3.28Å; V53-N57 PolarHBondContact O-N 3.48Å; V53-N57 VanDerWaalsContact O-N 3.09Å; V53-N57 PolarHBondContact O-ND2 3.35Å
54A98.6Very high98Very high0 Ų041.5 Ų41.50%023%0.233CC..Hα-helixtrans-56.6-59.3179.400000111.3M27 V28 L50 L51 S52 K56 N57 V58M27-A54 HydrophobicContact CB-CB 3.9Å; M27-A54 HydrophobicContact CE-CB 4.23Å; M27-A54 HydrophobicContact CG-CB 3.59Å; M27-A54 VanDerWaalsContact SD-CA 3.58Å; M27-A54 HydrophobicContact SD-CB 3.57Å; M27-A54 VanDerWaalsContact SD-CB 3.57Å; V28-A54 HydrophobicContact CG2-CB 3.79Å; L50-A54 WeakPolarHBondContact O-CB 3.42Å; L50-A54 PolarHBondContact O-N 3.17Å; L51-A54 PolarHBondContact O-N 3.33Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.34Å; A54-K56 PolarHBondContact O-N 3.16Å; A54-N57 PolarHBondContact O-N 3.36Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å; A54-V58 PolarHBondContact O-N 3.5Å; A54-V58 VanDerWaalsContact O-N 3.16Å
55Y98.7Very high98.1Very high4 Ų440.4 Ų40.42%0.01623%0.228CC..Hα-helixtrans-68-37.4-177.3-86-83.4000112.3V28 E32 L51 N57 V58 I59 I102 I106 L109 Y134V28-Y55 HydrophobicContact CG1-CD1 4.47Å; V28-Y55 HydrophobicContact CG1-CD2 4.44Å; V28-Y55 HydrophobicContact CG1-CE1 3.86Å; V28-Y55 HydrophobicContact CG1-CE2 3.84Å; V28-Y55 HydrophobicContact CG2-CD1 4.19Å; V28-Y55 HydrophobicContact CG2-CD2 4.06Å; V28-Y55 HydrophobicContact CG2-CE1 4.4Å; V28-Y55 HydrophobicContact CG2-CE2 4.28Å; V28-Y55 HydrophobicContact CG2-CG 4.02Å; E32-Y55 WeakPolarHBondContact CG-OH 3.44Å; E32-Y55 PolarHBondContact OE1-OH 2.87Å; L51-Y55 HydrophobicContact CD1-CD2 3.72Å; L51-Y55 HydrophobicContact CD1-CE2 3.6Å; L51-Y55 HydrophobicContact CG-CD2 4.31Å; L51-Y55 PolarHBondContact O-N 3.34Å; L51-Y55 VanDerWaalsContact O-N 3.16Å; Y55-N57 VanDerWaalsContact C-N 3.35Å; Y55-N57 PolarHBondContact O-N 3.45Å; Y55-V58 PolarHBondContact O-N 2.87Å; Y55-I59 WeakPolarHBondContact O-CB 3.38Å; Y55-I59 VanDerWaalsContact O-CG2 3.23Å; Y55-I59 WeakPolarHBondContact O-CG2 3.35Å; Y55-I59 PolarHBondContact O-N 3.28Å; Y55-I102 HydrophobicContact CD1-CG2 4.06Å; Y55-I102 HydrophobicContact CE1-CG2 4.44Å; Y55-I106 HydrophobicContact CD1-CB 3.83Å; Y55-I106 HydrophobicContact CD1-CG1 4.49Å; Y55-I106 HydrophobicContact CD1-CG2 4.28Å; Y55-I106 HydrophobicContact CD2-CB 4.48Å; Y55-I106 HydrophobicContact CD2-CD1 3.94Å; Y55-I106 HydrophobicContact CD2-CG1 4.45Å; Y55-I106 HydrophobicContact CE1-CB 3.64Å; Y55-I106 HydrophobicContact CE1-CG2 4.33Å; Y55-I106 HydrophobicContact CE2-CB 4.29Å; Y55-I106 HydrophobicContact CE2-CD1 3.83Å; Y55-I106 HydrophobicContact CE2-CG1 4.5Å; Y55-I106 HydrophobicContact CG-CB 4.24Å; Y55-I106 HydrophobicContact CG-CD1 4.39Å; Y55-I106 HydrophobicContact CG-CG1 4.42Å; Y55-L109 HydrophobicContact CE2-CD1 4.21Å; Y55-L109 WeakPolarHBondContact OH-CD1 3.4Å; Y55-Y134 VanDerWaalsContact CB-OH 3.25Å; Y55-Y134 WeakPolarHBondContact CB-OH 3.42Å; Y55-Y134 PolarHBondContact O-OH 2.91Å
56K98.2Very high98.2Very high144 Ų14438.4 Ų38.463%0.62621%0.212SC*.Hα-helixtrans-59.3-43.3178.2-179-178.1177.1-174.70112S52 V53 A54 G60S52-K56 WeakPolarHBondContact O-CB 3.43Å; S52-K56 PolarHBondContact O-N 3.03Å; V53-K56 PolarHBondContact O-N 3.28Å; A54-K56 PolarHBondContact O-N 3.16Å; K56-G60 WeakPolarHBondContact O-CA 3.2Å; K56-G60 PolarHBondContact O-N 3.31Å
57N98.4Very high98.3Very high58 Ų5838.3 Ų38.331%0.3121%0.208SC..Hα-helixtrans-68.6-45.2177.4-79.5-70.2000111.3Y24 V53 A54 Y55 I59 G60 A61Y24-N57 HydrophobicContact CD1-CB 3.61Å; Y24-N57 HydrophobicContact CD2-CB 3.45Å; Y24-N57 VanDerWaalsContact CD2-CB 3.45Å; Y24-N57 HydrophobicContact CE1-CB 3.93Å; Y24-N57 VanDerWaalsContact CE1-ND2 3.35Å; Y24-N57 WeakPolarHBondContact CE1-ND2 3.46Å; Y24-N57 HydrophobicContact CE2-CB 3.75Å; Y24-N57 HydrophobicContact CG-CB 3.35Å; Y24-N57 VanDerWaalsContact CZ-CG 3.47Å; V53-N57 PolarHBondContact O-N 3.48Å; V53-N57 VanDerWaalsContact O-N 3.09Å; V53-N57 PolarHBondContact O-ND2 3.35Å; A54-N57 PolarHBondContact O-N 3.36Å; Y55-N57 VanDerWaalsContact C-N 3.35Å; Y55-N57 PolarHBondContact O-N 3.45Å; N57-I59 PolarHBondContact O-N 3.06Å; N57-G60 PolarHBondContact O-N 2.95Å; N57-A61 PolarHBondContact O-N 2.85Å
58V98.5Very high98.3Very high11 Ų1142.4 Ų42.47%0.06723%0.229CC..Hα-helixtrans-62.3-47.8-179.3171.70000111.8Y24 E25 V28 A54 Y55 R62 I102Y24-V58 WeakPolarHBondContact O-CG2 3.48Å; E25-V58 HydrophobicContact CG-CG2 4.3Å; V28-V58 HydrophobicContact CG2-CB 4.4Å; V28-V58 HydrophobicContact CG2-CG2 3.85Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å; A54-V58 PolarHBondContact O-N 3.5Å; A54-V58 VanDerWaalsContact O-N 3.16Å; Y55-V58 PolarHBondContact O-N 2.87Å; V58-R62 VanDerWaalsContact CA-NH2 3.31Å; V58-R62 PolarHBondContact O-N 3.27Å; V58-R62 PolarHBondContact O-NE 3Å; V58-R62 PolarHBondContact O-NH2 2.86Å; V58-I102 HydrophobicContact CG1-CD1 3.7Å; V58-I102 HydrophobicContact CG1-CG1 3.93Å; V58-I102 HydrophobicContact CG1-CG2 4.19Å
59I98.5Very high98.4Very high2 Ų243 Ų431%0.0123%0.233CC..Hα-helixtrans-71.7-35.5179.1-16272.5000111.4Y55 N57 R62 R63 L99 I102 Y134 Y137Y55-I59 WeakPolarHBondContact O-CB 3.38Å; Y55-I59 VanDerWaalsContact O-CG2 3.23Å; Y55-I59 WeakPolarHBondContact O-CG2 3.35Å; Y55-I59 PolarHBondContact O-N 3.28Å; N57-I59 PolarHBondContact O-N 3.06Å; I59-R62 PolarHBondContact O-N 3.09Å; I59-R63 HydrophobicContact CG1-CG 4.18Å; I59-R63 WeakPolarHBondContact O-CB 3.1Å; I59-R63 VanDerWaalsContact O-CG 3.32Å; I59-R63 WeakPolarHBondContact O-CG 3.14Å; I59-R63 PolarHBondContact O-N 3.3Å; I59-L99 HydrophobicContact CD1-CD2 3.56Å; I59-L99 HydrophobicContact CG1-CD2 4.28Å; I59-I102 HydrophobicContact CB-CG2 4.05Å; I59-I102 HydrophobicContact CD1-CB 3.79Å; I59-I102 HydrophobicContact CD1-CD1 4.26Å; I59-I102 HydrophobicContact CD1-CG2 3.57Å; I59-I102 HydrophobicContact CG1-CG2 4.35Å; I59-Y134 HydrophobicContact CB-CE1 3.94Å; I59-Y134 HydrophobicContact CD1-CE1 4.24Å; I59-Y134 HydrophobicContact CG1-CD1 4.47Å; I59-Y134 HydrophobicContact CG1-CE1 3.9Å; I59-Y134 HydrophobicContact CG2-CE1 3.97Å; I59-Y134 WeakPolarHBondContact CG2-OH 3.13Å; I59-Y137 HydrophobicContact CG1-CD2 3.8Å; I59-Y137 HydrophobicContact CG1-CE2 4.25Å; I59-Y137 HydrophobicContact CG2-CD2 4.39Å; I59-Y137 HydrophobicContact CG2-CE2 4Å
60G98.3Very high98.4Very high29 Ų2940.5 Ų40.530%0.29922%0.221SC..Hα-helixtrans-60.7-48.2179.800000112K56 N57 R62 R63 A64K56-G60 WeakPolarHBondContact O-CA 3.2Å; K56-G60 PolarHBondContact O-N 3.31Å; N57-G60 PolarHBondContact O-N 2.95Å; G60-R62 PolarHBondContact O-N 3.27Å; G60-R63 PolarHBondContact O-N 3.38Å; G60-A64 WeakPolarHBondContact O-CB 3.46Å; G60-A64 PolarHBondContact O-N 2.89Å
61A98.2Very high98.4Very high47 Ų4742.2 Ų42.239%0.38823%0.234SC..Hα-helixtrans-59.1-47.4176.500000111.9N57 A64 S65N57-A61 PolarHBondContact O-N 2.85Å; A61-A64 WeakPolarHBondContact O-CB 3.22Å; A61-A64 PolarHBondContact O-N 3.15Å; A61-S65 PolarHBondContact O-N 3.06Å; A61-S65 PolarHBondContact O-OG 3.31Å
62R98.5Very high98.4Very high50 Ų5045.4 Ų45.419%0.18925%0.251CS..Hα-helixtrans-67-38.7179.9-94.946.365.2161.77.1112.7E25 V58 I59 G60 A64 S65 W66 E98 L99 I102E25-R62 IonicContact OE1-CZ 2.68Å; E25-R62 VanDerWaalsContact OE1-CZ 3.28Å; E25-R62 IonicContact OE1-NH1 3.31Å; E25-R62 PolarHBondContact OE1-NH1 3.34Å; E25-R62 IonicContact OE1-NH2 3.7Å; E25-R62 PolarHBondContact OE1-NH2 3.38Å; V58-R62 VanDerWaalsContact CA-NH2 3.31Å; V58-R62 PolarHBondContact O-N 3.27Å; V58-R62 PolarHBondContact O-NE 3Å; V58-R62 PolarHBondContact O-NH2 2.86Å; I59-R62 PolarHBondContact O-N 3.09Å; G60-R62 PolarHBondContact O-N 3.27Å; R62-A64 VanDerWaalsContact C-N 3.33Å; R62-A64 PolarHBondContact O-N 3.36Å; R62-S65 PolarHBondContact O-N 3.15Å; R62-W66 PolarHBondContact O-N 2.81Å; R62-E98 HydrophobicContact CG-CB 4.42Å; R62-L99 HydrophobicContact CB-CD2 3.64Å; R62-L99 HydrophobicContact CB-CG 4.13Å; R62-I102 HydrophobicContact CB-CD1 4.13Å; R62-I102 HydrophobicContact CG-CD1 3.93Å
63R98.3Very high98.4Very high35 Ų3544.6 Ų44.613%0.13224%0.243CC..Hα-helixtrans-65.6-36.6174.4-75177.965.4-126.514.9111.7I59 G60 W66 R67 L99 Y137 E140I59-R63 HydrophobicContact CG1-CG 4.18Å; I59-R63 WeakPolarHBondContact O-CB 3.1Å; I59-R63 VanDerWaalsContact O-CG 3.32Å; I59-R63 WeakPolarHBondContact O-CG 3.14Å; I59-R63 PolarHBondContact O-N 3.3Å; G60-R63 PolarHBondContact O-N 3.38Å; R63-W66 PolarHBondContact O-N 3.17Å; R63-R67 WeakPolarHBondContact O-CG 3.41Å; R63-R67 PolarHBondContact O-N 3.33Å; R63-L99 HydrophobicContact CB-CD2 4.45Å; R63-L99 HydrophobicContact CG-CD2 3.58Å; R63-Y137 VanDerWaalsContact CZ-CE1 3.5Å; R63-E140 IonicContact CZ-OE1 3.47Å; R63-E140 IonicContact CZ-OE2 3.88Å; R63-E140 IonicContact NE-OE1 2.66Å; R63-E140 PolarHBondContact NE-OE1 3.25Å; R63-E140 IonicContact NE-OE2 3.79Å; R63-E140 PolarHBondContact NE-OE2 2.97Å; R63-E140 VanDerWaalsContact NH2-CD 3.26Å; R63-E140 IonicContact NH2-OE1 3.61Å; R63-E140 PolarHBondContact NH2-OE1 2.96Å; R63-E140 IonicContact NH2-OE2 3.09Å; R63-E140 PolarHBondContact NH2-OE2 3.43Å
64A98.5Very high98.3Very high45 Ų4548.7 Ų48.737%0.37226%0.259SS..Hα-helixtrans-64.6-46.3173.800000111.3G60 A61 R62 W66 R67 I68G60-A64 WeakPolarHBondContact O-CB 3.46Å; G60-A64 PolarHBondContact O-N 2.89Å; A61-A64 WeakPolarHBondContact O-CB 3.22Å; A61-A64 PolarHBondContact O-N 3.15Å; R62-A64 VanDerWaalsContact C-N 3.33Å; R62-A64 PolarHBondContact O-N 3.36Å; A64-W66 VanDerWaalsContact C-N 3.34Å; A64-W66 PolarHBondContact O-N 2.98Å; A64-R67 PolarHBondContact O-N 3.28Å; A64-I68 WeakPolarHBondContact O-CG1 3.47Å; A64-I68 PolarHBondContact O-N 3.15Å; A64-I68 VanDerWaalsContact O-N 3.08Å
65S98.6Very high98.3Very high51 Ų5154.1 Ų54.136%0.35728%0.283SS..Hα-helixtrans-56.3-48.2173.6-57.20000111.5A61 R62 R67 I68 I69A61-S65 PolarHBondContact O-N 3.06Å; A61-S65 PolarHBondContact O-OG 3.31Å; R62-S65 PolarHBondContact O-N 3.15Å; S65-R67 PolarHBondContact O-N 2.77Å; S65-I68 PolarHBondContact O-N 3.41Å; S65-I69 WeakPolarHBondContact O-CG1 3.33Å; S65-I69 PolarHBondContact O-N 3.06Å
66W98.7Very high98.2Very high36 Ų3655.1 Ų55.114%0.13629%0.287CS..Hα-helixtrans-57.9-49178.5178.879.6000112.3R62 R63 A64 I68 I69 S70 I95 E96 L99 E140 F141R62-W66 PolarHBondContact O-N 2.81Å; R63-W66 PolarHBondContact O-N 3.17Å; A64-W66 VanDerWaalsContact C-N 3.34Å; A64-W66 PolarHBondContact O-N 2.98Å; W66-I68 VanDerWaalsContact C-N 3.34Å; W66-I68 PolarHBondContact O-N 3.32Å; W66-I69 PolarHBondContact O-N 3.44Å; W66-S70 WeakPolarHBondContact O-CB 3.47Å; W66-S70 PolarHBondContact O-N 3.28Å; W66-S70 PolarHBondContact O-OG 3.15Å; W66-I95 HydrophobicContact CB-CG2 3.74Å; W66-E96 PolarHBondContact NE1-OE1 3.31Å; W66-L99 HydrophobicContact CB-CD1 3.78Å; W66-L99 HydrophobicContact CG-CD1 3.94Å; W66-E140 HydrophobicContact CH2-CB 4.47Å; W66-E140 WeakPolarHBondContact CH2-O 3.22Å; W66-E140 HydrophobicContact CZ3-CB 4.4Å; W66-F141 HydrophobicContact CD2-CB 4.21Å; W66-F141 VanDerWaalsContact CE2-CB 3.42Å; W66-F141 HydrophobicContact CH2-CB 4.05Å; W66-F141 HydrophobicContact CZ2-CB 3.35Å
67R98.3Very high98.2Very high101 Ų10152.4 Ų52.438%0.38128%0.277SS..Hα-helixtrans-57.5-44.3177.5-74.6-176-179.780.915112.8R63 A64 S65 S71 E140R63-R67 WeakPolarHBondContact O-CG 3.41Å; R63-R67 PolarHBondContact O-N 3.33Å; A64-R67 PolarHBondContact O-N 3.28Å; S65-R67 PolarHBondContact O-N 2.77Å; R67-S71 WeakPolarHBondContact O-CB 3.41Å; R67-S71 PolarHBondContact O-N 3.18Å; R67-E140 IonicContact CZ-OE2 2.96Å; R67-E140 IonicContact NH2-OE2 2.66Å; R67-E140 PolarHBondContact NH2-OE2 3.31Å
68I98.5Very high98.1Very high103 Ų10354.3 Ų54.353%0.52830%0.295SS..Hα-helixtrans-62.7-48.2179.4-68.8166.5000110.1A64 S65 W66 S71 I72A64-I68 WeakPolarHBondContact O-CG1 3.47Å; A64-I68 PolarHBondContact O-N 3.15Å; A64-I68 VanDerWaalsContact O-N 3.08Å; S65-I68 PolarHBondContact O-N 3.41Å; W66-I68 VanDerWaalsContact C-N 3.34Å; W66-I68 PolarHBondContact O-N 3.32Å; I68-S71 PolarHBondContact O-N 3.34Å; I68-I72 HydrophobicContact CG2-CD1 3.85Å; I68-I72 WeakPolarHBondContact O-CG1 3.32Å; I68-I72 PolarHBondContact O-N 3.21Å
69I98.6Very high98Very high25 Ų2561.6 Ų61.613%0.12832%0.321CS..Hα-helixtrans-65.3-42.5-179.2-63.3-50.1000111.2S65 W66 S71 I72 E73 I88 Y91 R92 I95S65-I69 WeakPolarHBondContact O-CG1 3.33Å; S65-I69 PolarHBondContact O-N 3.06Å; W66-I69 PolarHBondContact O-N 3.44Å; I69-S71 VanDerWaalsContact C-N 3.29Å; I69-S71 PolarHBondContact O-N 3.21Å; I69-I72 HydrophobicContact CD1-CD1 4.24Å; I69-I72 PolarHBondContact O-N 3.11Å; I69-I72 VanDerWaalsContact O-N 3.15Å; I69-E73 PolarHBondContact O-N 3.49Å; I69-I88 HydrophobicContact CG2-CG2 3.81Å; I69-Y91 HydrophobicContact CD1-CD1 3.83Å; I69-Y91 HydrophobicContact CD1-CE1 3.77Å; I69-Y91 HydrophobicContact CG1-CD1 3.88Å; I69-Y91 HydrophobicContact CG1-CE1 3.88Å; I69-Y91 HydrophobicContact CG2-CD1 4.24Å; I69-R92 HydrophobicContact CG2-CB 3.81Å; I69-I95 HydrophobicContact CB-CD1 4.25Å; I69-I95 HydrophobicContact CG1-CD1 3.65Å
70S98Very high97.9Very high20 Ų2064.1 Ų64.114%0.1435%0.347CS..Hα-helixtrans-59.6-37.9173.9-61.80000112.3W66 E73 Q74 R92W66-S70 WeakPolarHBondContact O-CB 3.47Å; W66-S70 PolarHBondContact O-N 3.28Å; W66-S70 PolarHBondContact O-OG 3.15Å; S70-E73 WeakPolarHBondContact O-CB 3.34Å; S70-E73 PolarHBondContact O-N 2.78Å; S70-Q74 WeakPolarHBondContact O-CG 3.41Å; S70-Q74 PolarHBondContact O-N 3.49Å; S70-R92 VanDerWaalsContact OG-CD 3.29Å; S70-R92 WeakPolarHBondContact OG-CD 3.48Å
71S98.1Very high97.7Very high46 Ų4665.5 Ų65.532%0.32235%0.348SS..Hα-helixtrans-68.9-37.8174.8-176.50000112.8R67 I68 I69 K75R67-S71 WeakPolarHBondContact O-CB 3.41Å; R67-S71 PolarHBondContact O-N 3.18Å; I68-S71 PolarHBondContact O-N 3.34Å; I69-S71 VanDerWaalsContact C-N 3.29Å; I69-S71 PolarHBondContact O-N 3.21Å; S71-K75 WeakPolarHBondContact O-CG 3.44Å; S71-K75 PolarHBondContact O-N 3.06Å
72I98.3Very high97.6Very high67 Ų6771.3 Ų71.334%0.34437%0.367SS..Hα-helixtrans-66.3-41.4175.5-67.4167.9000110.2I68 I69 Q74 K75 E76 I88I68-I72 HydrophobicContact CG2-CD1 3.85Å; I68-I72 WeakPolarHBondContact O-CG1 3.32Å; I68-I72 PolarHBondContact O-N 3.21Å; I69-I72 HydrophobicContact CD1-CD1 4.24Å; I69-I72 PolarHBondContact O-N 3.11Å; I69-I72 VanDerWaalsContact O-N 3.15Å; I72-Q74 PolarHBondContact O-N 2.97Å; I72-K75 PolarHBondContact O-N 3.18Å; I72-E76 HydrophobicContact CG2-CG 4.29Å; I72-E76 WeakPolarHBondContact O-CG 3.23Å; I72-E76 PolarHBondContact O-N 2.68Å; I72-I88 HydrophobicContact CG2-CD1 3.86Å; I72-I88 HydrophobicContact CG2-CG1 4.47Å
73E97.9Very high97.4Very high17 Ų1772.5 Ų72.58%0.07939%0.388CS..Hα-helixtrans-53.7-54.1174.5-172.3173.4155.100111.3I69 S70 K75 E76 E77 I88 K89 R92I69-E73 PolarHBondContact O-N 3.49Å; S70-E73 WeakPolarHBondContact O-CB 3.34Å; S70-E73 PolarHBondContact O-N 2.78Å; E73-K75 VanDerWaalsContact C-N 3.28Å; E73-K75 PolarHBondContact O-N 3.11Å; E73-E76 PolarHBondContact O-N 3.28Å; E73-E76 VanDerWaalsContact O-N 3.16Å; E73-E77 HydrophobicContact CG-CG 4.49Å; E73-E77 WeakPolarHBondContact O-CB 3.28Å; E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 2.91Å; E73-I88 HydrophobicContact CB-CG2 3.6Å; E73-I88 HydrophobicContact CG-CG2 4.14Å; E73-K89 HydrophobicContact CG-CG 4.34Å; E73-K89 WeakPolarHBondContact OE1-CE 3.33Å; E73-K89 WeakPolarHBondContact OE1-CG 3.21Å; E73-R92 IonicContact OE1-CZ 2.73Å; E73-R92 IonicContact OE1-NE 2.91Å; E73-R92 IonicContact OE1-NH2 3.44Å; E73-R92 PolarHBondContact OE1-NH2 2.89Å; E73-R92 IonicContact OE2-CZ 3.97Å; E73-R92 IonicContact OE2-NE 3.05Å; E73-R92 PolarHBondContact OE2-NE 3.46Å; E73-R92 IonicContact OE2-NH2 3.72Å; E73-R92 PolarHBondContact OE2-NH2 2.85Å
74Q97.1Very high97.3Very high131 Ų13178.2 Ų78.261%0.61241%0.41SS*.Hα-helixtrans-57.8-39.7179.3-70.7173.4-4.900112.4S70 I72 S78S70-Q74 WeakPolarHBondContact O-CG 3.41Å; S70-Q74 PolarHBondContact O-N 3.49Å; I72-Q74 PolarHBondContact O-N 2.97Å; Q74-S78 PolarHBondContact O-N 3.42Å
75K97.6Very high97.3Very high115 Ų11576.6 Ų76.650%0.540%0.396SS..Hα-helixtrans-67.3-42.9177.7-73.6170.6-178169.50112S71 I72 E73 S78 R79S71-K75 WeakPolarHBondContact O-CG 3.44Å; S71-K75 PolarHBondContact O-N 3.06Å; I72-K75 PolarHBondContact O-N 3.18Å; E73-K75 VanDerWaalsContact C-N 3.28Å; E73-K75 PolarHBondContact O-N 3.11Å; K75-S78 PolarHBondContact O-N 3.45Å; K75-S78 PolarHBondContact O-OG 2.99Å; K75-R79 WeakPolarHBondContact O-CG 3.25Å; K75-R79 PolarHBondContact O-N 3.09Å
76E97.8Very high97.2Very high25 Ų2577 Ų7712%0.11740%0.403CS..Hα-helixtrans-72.3-33.2179-67.9-5712600112.3I72 E73 R79 G80 N81 V85 I88I72-E76 HydrophobicContact CG2-CG 4.29Å; I72-E76 WeakPolarHBondContact O-CG 3.23Å; I72-E76 PolarHBondContact O-N 2.68Å; E73-E76 PolarHBondContact O-N 3.28Å; E73-E76 VanDerWaalsContact O-N 3.16Å; E76-R79 PolarHBondContact O-N 3.47Å; E76-R79 IonicContact OE1-CZ 3.34Å; E76-R79 IonicContact OE1-NE 3.15Å; E76-R79 IonicContact OE1-NH1 2.86Å; E76-R79 PolarHBondContact OE1-NH1 2.95Å; E76-G80 PolarHBondContact O-N 3.5Å; E76-N81 PolarHBondContact O-N 3.16Å; E76-N81 VanDerWaalsContact O-N 3.17Å; E76-N81 WeakPolarHBondContact OE2-CB 3.49Å; E76-N81 PolarHBondContact OE2-ND2 3.39Å; E76-V85 HydrophobicContact CB-CG2 3.9Å; E76-I88 HydrophobicContact CB-CD1 3.89Å; E76-I88 HydrophobicContact CG-CD1 3.64Å
77E96.8Very high97.2Very high86 Ų8678.8 Ų78.840%0.40242%0.42SS..Hα-helixtrans-60.3-44.8169.6-76-176156.100111.1E73 R79 G80 V85 K89E73-E77 HydrophobicContact CG-CG 4.49Å; E73-E77 WeakPolarHBondContact O-CB 3.28Å; E73-E77 WeakPolarHBondContact O-CG 3.35Å; E73-E77 PolarHBondContact O-N 2.91Å; E77-R79 PolarHBondContact O-N 2.86Å; E77-R79 VanDerWaalsContact O-N 3.14Å; E77-G80 PolarHBondContact O-N 3.39Å; E77-V85 HydrophobicContact CB-CG2 4.29Å; E77-V85 HydrophobicContact CG-CB 4.24Å; E77-V85 HydrophobicContact CG-CG1 3.58Å; E77-V85 HydrophobicContact CG-CG2 3.57Å; E77-K89 WeakPolarHBondContact OE1-CE 3.46Å; E77-K89 IonicContact OE1-NZ 3.66Å; E77-K89 PolarHBondContact OE1-NZ 3.42Å
78S97.1Very high97.2Very high99 Ų9975.1 Ų75.169%0.69241%0.408SS*.Hα-helixtrans-62.9-20.7177.179.90000114.1Q74 K75Q74-S78 PolarHBondContact O-N 3.42Å; K75-S78 PolarHBondContact O-N 3.45Å; K75-S78 PolarHBondContact O-OG 2.99Å
79R96.7Very high97.2Very high164 Ų16474.1 Ų74.162%0.61940%0.4SS*.THydrogen-bonded Turntrans-92.5-7.2178-68.7167.8177.7-178.2-5113.3K75 E76 E77 N81K75-R79 WeakPolarHBondContact O-CG 3.25Å; K75-R79 PolarHBondContact O-N 3.09Å; E76-R79 PolarHBondContact O-N 3.47Å; E76-R79 IonicContact OE1-CZ 3.34Å; E76-R79 IonicContact OE1-NE 3.15Å; E76-R79 IonicContact OE1-NH1 2.86Å; E76-R79 PolarHBondContact OE1-NH1 2.95Å; E77-R79 PolarHBondContact O-N 2.86Å; E77-R79 VanDerWaalsContact O-N 3.14Å; R79-N81 VanDerWaalsContact C-N 3.3Å
80G95.3Very high97.2Very high54 Ų5479.5 Ų79.556%0.55743%0.425SS*.THydrogen-bonded Turntrans71.920.6-175.200000114.1E76 E77 E82E76-G80 PolarHBondContact O-N 3.5Å; E77-G80 PolarHBondContact O-N 3.39Å; G80-E82 VanDerWaalsContact C-N 3.26Å; G80-E82 PolarHBondContact O-N 2.85Å
81N95.3Very high97.2Very high59 Ų5984.3 Ų84.332%0.31644%0.44SS..  trans-8364.4-177.2-72.5-24000111.8E76 R79 A83 Y84 V85E76-N81 PolarHBondContact O-N 3.16Å; E76-N81 VanDerWaalsContact O-N 3.17Å; E76-N81 WeakPolarHBondContact OE2-CB 3.49Å; E76-N81 PolarHBondContact OE2-ND2 3.39Å; R79-N81 VanDerWaalsContact C-N 3.3Å; N81-A83 VanDerWaalsContact C-N 3.29Å; N81-A83 PolarHBondContact O-N 3.38Å; N81-A83 VanDerWaalsContact O-N 3.13Å; N81-Y84 HydrophobicContact CB-CD2 3.94Å; N81-Y84 PolarHBondContact O-N 2.89Å; N81-V85 WeakPolarHBondContact O-CG2 3.05Å; N81-V85 PolarHBondContact O-N 2.91Å
82E95.1Very high97.2Very high169 Ų16984.5 Ų84.579%0.7943%0.434SS*.Hα-helixtrans-51.4-41.3-170.4-65.4-175.7173.900114.4G80 V85 A86G80-E82 VanDerWaalsContact C-N 3.26Å; G80-E82 PolarHBondContact O-N 2.85Å; E82-V85 PolarHBondContact O-N 3.32Å; E82-A86 PolarHBondContact O-N 3.2Å
83A94.3Very high97.2Very high75 Ų7584.1 Ų84.162%0.6244%0.437SS*.Hα-helixtrans-65.7-38.6179.300000113N81 S87N81-A83 VanDerWaalsContact C-N 3.29Å; N81-A83 PolarHBondContact O-N 3.38Å; N81-A83 VanDerWaalsContact O-N 3.13Å; A83-S87 PolarHBondContact O-N 3.07Å; A83-S87 PolarHBondContact O-OG 2.92Å
84Y96.9Very high97.2Very high154 Ų15490.2 Ų90.260%0.60446%0.46SS*.Hα-helixtrans-72.2-41175.1-65.3-30.3000111N81 A86 S87 I88N81-Y84 HydrophobicContact CB-CD2 3.94Å; N81-Y84 PolarHBondContact O-N 2.89Å; Y84-A86 VanDerWaalsContact C-N 3.28Å; Y84-A86 PolarHBondContact O-N 3.45Å; Y84-S87 PolarHBondContact O-N 3.34Å; Y84-S87 VanDerWaalsContact O-N 3.12Å; Y84-I88 WeakPolarHBondContact O-CB 3.31Å; Y84-I88 WeakPolarHBondContact O-CD1 3.47Å; Y84-I88 WeakPolarHBondContact O-CG1 3.48Å; Y84-I88 PolarHBondContact O-N 2.87Å
85V98.2Very high97.3Very high12 Ų1284.2 Ų84.27%0.07343%0.432CS..Hα-helixtrans-56-43.8175.2172.50000111.1E76 E77 N81 E82 S87 I88 K89E76-V85 HydrophobicContact CB-CG2 3.9Å; E77-V85 HydrophobicContact CB-CG2 4.29Å; E77-V85 HydrophobicContact CG-CB 4.24Å; E77-V85 HydrophobicContact CG-CG1 3.58Å; E77-V85 HydrophobicContact CG-CG2 3.57Å; N81-V85 WeakPolarHBondContact O-CG2 3.05Å; N81-V85 PolarHBondContact O-N 2.91Å; E82-V85 PolarHBondContact O-N 3.32Å; V85-S87 PolarHBondContact O-N 3.29Å; V85-I88 PolarHBondContact O-N 3.05Å; V85-K89 HydrophobicContact CG1-CD 4.01Å; V85-K89 HydrophobicContact CG1-CG 4.47Å; V85-K89 WeakPolarHBondContact O-CB 3.37Å; V85-K89 WeakPolarHBondContact O-CG 3.19Å; V85-K89 PolarHBondContact O-N 3.38Å
86A97.7Very high97.4Very high60 Ų6080.1 Ų80.150%0.49641%0.414SS..Hα-helixtrans-59.9-45.9176.400000112.3E82 Y84 I88 K89 E90E82-A86 PolarHBondContact O-N 3.2Å; Y84-A86 VanDerWaalsContact C-N 3.28Å; Y84-A86 PolarHBondContact O-N 3.45Å; A86-I88 VanDerWaalsContact C-N 3.35Å; A86-I88 PolarHBondContact O-N 2.86Å; A86-K89 PolarHBondContact O-N 3.27Å; A86-E90 PolarHBondContact O-N 3.48Å; A86-E90 VanDerWaalsContact O-N 3.14Å
87S97.9Very high97.4Very high73 Ų7383.3 Ų83.351%0.5144%0.436SS..Hα-helixtrans-65.3-38.1178-55.80000112.2A83 Y84 V85 E90 Y91A83-S87 PolarHBondContact O-N 3.07Å; A83-S87 PolarHBondContact O-OG 2.92Å; Y84-S87 PolarHBondContact O-N 3.34Å; Y84-S87 VanDerWaalsContact O-N 3.12Å; V85-S87 PolarHBondContact O-N 3.29Å; S87-E90 PolarHBondContact O-N 3.23Å; S87-Y91 PolarHBondContact O-N 3.4Å; S87-Y91 VanDerWaalsContact O-N 3.08Å
88I98.4Very high97.5Very high24 Ų2483.3 Ų83.312%0.12344%0.436CS..Hα-helixtrans-67.2-42.5177.6-67.6159.3000110.6I69 I72 E73 E76 Y84 V85 A86 E90 Y91 R92I69-I88 HydrophobicContact CG2-CG2 3.81Å; I72-I88 HydrophobicContact CG2-CD1 3.86Å; I72-I88 HydrophobicContact CG2-CG1 4.47Å; E73-I88 HydrophobicContact CB-CG2 3.6Å; E73-I88 HydrophobicContact CG-CG2 4.14Å; E76-I88 HydrophobicContact CB-CD1 3.89Å; E76-I88 HydrophobicContact CG-CD1 3.64Å; Y84-I88 WeakPolarHBondContact O-CB 3.31Å; Y84-I88 WeakPolarHBondContact O-CD1 3.47Å; Y84-I88 WeakPolarHBondContact O-CG1 3.48Å; Y84-I88 PolarHBondContact O-N 2.87Å; V85-I88 PolarHBondContact O-N 3.05Å; A86-I88 VanDerWaalsContact C-N 3.35Å; A86-I88 PolarHBondContact O-N 2.86Å; I88-E90 VanDerWaalsContact C-N 3.35Å; I88-E90 PolarHBondContact O-N 3.42Å; I88-Y91 PolarHBondContact O-N 2.95Å; I88-R92 WeakPolarHBondContact O-CB 3.5Å; I88-R92 PolarHBondContact O-N 3.14Å
89K98.2Very high97.6Very high82 Ų8278.6 Ų78.636%0.35740%0.403SS..Hα-helixtrans-59.7-43.7176.1-79.3175.9177.41690112.1E73 E77 V85 A86 R92 S93E73-K89 HydrophobicContact CG-CG 4.34Å; E73-K89 WeakPolarHBondContact OE1-CE 3.33Å; E73-K89 WeakPolarHBondContact OE1-CG 3.21Å; E77-K89 WeakPolarHBondContact OE1-CE 3.46Å; E77-K89 IonicContact OE1-NZ 3.66Å; E77-K89 PolarHBondContact OE1-NZ 3.42Å; V85-K89 HydrophobicContact CG1-CD 4.01Å; V85-K89 HydrophobicContact CG1-CG 4.47Å; V85-K89 WeakPolarHBondContact O-CB 3.37Å; V85-K89 WeakPolarHBondContact O-CG 3.19Å; V85-K89 PolarHBondContact O-N 3.38Å; A86-K89 PolarHBondContact O-N 3.27Å; K89-R92 PolarHBondContact O-N 2.93Å; K89-S93 WeakPolarHBondContact O-CB 3.45Å; K89-S93 PolarHBondContact O-N 3.19Å
90E98.2Very high97.7Very high138 Ų13871.5 Ų71.565%0.64538%0.378SS*.Hα-helixtrans-61.2-45.8175-174-178.6173.100111.2A86 S87 I88 S93 R94A86-E90 PolarHBondContact O-N 3.48Å; A86-E90 VanDerWaalsContact O-N 3.14Å; S87-E90 PolarHBondContact O-N 3.23Å; I88-E90 VanDerWaalsContact C-N 3.35Å; I88-E90 PolarHBondContact O-N 3.42Å; E90-S93 PolarHBondContact O-N 2.96Å; E90-R94 PolarHBondContact O-N 3.47Å; E90-R94 VanDerWaalsContact O-N 3.16Å
91Y98.4Very high97.8Very high120 Ų12076.9 Ų76.947%0.47139%0.386SS..Hα-helixtrans-66-41178.8-170.9-125000112.7I69 S87 I88 S93 R94 I95I69-Y91 HydrophobicContact CD1-CD1 3.83Å; I69-Y91 HydrophobicContact CD1-CE1 3.77Å; I69-Y91 HydrophobicContact CG1-CD1 3.88Å; I69-Y91 HydrophobicContact CG1-CE1 3.88Å; I69-Y91 HydrophobicContact CG2-CD1 4.24Å; S87-Y91 PolarHBondContact O-N 3.4Å; S87-Y91 VanDerWaalsContact O-N 3.08Å; I88-Y91 PolarHBondContact O-N 2.95Å; Y91-S93 VanDerWaalsContact C-N 3.33Å; Y91-S93 PolarHBondContact O-N 3.33Å; Y91-R94 WeakPolarHBondContact O-CB 3.45Å; Y91-R94 PolarHBondContact O-N 3.35Å; Y91-I95 HydrophobicContact CD1-CD1 4.25Å; Y91-I95 HydrophobicContact CE1-CD1 3.97Å; Y91-I95 PolarHBondContact O-N 3.19Å
92R98.4Very high98Very high50 Ų5075.3 Ų75.319%0.18938%0.378CS..Hα-helixtrans-58.6-45173-178175.549.279.3-4.3111.2I69 S70 E73 I88 K89 R94 I95 E96I69-R92 HydrophobicContact CG2-CB 3.81Å; S70-R92 VanDerWaalsContact OG-CD 3.29Å; S70-R92 WeakPolarHBondContact OG-CD 3.48Å; E73-R92 IonicContact OE1-CZ 2.73Å; E73-R92 IonicContact OE1-NE 2.91Å; E73-R92 IonicContact OE1-NH2 3.44Å; E73-R92 PolarHBondContact OE1-NH2 2.89Å; E73-R92 IonicContact OE2-CZ 3.97Å; E73-R92 IonicContact OE2-NE 3.05Å; E73-R92 PolarHBondContact OE2-NE 3.46Å; E73-R92 IonicContact OE2-NH2 3.72Å; E73-R92 PolarHBondContact OE2-NH2 2.85Å; I88-R92 WeakPolarHBondContact O-CB 3.5Å; I88-R92 PolarHBondContact O-N 3.14Å; K89-R92 PolarHBondContact O-N 2.93Å; R92-R94 VanDerWaalsContact C-N 3.26Å; R92-R94 PolarHBondContact O-N 3.49Å; R92-I95 WeakPolarHBondContact O-CB 3.26Å; R92-I95 PolarHBondContact O-N 2.97Å; R92-E96 WeakPolarHBondContact CD-OE1 3.29Å; R92-E96 HydrophobicContact CG-CG 4.33Å; R92-E96 WeakPolarHBondContact CG-OE1 3.22Å; R92-E96 IonicContact CZ-OE1 2.72Å; R92-E96 IonicContact NE-OE1 2.72Å; R92-E96 IonicContact NH1-OE1 3.87Å; R92-E96 PolarHBondContact NH1-OE1 3.38Å; R92-E96 IonicContact NH1-OE2 3.31Å; R92-E96 PolarHBondContact NH1-OE2 2.96Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 2.89Å
93S98.3Very high98.2Very high59 Ų5967.3 Ų67.341%0.41334%0.34SS..Hα-helixtrans-61-34.6179.2-176.20000112.8K89 E90 Y91 E96 T97K89-S93 WeakPolarHBondContact O-CB 3.45Å; K89-S93 PolarHBondContact O-N 3.19Å; E90-S93 PolarHBondContact O-N 2.96Å; Y91-S93 VanDerWaalsContact C-N 3.33Å; Y91-S93 PolarHBondContact O-N 3.33Å; S93-E96 PolarHBondContact O-N 3.08Å; S93-T97 PolarHBondContact O-N 3.47Å; S93-T97 PolarHBondContact O-OG1 3.22Å
94R98.6Very high98.4Very high146 Ų14668 Ų6855%0.55133%0.333SS*.Hα-helixtrans-62.8-45.7171.7-69.1175.858.6-179.4-2.9111.7E90 Y91 R92 E96 T97 E98E90-R94 PolarHBondContact O-N 3.47Å; E90-R94 VanDerWaalsContact O-N 3.16Å; Y91-R94 WeakPolarHBondContact O-CB 3.45Å; Y91-R94 PolarHBondContact O-N 3.35Å; R92-R94 VanDerWaalsContact C-N 3.26Å; R92-R94 PolarHBondContact O-N 3.49Å; R94-E96 VanDerWaalsContact C-N 3.32Å; R94-E96 PolarHBondContact O-N 3.07Å; R94-T97 WeakPolarHBondContact O-CB 3.15Å; R94-T97 PolarHBondContact O-N 3.47Å; R94-E98 WeakPolarHBondContact O-CG 3.5Å; R94-E98 PolarHBondContact O-N 2.99Å
95I98.7Very high98.4Very high4 Ų461.6 Ų61.62%0.02131%0.314CS..Hα-helixtrans-63-40176.6-60.6169.1000110.8W66 I69 Y91 R92 T97 E98 L99W66-I95 HydrophobicContact CB-CG2 3.74Å; I69-I95 HydrophobicContact CB-CD1 4.25Å; I69-I95 HydrophobicContact CG1-CD1 3.65Å; Y91-I95 HydrophobicContact CD1-CD1 4.25Å; Y91-I95 HydrophobicContact CE1-CD1 3.97Å; Y91-I95 PolarHBondContact O-N 3.19Å; R92-I95 WeakPolarHBondContact O-CB 3.26Å; R92-I95 PolarHBondContact O-N 2.97Å; I95-T97 VanDerWaalsContact C-N 3.29Å; I95-T97 PolarHBondContact O-N 3.46Å; I95-E98 WeakPolarHBondContact O-CB 3.42Å; I95-E98 PolarHBondContact O-N 3.5Å; I95-L99 HydrophobicContact CG2-CD1 4.22Å; I95-L99 HydrophobicContact CG2-CG 4.42Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 WeakPolarHBondContact O-CG 3.32Å; I95-L99 PolarHBondContact O-N 3.18Å
96E98.7Very high98.4Very high29 Ų2961 Ų6114%0.13631%0.311CS..Hα-helixtrans-63.5-35176-70.6171.1175.900112.4W66 R92 S93 R94 S100 F141W66-E96 PolarHBondContact NE1-OE1 3.31Å; R92-E96 WeakPolarHBondContact CD-OE1 3.29Å; R92-E96 HydrophobicContact CG-CG 4.33Å; R92-E96 WeakPolarHBondContact CG-OE1 3.22Å; R92-E96 IonicContact CZ-OE1 2.72Å; R92-E96 IonicContact NE-OE1 2.72Å; R92-E96 IonicContact NH1-OE1 3.87Å; R92-E96 PolarHBondContact NH1-OE1 3.38Å; R92-E96 IonicContact NH1-OE2 3.31Å; R92-E96 PolarHBondContact NH1-OE2 2.96Å; R92-E96 WeakPolarHBondContact O-CG 3.33Å; R92-E96 PolarHBondContact O-N 2.89Å; S93-E96 PolarHBondContact O-N 3.08Å; R94-E96 VanDerWaalsContact C-N 3.32Å; R94-E96 PolarHBondContact O-N 3.07Å; E96-S100 WeakPolarHBondContact O-CB 3.31Å; E96-S100 PolarHBondContact O-N 3.42Å; E96-S100 PolarHBondContact O-OG 2.85Å; E96-F141 HydrophobicContact CB-CD2 3.74Å; E96-F141 HydrophobicContact CB-CE2 3.94Å; E96-F141 HydrophobicContact CG-CB 4.16Å; E96-F141 HydrophobicContact CG-CD2 3.62Å; E96-F141 HydrophobicContact CG-CE2 4.32Å; E96-F141 HydrophobicContact CG-CG 4.11Å; E96-F141 WeakPolarHBondContact O-CE2 3.24Å
97T98.6Very high98.5Very high92 Ų9258.8 Ų58.856%0.56429%0.29SS*.Hα-helixtrans-66.6-43.2173.4-57.70000111.1S93 R94 I95 S100 K101S93-T97 PolarHBondContact O-N 3.47Å; S93-T97 PolarHBondContact O-OG1 3.22Å; R94-T97 WeakPolarHBondContact O-CB 3.15Å; R94-T97 PolarHBondContact O-N 3.47Å; I95-T97 VanDerWaalsContact C-N 3.29Å; I95-T97 PolarHBondContact O-N 3.46Å; T97-S100 PolarHBondContact O-N 3.18Å; T97-K101 WeakPolarHBondContact O-CB 3.4Å; T97-K101 PolarHBondContact O-N 3.37Å
98E98.6Very high98.5Very high86 Ų8662.6 Ų62.640%0.40230%0.298SS..Hα-helixtrans-63.2-45.3175.1-68.5168.6-166.100111.7R62 R94 I95 S100 K101 I102R62-E98 HydrophobicContact CG-CB 4.42Å; R94-E98 WeakPolarHBondContact O-CG 3.5Å; R94-E98 PolarHBondContact O-N 2.99Å; I95-E98 WeakPolarHBondContact O-CB 3.42Å; I95-E98 PolarHBondContact O-N 3.5Å; E98-S100 PolarHBondContact O-N 3.48Å; E98-K101 PolarHBondContact O-N 3.05Å; E98-I102 WeakPolarHBondContact O-CD1 3.44Å; E98-I102 VanDerWaalsContact O-CG1 3.29Å; E98-I102 WeakPolarHBondContact O-CG1 3.36Å; E98-I102 PolarHBondContact O-N 3.12Å
99L98.7Very high98.5Very high1 Ų161.7 Ų61.71%0.00529%0.293CS..Hα-helixtrans-58.2-47.2174.5-79.7171.8000111.9I59 R62 R63 W66 I95 K101 I102 C103 F141I59-L99 HydrophobicContact CD1-CD2 3.56Å; I59-L99 HydrophobicContact CG1-CD2 4.28Å; R62-L99 HydrophobicContact CB-CD2 3.64Å; R62-L99 HydrophobicContact CB-CG 4.13Å; R63-L99 HydrophobicContact CB-CD2 4.45Å; R63-L99 HydrophobicContact CG-CD2 3.58Å; W66-L99 HydrophobicContact CB-CD1 3.78Å; W66-L99 HydrophobicContact CG-CD1 3.94Å; I95-L99 HydrophobicContact CG2-CD1 4.22Å; I95-L99 HydrophobicContact CG2-CG 4.42Å; I95-L99 WeakPolarHBondContact O-CB 3.39Å; I95-L99 WeakPolarHBondContact O-CG 3.32Å; I95-L99 PolarHBondContact O-N 3.18Å; L99-K101 VanDerWaalsContact C-N 3.34Å; L99-K101 PolarHBondContact O-N 3.44Å; L99-I102 PolarHBondContact O-N 3.01Å; L99-C103 PolarHBondContact O-N 2.82Å; L99-C103 PolarHBondContact O-SG 2.99Å; L99-F141 HydrophobicContact CB-CD1 4.45Å; L99-F141 HydrophobicContact CB-CE1 3.71Å; L99-F141 HydrophobicContact CB-CZ 3.73Å; L99-F141 HydrophobicContact CD1-CD1 3.96Å; L99-F141 HydrophobicContact CD1-CE1 4.04Å; L99-F141 HydrophobicContact CD1-CG 4.48Å; L99-F141 HydrophobicContact CG-CE1 4.45Å
100S98.7Very high98.5Very high14 Ų1457.8 Ų57.810%0.09828%0.276CS..Hα-helixtrans-58.7-48177.7-58.20000110.3E96 T97 E98 I102 C103 D104 F141E96-S100 WeakPolarHBondContact O-CB 3.31Å; E96-S100 PolarHBondContact O-N 3.42Å; E96-S100 PolarHBondContact O-OG 2.85Å; T97-S100 PolarHBondContact O-N 3.18Å; E98-S100 PolarHBondContact O-N 3.48Å; S100-I102 VanDerWaalsContact C-N 3.33Å; S100-I102 PolarHBondContact O-N 3.19Å; S100-C103 PolarHBondContact O-N 3.35Å; S100-C103 VanDerWaalsContact O-N 3.17Å; S100-D104 WeakPolarHBondContact O-CB 3.26Å; S100-D104 PolarHBondContact O-N 3.15Å; S100-F141 WeakPolarHBondContact OG-CE2 3.29Å; S100-F141 WeakPolarHBondContact OG-CZ 3.41Å
101K98.6Very high98.5Very high168 Ų16855 Ų5573%0.7327%0.265SS*.Hα-helixtrans-58.6-41.8178.1-174.1-178.2177.5-173.50112.8T97 E98 L99 G105T97-K101 WeakPolarHBondContact O-CB 3.4Å; T97-K101 PolarHBondContact O-N 3.37Å; E98-K101 PolarHBondContact O-N 3.05Å; L99-K101 VanDerWaalsContact C-N 3.34Å; L99-K101 PolarHBondContact O-N 3.44Å; K101-G105 PolarHBondContact O-N 2.93Å
102I98.6Very high98.5Very high26 Ų2652 Ų5213%0.13326%0.262CS..Hα-helixtrans-65-46.2177.6-63.5156.9000110.3Y55 V58 I59 R62 E98 L99 S100 G105 I106 Y134Y55-I102 HydrophobicContact CD1-CG2 4.06Å; Y55-I102 HydrophobicContact CE1-CG2 4.44Å; V58-I102 HydrophobicContact CG1-CD1 3.7Å; V58-I102 HydrophobicContact CG1-CG1 3.93Å; V58-I102 HydrophobicContact CG1-CG2 4.19Å; I59-I102 HydrophobicContact CB-CG2 4.05Å; I59-I102 HydrophobicContact CD1-CB 3.79Å; I59-I102 HydrophobicContact CD1-CD1 4.26Å; I59-I102 HydrophobicContact CD1-CG2 3.57Å; I59-I102 HydrophobicContact CG1-CG2 4.35Å; R62-I102 HydrophobicContact CB-CD1 4.13Å; R62-I102 HydrophobicContact CG-CD1 3.93Å; E98-I102 WeakPolarHBondContact O-CD1 3.44Å; E98-I102 VanDerWaalsContact O-CG1 3.29Å; E98-I102 WeakPolarHBondContact O-CG1 3.36Å; E98-I102 PolarHBondContact O-N 3.12Å; L99-I102 PolarHBondContact O-N 3.01Å; S100-I102 VanDerWaalsContact C-N 3.33Å; S100-I102 PolarHBondContact O-N 3.19Å; I102-G105 PolarHBondContact O-N 3.49Å; I102-I106 PolarHBondContact O-N 3.03Å; I102-Y134 HydrophobicContact CG2-CE1 4.48Å
103C98.8Very high98.5Very high0 Ų052.1 Ų52.10%027%0.265CS..Hα-helixtrans-62.5-48.5178.6-62.70000111.4L99 S100 G105 I106 L107 Y134 L138L99-C103 PolarHBondContact O-N 2.82Å; L99-C103 PolarHBondContact O-SG 2.99Å; S100-C103 PolarHBondContact O-N 3.35Å; S100-C103 VanDerWaalsContact O-N 3.17Å; C103-G105 VanDerWaalsContact C-N 3.25Å; C103-G105 PolarHBondContact O-N 2.76Å; C103-I106 VanDerWaalsContact O-CG2 3.24Å; C103-I106 WeakPolarHBondContact O-CG2 3.29Å; C103-I106 PolarHBondContact O-N 3.4Å; C103-L107 HydrophobicContact CB-CD1 4.41Å; C103-L107 VanDerWaalsContact O-CB 3.29Å; C103-L107 WeakPolarHBondContact O-CB 3.47Å; C103-L107 WeakPolarHBondContact O-CG 3.35Å; C103-L107 PolarHBondContact O-N 3.04Å; C103-Y134 HydrophobicContact CB-CD1 4.25Å; C103-L138 HydrophobicContact CB-CD1 4.13Å; C103-L138 HydrophobicContact CB-CD2 3.69Å; C103-L138 HydrophobicContact CB-CG 3.78Å
104D98.5Very high98.5Very high90 Ų9049.3 Ų49.348%0.48125%0.245SC..Hα-helixtrans-61.2-36.5-179.7-65.2-20.3000111.7S100 K108S100-D104 WeakPolarHBondContact O-CB 3.26Å; S100-D104 PolarHBondContact O-N 3.15Å; D104-K108 WeakPolarHBondContact O-CB 3.34Å; D104-K108 PolarHBondContact O-N 3.25Å
105G98Very high98.5Very high20 Ų2044.6 Ų44.621%0.20623%0.232CC..Hα-helixtrans-58.4-55.8175.600000112.6K101 I102 C103 K108 L109K101-G105 PolarHBondContact O-N 2.93Å; I102-G105 PolarHBondContact O-N 3.49Å; C103-G105 VanDerWaalsContact C-N 3.25Å; C103-G105 PolarHBondContact O-N 2.76Å; G105-K108 PolarHBondContact O-N 2.99Å; G105-L109 WeakPolarHBondContact O-CG 3.12Å; G105-L109 PolarHBondContact O-N 3.44Å
106I98.6Very high98.4Very high0 Ų048.7 Ų48.70%026%0.259CS..Hα-helixtrans-70.4-38.9-179.8-175.458.6000112.4L51 Y55 I102 C103 K108 L109 L110 M130 Y134L51-I106 HydrophobicContact CD2-CD1 4.36Å; Y55-I106 HydrophobicContact CD1-CB 3.83Å; Y55-I106 HydrophobicContact CD1-CG1 4.49Å; Y55-I106 HydrophobicContact CD1-CG2 4.28Å; Y55-I106 HydrophobicContact CD2-CB 4.48Å; Y55-I106 HydrophobicContact CD2-CD1 3.94Å; Y55-I106 HydrophobicContact CD2-CG1 4.45Å; Y55-I106 HydrophobicContact CE1-CB 3.64Å; Y55-I106 HydrophobicContact CE1-CG2 4.33Å; Y55-I106 HydrophobicContact CE2-CB 4.29Å; Y55-I106 HydrophobicContact CE2-CD1 3.83Å; Y55-I106 HydrophobicContact CE2-CG1 4.5Å; Y55-I106 HydrophobicContact CG-CB 4.24Å; Y55-I106 HydrophobicContact CG-CD1 4.39Å; Y55-I106 HydrophobicContact CG-CG1 4.42Å; I102-I106 PolarHBondContact O-N 3.03Å; C103-I106 VanDerWaalsContact O-CG2 3.24Å; C103-I106 WeakPolarHBondContact O-CG2 3.29Å; C103-I106 PolarHBondContact O-N 3.4Å; I106-K108 VanDerWaalsContact C-N 3.28Å; I106-K108 PolarHBondContact O-N 2.93Å; I106-L109 PolarHBondContact O-N 3.09Å; I106-L109 VanDerWaalsContact O-N 3.14Å; I106-L110 HydrophobicContact CD1-CD1 4.42Å; I106-L110 HydrophobicContact CD1-CG 4.21Å; I106-L110 HydrophobicContact CG1-CD1 3.87Å; I106-L110 HydrophobicContact CG1-CG 4.18Å; I106-L110 WeakPolarHBondContact O-CB 3.41Å; I106-L110 VanDerWaalsContact O-CG 3.26Å; I106-L110 WeakPolarHBondContact O-CG 3.36Å; I106-L110 PolarHBondContact O-N 3.35Å; I106-M130 HydrophobicContact CD1-CE 4.07Å; I106-M130 HydrophobicContact CD1-SD 4.09Å; I106-M130 HydrophobicContact CG1-CE 4.1Å; I106-M130 HydrophobicContact CG1-SD 4.19Å; I106-Y134 HydrophobicContact CG1-CD2 4.26Å; I106-Y134 HydrophobicContact CG1-CE2 4.22Å; I106-Y134 HydrophobicContact CG2-CD1 3.34Å; I106-Y134 HydrophobicContact CG2-CD2 3.61Å; I106-Y134 HydrophobicContact CG2-CE1 3.64Å; I106-Y134 HydrophobicContact CG2-CE2 3.93Å; I106-Y134 HydrophobicContact CG2-CG 3.34Å
107L98.8Very high98.3Very high12 Ų1248.3 Ų48.36%0.06326%0.26CS..Hα-helixtrans-59.7-41.6177-71.5172.3000110.9C103 L110 D111 K131 L138C103-L107 HydrophobicContact CB-CD1 4.41Å; C103-L107 VanDerWaalsContact O-CB 3.29Å; C103-L107 WeakPolarHBondContact O-CB 3.47Å; C103-L107 WeakPolarHBondContact O-CG 3.35Å; C103-L107 PolarHBondContact O-N 3.04Å; L107-L110 PolarHBondContact O-N 3.18Å; L107-D111 WeakPolarHBondContact O-CB 3.4Å; L107-D111 PolarHBondContact O-N 3.49Å; L107-K131 HydrophobicContact CD2-CB 4.49Å; L107-K131 HydrophobicContact CD2-CG 3.84Å; L107-L138 HydrophobicContact CD1-CD1 3.83Å
108K98.5Very high98.2Very high154 Ų15444.3 Ų44.367%0.6724%0.237SC*.Hα-helixtrans-61.3-45.7174-176.9177.7179.4178.70112D104 G105 I106 L110 D111 S112D104-K108 WeakPolarHBondContact O-CB 3.34Å; D104-K108 PolarHBondContact O-N 3.25Å; G105-K108 PolarHBondContact O-N 2.99Å; I106-K108 VanDerWaalsContact C-N 3.28Å; I106-K108 PolarHBondContact O-N 2.93Å; K108-L110 VanDerWaalsContact C-N 3.34Å; K108-D111 PolarHBondContact O-N 3.46Å; K108-S112 WeakPolarHBondContact O-CB 3.37Å; K108-S112 PolarHBondContact O-N 3.39Å; K108-S112 PolarHBondContact O-OG 3.37Å
109L98.3Very high98.1Very high5 Ų545.4 Ų45.43%0.02625%0.249CC..Hα-helixtrans-63.1-41.3177.5-69175.2000112.2E32 A35 K36 Y55 G105 I106 H113 L114E32-L109 HydrophobicContact CB-CD1 4.15Å; E32-L109 HydrophobicContact CG-CD1 3.82Å; A35-L109 HydrophobicContact CB-CD1 4.22Å; A35-L109 HydrophobicContact CB-CD2 4.23Å; K36-L109 HydrophobicContact CG-CD2 4.06Å; Y55-L109 HydrophobicContact CE2-CD1 4.21Å; Y55-L109 WeakPolarHBondContact OH-CD1 3.4Å; G105-L109 WeakPolarHBondContact O-CG 3.12Å; G105-L109 PolarHBondContact O-N 3.44Å; I106-L109 PolarHBondContact O-N 3.09Å; I106-L109 VanDerWaalsContact O-N 3.14Å; L109-H113 PolarHBondContact O-N 3.31Å; L109-L114 HydrophobicContact CB-CD1 4.23Å; L109-L114 PolarHBondContact O-N 3.34Å
110L98.6Very high98Very high0 Ų047.5 Ų47.50%027%0.267CS..Iπ-helixtrans-59-49.5177-72.7165.4000110.7I106 L107 K108 L114 V115 P116 Y127 M130 K131I106-L110 HydrophobicContact CD1-CD1 4.42Å; I106-L110 HydrophobicContact CD1-CG 4.21Å; I106-L110 HydrophobicContact CG1-CD1 3.87Å; I106-L110 HydrophobicContact CG1-CG 4.18Å; I106-L110 WeakPolarHBondContact O-CB 3.41Å; I106-L110 VanDerWaalsContact O-CG 3.26Å; I106-L110 WeakPolarHBondContact O-CG 3.36Å; I106-L110 PolarHBondContact O-N 3.35Å; L107-L110 PolarHBondContact O-N 3.18Å; K108-L110 VanDerWaalsContact C-N 3.34Å; L110-L114 HydrophobicContact CD2-CB 4.27Å; L110-L114 HydrophobicContact CD2-CD1 3.88Å; L110-L114 HydrophobicContact CG-CD1 4.31Å; L110-L114 PolarHBondContact O-N 3.49Å; L110-V115 HydrophobicContact CB-CG2 4.36Å; L110-V115 VanDerWaalsContact O-CB 3.27Å; L110-V115 WeakPolarHBondContact O-CB 3.34Å; L110-V115 WeakPolarHBondContact O-CG2 3.36Å; L110-V115 PolarHBondContact O-N 2.95Å; L110-P116 WeakPolarHBondContact O-CD 3.04Å; L110-Y127 HydrophobicContact CD2-CD1 3.81Å; L110-Y127 HydrophobicContact CD2-CG 4.06Å; L110-M130 HydrophobicContact CD1-CB 4.28Å; L110-M130 HydrophobicContact CD1-CG 4.22Å; L110-M130 HydrophobicContact CD2-CB 4.37Å; L110-M130 HydrophobicContact CD2-SD 4.34Å; L110-K131 HydrophobicContact CD1-CB 3.98Å
111D98.4Very high98Very high78 Ų7848 Ų4842%0.41727%0.272SS..Iπ-helixtrans-74.2-35.5-175.3-73.3-13.5000113.6L107 K108 P116 K131L107-D111 WeakPolarHBondContact O-CB 3.4Å; L107-D111 PolarHBondContact O-N 3.49Å; K108-D111 PolarHBondContact O-N 3.46Å; D111-P116 WeakPolarHBondContact O-CG 3.41Å; D111-K131 VanDerWaalsContact CG-NZ 3.25Å; D111-K131 WeakPolarHBondContact OD1-CE 3.39Å; D111-K131 IonicContact OD1-NZ 3.34Å; D111-K131 PolarHBondContact OD1-NZ 2.97Å; D111-K131 IonicContact OD2-NZ 2.77Å; D111-K131 PolarHBondContact OD2-NZ 2.73Å; D111-K131 VanDerWaalsContact OD2-NZ 3.09Å
112S97.7Very high97.9Very high58 Ų5843.8 Ų43.841%0.40625%0.254SS..Iπ-helixtrans-91.1-27-174.756.80000114.7K108K108-S112 WeakPolarHBondContact O-CB 3.37Å; K108-S112 PolarHBondContact O-N 3.39Å; K108-S112 PolarHBondContact O-OG 3.37Å
113H97.7Very high97.9Very high53 Ų5342.9 Ų42.925%0.24525%0.25CS..Iπ-helixtrans-130.2-54-172-60.5-73.4000113.2A35 T38 L109 S117A35-H113 WeakPolarHBondContact O-CB 3.43Å; T38-H113 HydrophobicContact CG2-CB 4.2Å; L109-H113 PolarHBondContact O-N 3.31Å; H113-S117 WeakPolarHBondContact O-CB 3.31Å; H113-S117 PolarHBondContact O-N 3.35Å; H113-S117 VanDerWaalsContact O-N 3.11Å; H113-S117 PolarHBondContact O-OG 3.32Å; H113-S117 VanDerWaalsContact O-OG 3.07Å
114L98.4Very high97.9Very high0 Ų046.8 Ų46.80%027%0.267CS..Iπ-helixtrans-77.5-51.9-164.3-57.3167.8000112.8A35 T38 L43 L51 L109 L110 S117 A118 Y127A35-L114 HydrophobicContact CB-CD2 3.97Å; A35-L114 HydrophobicContact CB-CG 4.44Å; T38-L114 HydrophobicContact CG2-CD2 4.39Å; L43-L114 HydrophobicContact CD1-CD2 3.61Å; L43-L114 HydrophobicContact CD2-CD2 3.7Å; L43-L114 HydrophobicContact CG-CD2 4.28Å; L51-L114 HydrophobicContact CD2-CD1 3.51Å; L51-L114 HydrophobicContact CD2-CD2 4.37Å; L109-L114 HydrophobicContact CB-CD1 4.23Å; L109-L114 PolarHBondContact O-N 3.34Å; L110-L114 HydrophobicContact CD2-CB 4.27Å; L110-L114 HydrophobicContact CD2-CD1 3.88Å; L110-L114 HydrophobicContact CG-CD1 4.31Å; L110-L114 PolarHBondContact O-N 3.49Å; L114-S117 PolarHBondContact O-N 3.5Å; L114-S117 PolarHBondContact O-OG 3.34Å; L114-A118 PolarHBondContact O-N 2.94Å; L114-A118 VanDerWaalsContact O-N 3.13Å; L114-Y127 HydrophobicContact CB-CD1 3.93Å; L114-Y127 HydrophobicContact CB-CD2 4Å; L114-Y127 HydrophobicContact CB-CE1 3.95Å; L114-Y127 HydrophobicContact CB-CE2 4.03Å; L114-Y127 HydrophobicContact CB-CG 3.99Å; L114-Y127 HydrophobicContact CD1-CD1 4.28Å; L114-Y127 HydrophobicContact CD1-CE1 4.18Å; L114-Y127 HydrophobicContact CD2-CE1 4.24Å; L114-Y127 HydrophobicContact CG-CE1 4.36Å; L114-Y127 WeakPolarHBondContact O-CD2 3.44Å
115V98.1Very high97.9Very high46 Ų4642.5 Ų42.528%0.27924%0.244SC..Hα-helixtrans-61.4-45.6177.4175.40000111.2L110 S117 A118 L128L110-V115 HydrophobicContact CB-CG2 4.36Å; L110-V115 VanDerWaalsContact O-CB 3.27Å; L110-V115 WeakPolarHBondContact O-CB 3.34Å; L110-V115 WeakPolarHBondContact O-CG2 3.36Å; L110-V115 PolarHBondContact O-N 2.95Å; V115-S117 VanDerWaalsContact C-N 3.29Å; V115-S117 PolarHBondContact O-N 3.03Å; V115-A118 PolarHBondContact O-N 3.28Å; V115-L128 HydrophobicContact CG1-CD2 4.43Å
116P97.5Very high97.9Very high90 Ų9042.9 Ų42.958%0.58424%0.241SC*.Hα-helixtrans-62.1-32175.4-25.435.5000114.5L110 D111L110-P116 WeakPolarHBondContact O-CD 3.04Å; D111-P116 WeakPolarHBondContact O-CG 3.41Å
117S96.8Very high97.9Very high21 Ų2142.9 Ų42.915%0.14724%0.241CC..Hα-helixtrans-80.2-18-179.872.50000114.4T38 H113 L114 V115 T119T38-S117 WeakPolarHBondContact CG2-OG 3.41Å; H113-S117 WeakPolarHBondContact O-CB 3.31Å; H113-S117 PolarHBondContact O-N 3.35Å; H113-S117 VanDerWaalsContact O-N 3.11Å; H113-S117 PolarHBondContact O-OG 3.32Å; H113-S117 VanDerWaalsContact O-OG 3.07Å; L114-S117 PolarHBondContact O-N 3.5Å; L114-S117 PolarHBondContact O-OG 3.34Å; V115-S117 VanDerWaalsContact C-N 3.29Å; V115-S117 PolarHBondContact O-N 3.03Å; S117-T119 PolarHBondContact O-N 2.92Å
118A97.2Very high97.9Very high9 Ų943.5 Ų43.57%0.07424%0.244CC..  trans-73.5115.2-171.200000111.8L114 V115 K124 Y127L114-A118 PolarHBondContact O-N 2.94Å; L114-A118 VanDerWaalsContact O-N 3.13Å; V115-A118 PolarHBondContact O-N 3.28Å; A118-K124 HydrophobicContact CB-CG 3.8Å; A118-K124 WeakPolarHBondContact O-CE 3.49Å; A118-Y127 HydrophobicContact CB-CD2 3.75Å; A118-Y127 HydrophobicContact CB-CE2 3.9Å
119T96.1Very high97.9Very high109 Ų10937.9 Ų37.967%0.66922%0.22SC*.  trans-98.3-44.2177.7610000111.6E42 S117 K124E42-T119 PolarHBondContact OE2-N 3.32Å; E42-T119 PolarHBondContact OE2-OG1 2.89Å; S117-T119 PolarHBondContact O-N 2.92Å; T119-K124 WeakPolarHBondContact O-CE 3.2Å; T119-K124 PolarHBondContact O-NZ 3.14Å
120A96.2Very high97.9Very high45 Ų4538.1 Ų38.137%0.37222%0.221SC..SBendtrans-69.4143.917900000112.2E122 S123 K124A120-E122 VanDerWaalsContact C-N 3.31Å; A120-E122 PolarHBondContact O-N 2.87Å; A120-S123 PolarHBondContact O-N 3.35Å; A120-K124 WeakPolarHBondContact O-CG 3.38Å; A120-K124 PolarHBondContact O-N 3.28Å
121A97.8Very high98Very high25 Ų2540.1 Ų40.121%0.20723%0.229CC..Hα-helixtrans-56.7-46.1176.600000111.3S123 K124 V125 I164 D168 L169A121-S123 PolarHBondContact O-N 3.1Å; A121-K124 WeakPolarHBondContact O-CB 3.35Å; A121-K124 PolarHBondContact O-N 3.22Å; A121-V125 WeakPolarHBondContact O-CG2 3.47Å; A121-V125 PolarHBondContact O-N 3.38Å; A121-I164 HydrophobicContact CB-CG2 4.15Å; A121-D168 HydrophobicContact CB-CB 3.52Å; A121-L169 HydrophobicContact CB-CD2 4.41Å
122E97.3Very high98Very high78 Ų7836.4 Ų36.436%0.36421%0.209SC..Hα-helixtrans-53.5-49.1176.9-71.7-178.9-162.900113.1A120 V125 F126 L169 H173 I175A120-E122 VanDerWaalsContact C-N 3.31Å; A120-E122 PolarHBondContact O-N 2.87Å; E122-V125 PolarHBondContact O-N 2.96Å; E122-F126 VanDerWaalsContact O-CB 3.24Å; E122-F126 WeakPolarHBondContact O-CB 3.36Å; E122-F126 PolarHBondContact O-N 2.66Å; E122-L169 HydrophobicContact CG-CD2 3.71Å; E122-H173 IonicContact OE1-NE2 3.37Å; E122-H173 PolarHBondContact OE1-NE2 2.93Å; E122-I175 HydrophobicContact CB-CD1 4.09Å
123S98.1Very high98Very high7 Ų734 Ų345%0.04919%0.192CC..Hα-helixtrans-64.3-41.3179.2-630000112.1E42 A120 A121 F126 Y127E42-S123 WeakPolarHBondContact OE1-CB 2.88Å; E42-S123 PolarHBondContact OE1-OG 2.76Å; A120-S123 PolarHBondContact O-N 3.35Å; A121-S123 PolarHBondContact O-N 3.1Å; S123-F126 WeakPolarHBondContact O-CB 3.46Å; S123-F126 PolarHBondContact O-N 3.46Å; S123-Y127 WeakPolarHBondContact O-CD2 3.27Å; S123-Y127 PolarHBondContact O-N 3.01Å
124K98.6Very high98.1Very high82 Ų8231.9 Ų31.936%0.35718%0.182SC..Hα-helixtrans-60.1-50.4175.7-70.2170.4179.7163.60111.1A118 T119 A120 A121 F126 Y127 L128 I164A118-K124 HydrophobicContact CB-CG 3.8Å; A118-K124 WeakPolarHBondContact O-CE 3.49Å; T119-K124 WeakPolarHBondContact O-CE 3.2Å; T119-K124 PolarHBondContact O-NZ 3.14Å; A120-K124 WeakPolarHBondContact O-CG 3.38Å; A120-K124 PolarHBondContact O-N 3.28Å; A121-K124 WeakPolarHBondContact O-CB 3.35Å; A121-K124 PolarHBondContact O-N 3.22Å; K124-F126 VanDerWaalsContact C-N 3.31Å; K124-F126 PolarHBondContact O-N 3.18Å; K124-Y127 PolarHBondContact O-N 3.06Å; K124-L128 WeakPolarHBondContact O-CB 3.48Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.39Å; K124-L128 PolarHBondContact O-N 3.27Å; K124-I164 HydrophobicContact CB-CD1 3.94Å; K124-I164 HydrophobicContact CD-CD1 4.35Å
125V98.8Very high98.1Very high0 Ų032.8 Ų32.80%019%0.186CC..Hα-helixtrans-62-42.3177.7-175.60000110.4A121 E122 K129 A161 I164 A165 L169 I175 L179A121-V125 WeakPolarHBondContact O-CG2 3.47Å; A121-V125 PolarHBondContact O-N 3.38Å; E122-V125 PolarHBondContact O-N 2.96Å; V125-K129 WeakPolarHBondContact O-CB 3.49Å; V125-K129 PolarHBondContact O-N 3.03Å; V125-A161 HydrophobicContact CG1-CB 4.27Å; V125-I164 HydrophobicContact CG2-CB 3.85Å; V125-I164 HydrophobicContact CG2-CG2 3.56Å; V125-A165 HydrophobicContact CG1-CB 3.91Å; V125-A165 HydrophobicContact CG2-CB 4.01Å; V125-L169 HydrophobicContact CB-CD1 4.05Å; V125-L169 HydrophobicContact CG1-CD1 4.22Å; V125-L169 HydrophobicContact CG2-CD1 3.77Å; V125-L169 HydrophobicContact CG2-CG 4.49Å; V125-I175 HydrophobicContact CB-CG2 3.96Å; V125-I175 HydrophobicContact CG1-CG2 3.61Å; V125-L179 HydrophobicContact CG1-CD2 4.09Å
126F98.6Very high98.1Very high29 Ų2931.1 Ų31.113%0.12718%0.175CC..Hα-helixtrans-58.1-52.2178.9-171.2-83.3000112.1R48 E122 S123 K124 M130 I175R48-F126 HydrophobicContact CG-CD1 3.57Å; R48-F126 HydrophobicContact CG-CD2 4.42Å; R48-F126 HydrophobicContact CG-CE1 3.35Å; R48-F126 HydrophobicContact CG-CE2 4.23Å; R48-F126 HydrophobicContact CG-CG 4.1Å; R48-F126 HydrophobicContact CG-CZ 3.69Å; E122-F126 VanDerWaalsContact O-CB 3.24Å; E122-F126 WeakPolarHBondContact O-CB 3.36Å; E122-F126 PolarHBondContact O-N 2.66Å; S123-F126 WeakPolarHBondContact O-CB 3.46Å; S123-F126 PolarHBondContact O-N 3.46Å; K124-F126 VanDerWaalsContact C-N 3.31Å; K124-F126 PolarHBondContact O-N 3.18Å; F126-M130 HydrophobicContact CE1-SD 4.28Å; F126-M130 WeakPolarHBondContact O-CB 3.34Å; F126-M130 PolarHBondContact O-N 2.7Å; F126-I175 HydrophobicContact CB-CD1 4.29Å; F126-I175 HydrophobicContact CD2-CD1 4.05Å; F126-I175 HydrophobicContact CD2-CG1 4.42Å
127Y98.8Very high98.2Very high0 Ų028 Ų280%015%0.152CC..Hα-helixtrans-70.9-39.1-177.4-62.8-43.1000112.5R48 L110 L114 A118 S123 K124 M130 K131R48-Y127 HydrophobicContact CG-CE1 3.88Å; L110-Y127 HydrophobicContact CD2-CD1 3.81Å; L110-Y127 HydrophobicContact CD2-CG 4.06Å; L114-Y127 HydrophobicContact CB-CD1 3.93Å; L114-Y127 HydrophobicContact CB-CD2 4Å; L114-Y127 HydrophobicContact CB-CE1 3.95Å; L114-Y127 HydrophobicContact CB-CE2 4.03Å; L114-Y127 HydrophobicContact CB-CG 3.99Å; L114-Y127 HydrophobicContact CD1-CD1 4.28Å; L114-Y127 HydrophobicContact CD1-CE1 4.18Å; L114-Y127 HydrophobicContact CD2-CE1 4.24Å; L114-Y127 HydrophobicContact CG-CE1 4.36Å; L114-Y127 WeakPolarHBondContact O-CD2 3.44Å; A118-Y127 HydrophobicContact CB-CD2 3.75Å; A118-Y127 HydrophobicContact CB-CE2 3.9Å; S123-Y127 WeakPolarHBondContact O-CD2 3.27Å; S123-Y127 PolarHBondContact O-N 3.01Å; K124-Y127 PolarHBondContact O-N 3.06Å; Y127-M130 PolarHBondContact O-N 3.09Å; Y127-K131 WeakPolarHBondContact O-CB 3.33Å; Y127-K131 PolarHBondContact O-N 2.9Å
128L98.9Very high98.3Very high25 Ų2527.8 Ų27.813%0.13115%0.149CC..Hα-helixtrans-67.5-40.1176.1-69.8169.5000111.7V115 K124 M130 K131 G132 A161 I164V115-L128 HydrophobicContact CG1-CD2 4.43Å; K124-L128 WeakPolarHBondContact O-CB 3.48Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.39Å; K124-L128 PolarHBondContact O-N 3.27Å; L128-M130 VanDerWaalsContact C-N 3.35Å; L128-K131 WeakPolarHBondContact O-CB 3.47Å; L128-K131 PolarHBondContact O-N 3.33Å; L128-G132 PolarHBondContact O-N 2.97Å; L128-A161 HydrophobicContact CB-CB 3.68Å; L128-I164 HydrophobicContact CD1-CD1 3.82Å
129K98.8Very high98.4Very high36 Ų3627.4 Ų27.416%0.15715%0.145CC..Hα-helixtrans-58.8-48.3170.6178.5-169.5171.9-66.30110.6V125 K131 G132 D133 Y158 G178 L179 N182V125-K129 WeakPolarHBondContact O-CB 3.49Å; V125-K129 PolarHBondContact O-N 3.03Å; K129-K131 VanDerWaalsContact C-N 3.32Å; K129-K131 PolarHBondContact O-N 3.45Å; K129-G132 PolarHBondContact O-N 2.59Å; K129-D133 IonicContact NZ-OD2 2.71Å; K129-D133 PolarHBondContact NZ-OD2 3.42Å; K129-D133 PolarHBondContact O-N 3.17Å; K129-Y158 HydrophobicContact CG-CE1 4.4Å; K129-Y158 WeakPolarHBondContact O-CE1 3.42Å; K129-G178 WeakPolarHBondContact CE-O 3.42Å; K129-L179 HydrophobicContact CB-CD1 4.08Å; K129-L179 HydrophobicContact CD-CB 4.08Å; K129-L179 HydrophobicContact CG-CB 4.32Å; K129-L179 HydrophobicContact CG-CD1 3.99Å; K129-N182 PolarHBondContact NZ-ND2 2.83Å
130M98.7Very high98.4Very high10 Ų1023.6 Ų23.65%0.04912%0.12CC..Hα-helixtrans-59.7-43.3178-165.2175.3-15600111I106 L110 F126 Y127 L128 G132 D133 Y134I106-M130 HydrophobicContact CD1-CE 4.07Å; I106-M130 HydrophobicContact CD1-SD 4.09Å; I106-M130 HydrophobicContact CG1-CE 4.1Å; I106-M130 HydrophobicContact CG1-SD 4.19Å; L110-M130 HydrophobicContact CD1-CB 4.28Å; L110-M130 HydrophobicContact CD1-CG 4.22Å; L110-M130 HydrophobicContact CD2-CB 4.37Å; L110-M130 HydrophobicContact CD2-SD 4.34Å; F126-M130 HydrophobicContact CE1-SD 4.28Å; F126-M130 WeakPolarHBondContact O-CB 3.34Å; F126-M130 PolarHBondContact O-N 2.7Å; Y127-M130 PolarHBondContact O-N 3.09Å; L128-M130 VanDerWaalsContact C-N 3.35Å; M130-G132 VanDerWaalsContact C-N 3.33Å; M130-G132 PolarHBondContact O-N 2.96Å; M130-D133 WeakPolarHBondContact O-CB 3.36Å; M130-D133 PolarHBondContact O-N 3.13Å; M130-D133 VanDerWaalsContact O-N 3.14Å; M130-Y134 HydrophobicContact CE-CE2 3.92Å; M130-Y134 HydrophobicContact CG-CD2 3.94Å; M130-Y134 HydrophobicContact CG-CE2 3.79Å; M130-Y134 VanDerWaalsContact O-CD2 3.29Å; M130-Y134 WeakPolarHBondContact O-CD2 3.28Å; M130-Y134 PolarHBondContact O-N 3.35Å
131K98.9Very high98.5Very high42 Ų4222.4 Ų22.418%0.18311%0.107CC..Hα-helixtrans-56.4-47.1174.1-176.1170-177.3169.50111.7L107 L110 D111 Y127 L128 K129 D133 Y134 H135 A157L107-K131 HydrophobicContact CD2-CB 4.49Å; L107-K131 HydrophobicContact CD2-CG 3.84Å; L110-K131 HydrophobicContact CD1-CB 3.98Å; D111-K131 VanDerWaalsContact CG-NZ 3.25Å; D111-K131 WeakPolarHBondContact OD1-CE 3.39Å; D111-K131 IonicContact OD1-NZ 3.34Å; D111-K131 PolarHBondContact OD1-NZ 2.97Å; D111-K131 IonicContact OD2-NZ 2.77Å; D111-K131 PolarHBondContact OD2-NZ 2.73Å; D111-K131 VanDerWaalsContact OD2-NZ 3.09Å; Y127-K131 WeakPolarHBondContact O-CB 3.33Å; Y127-K131 PolarHBondContact O-N 2.9Å; L128-K131 WeakPolarHBondContact O-CB 3.47Å; L128-K131 PolarHBondContact O-N 3.33Å; K129-K131 VanDerWaalsContact C-N 3.32Å; K129-K131 PolarHBondContact O-N 3.45Å; K131-D133 PolarHBondContact O-N 2.91Å; K131-Y134 PolarHBondContact O-N 3.23Å; K131-H135 PolarHBondContact O-CD2 2.93Å; K131-H135 VanDerWaalsContact O-CD2 3.29Å; K131-H135 PolarHBondContact O-N 3.41Å; K131-H135 VanDerWaalsContact O-N 3.08Å; K131-A157 HydrophobicContact CB-CB 4.17Å; K131-A157 HydrophobicContact CD-CB 4.43Å; K131-A157 HydrophobicContact CG-CB 4.05Å
132G98.9Very high98.5Very high0 Ų023.6 Ų23.60%011%0.107CC..Hα-helixtrans-60.4-42.9174.900000112.7L128 K129 M130 Y134 H135 R136 T154L128-G132 PolarHBondContact O-N 2.97Å; K129-G132 PolarHBondContact O-N 2.59Å; M130-G132 VanDerWaalsContact C-N 3.33Å; M130-G132 PolarHBondContact O-N 2.96Å; G132-Y134 PolarHBondContact O-N 3.03Å; G132-H135 PolarHBondContact O-N 3.49Å; G132-R136 VanDerWaalsContact O-CB 3.26Å; G132-R136 WeakPolarHBondContact O-CB 3.35Å; G132-R136 PolarHBondContact O-N 3.37Å; G132-T154 WeakPolarHBondContact O-CG2 3.24Å
133D98.8Very high98.5Very high8 Ų824 Ų244%0.04312%0.118CC..Hα-helixtrans-58.7-45.3177.2-82.4-48.5000112.6K129 M130 K131 R136 Y137 Y158 N182K129-D133 IonicContact NZ-OD2 2.71Å; K129-D133 PolarHBondContact NZ-OD2 3.42Å; K129-D133 PolarHBondContact O-N 3.17Å; M130-D133 WeakPolarHBondContact O-CB 3.36Å; M130-D133 PolarHBondContact O-N 3.13Å; M130-D133 VanDerWaalsContact O-N 3.14Å; K131-D133 PolarHBondContact O-N 2.91Å; D133-R136 WeakPolarHBondContact O-CB 3.43Å; D133-R136 PolarHBondContact O-N 3Å; D133-R136 IonicContact OD1-CZ 3.14Å; D133-R136 IonicContact OD1-NE 3.95Å; D133-R136 IonicContact OD1-NH2 3.07Å; D133-R136 PolarHBondContact OD1-NH2 2.95Å; D133-Y137 HydrophobicContact CB-CE2 4.38Å; D133-Y137 VanDerWaalsContact O-CD1 3.29Å; D133-Y137 WeakPolarHBondContact O-CD1 3.49Å; D133-Y137 VanDerWaalsContact O-CD2 3.31Å; D133-Y137 WeakPolarHBondContact O-CD2 3.39Å; D133-Y137 PolarHBondContact O-N 3.22Å; D133-Y158 PolarHBondContact N-OH 2.81Å; D133-Y158 PolarHBondContact OD1-OH 3.29Å; D133-N182 WeakPolarHBondContact OD1-CB 3.07Å; D133-N182 PolarHBondContact OD1-ND2 3.25Å; D133-N182 PolarHBondContact OD2-ND2 2.98Å
134Y98.8Very high98.5Very high7 Ų726.5 Ų26.53%0.02715%0.146CC..Hα-helixtrans-75.9-34.3-178.4-78.3-86.5000113.4Y55 I59 I102 C103 I106 M130 K131 G132 R136 Y137 L138Y55-Y134 VanDerWaalsContact CB-OH 3.25Å; Y55-Y134 WeakPolarHBondContact CB-OH 3.42Å; Y55-Y134 PolarHBondContact O-OH 2.91Å; I59-Y134 HydrophobicContact CB-CE1 3.94Å; I59-Y134 HydrophobicContact CD1-CE1 4.24Å; I59-Y134 HydrophobicContact CG1-CD1 4.47Å; I59-Y134 HydrophobicContact CG1-CE1 3.9Å; I59-Y134 HydrophobicContact CG2-CE1 3.97Å; I59-Y134 WeakPolarHBondContact CG2-OH 3.13Å; I102-Y134 HydrophobicContact CG2-CE1 4.48Å; C103-Y134 HydrophobicContact CB-CD1 4.25Å; I106-Y134 HydrophobicContact CG1-CD2 4.26Å; I106-Y134 HydrophobicContact CG1-CE2 4.22Å; I106-Y134 HydrophobicContact CG2-CD1 3.34Å; I106-Y134 HydrophobicContact CG2-CD2 3.61Å; I106-Y134 HydrophobicContact CG2-CE1 3.64Å; I106-Y134 HydrophobicContact CG2-CE2 3.93Å; I106-Y134 HydrophobicContact CG2-CG 3.34Å; M130-Y134 HydrophobicContact CE-CE2 3.92Å; M130-Y134 HydrophobicContact CG-CD2 3.94Å; M130-Y134 HydrophobicContact CG-CE2 3.79Å; M130-Y134 VanDerWaalsContact O-CD2 3.29Å; M130-Y134 WeakPolarHBondContact O-CD2 3.28Å; M130-Y134 PolarHBondContact O-N 3.35Å; K131-Y134 PolarHBondContact O-N 3.23Å; G132-Y134 PolarHBondContact O-N 3.03Å; Y134-R136 VanDerWaalsContact C-N 3.28Å; Y134-R136 PolarHBondContact O-N 2.65Å; Y134-Y137 AromaticContact CD1-CD2 3.82Å; Y134-Y137 HydrophobicContact CD1-CD2 3.82Å; Y134-Y137 HydrophobicContact CD1-CE2 4.26Å; Y134-Y137 HydrophobicContact CE1-CD2 4.06Å; Y134-Y137 HydrophobicContact CE1-CE2 4.17Å; Y134-Y137 HydrophobicContact CE2-CE2 4.49Å; Y134-Y137 HydrophobicContact CG-CD2 4.2Å; Y134-Y137 HydrophobicContact CG-CE2 4.48Å; Y134-Y137 PolarHBondContact O-N 3.29Å; Y134-L138 PolarHBondContact O-N 3.46Å; Y134-L138 VanDerWaalsContact O-N 3.11Å
135H98.9Very high98.5Very high20 Ų2026.5 Ų26.59%0.09316%0.161CC..Hα-helixtrans-64.3-36.3168.3-79-63.2000112K131 G132 Y137 L138 A139 N153 T154K131-H135 PolarHBondContact O-CD2 2.93Å; K131-H135 VanDerWaalsContact O-CD2 3.29Å; K131-H135 PolarHBondContact O-N 3.41Å; K131-H135 VanDerWaalsContact O-N 3.08Å; G132-H135 PolarHBondContact O-N 3.49Å; H135-Y137 VanDerWaalsContact C-N 3.33Å; H135-Y137 PolarHBondContact O-N 2.71Å; H135-L138 WeakPolarHBondContact O-CB 3.46Å; H135-L138 PolarHBondContact O-N 3.23Å; H135-A139 PolarHBondContact O-N 3.15Å; H135-N153 HydrophobicContact CB-CB 4.23Å; H135-T154 VanDerWaalsContact CB-OG1 3.27Å; H135-T154 WeakPolarHBondContact CB-OG1 3.35Å
136R98.7Very high98.4Very high10 Ų1031.3 Ų31.34%0.03818%0.183CC..Hα-helixtrans-62.8-42.7175.5-177.1173.962.196.3-12.6111.2G132 D133 Y134 L138 A139 E140 T154 Y158 F186 E189 I190G132-R136 VanDerWaalsContact O-CB 3.26Å; G132-R136 WeakPolarHBondContact O-CB 3.35Å; G132-R136 PolarHBondContact O-N 3.37Å; D133-R136 WeakPolarHBondContact O-CB 3.43Å; D133-R136 PolarHBondContact O-N 3Å; D133-R136 IonicContact OD1-CZ 3.14Å; D133-R136 IonicContact OD1-NE 3.95Å; D133-R136 IonicContact OD1-NH2 3.07Å; D133-R136 PolarHBondContact OD1-NH2 2.95Å; Y134-R136 VanDerWaalsContact C-N 3.28Å; Y134-R136 PolarHBondContact O-N 2.65Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.11Å; R136-A139 WeakPolarHBondContact O-CB 3.4Å; R136-A139 PolarHBondContact O-N 3.41Å; R136-E140 IonicContact NH1-OE1 2.65Å; R136-E140 PolarHBondContact O-N 3.17Å; R136-E140 VanDerWaalsContact O-N 3.15Å; R136-T154 WeakPolarHBondContact CA-OG1 3.42Å; R136-T154 HydrophobicContact CB-CG2 3.82Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.01Å; R136-Y158 PolarHBondContact NE-OH 3.13Å; R136-F186 HydrophobicContact CG-CD2 4.19Å; R136-E189 IonicContact NH1-OE2 2.74Å; R136-I190 HydrophobicContact CG-CG1 3.98Å
137Y98.7Very high98.4Very high26 Ų2635.1 Ų35.110%0.10220%0.197CC..Hα-helixtrans-61.4-39.1175.5-58-24.5000112I59 R63 D133 Y134 H135 A139 E140 F141I59-Y137 HydrophobicContact CG1-CD2 3.8Å; I59-Y137 HydrophobicContact CG1-CE2 4.25Å; I59-Y137 HydrophobicContact CG2-CD2 4.39Å; I59-Y137 HydrophobicContact CG2-CE2 4Å; R63-Y137 VanDerWaalsContact CZ-CE1 3.5Å; D133-Y137 HydrophobicContact CB-CE2 4.38Å; D133-Y137 VanDerWaalsContact O-CD1 3.29Å; D133-Y137 WeakPolarHBondContact O-CD1 3.49Å; D133-Y137 VanDerWaalsContact O-CD2 3.31Å; D133-Y137 WeakPolarHBondContact O-CD2 3.39Å; D133-Y137 PolarHBondContact O-N 3.22Å; Y134-Y137 AromaticContact CD1-CD2 3.82Å; Y134-Y137 HydrophobicContact CD1-CD2 3.82Å; Y134-Y137 HydrophobicContact CD1-CE2 4.26Å; Y134-Y137 HydrophobicContact CE1-CD2 4.06Å; Y134-Y137 HydrophobicContact CE1-CE2 4.17Å; Y134-Y137 HydrophobicContact CE2-CE2 4.49Å; Y134-Y137 HydrophobicContact CG-CD2 4.2Å; Y134-Y137 HydrophobicContact CG-CE2 4.48Å; Y134-Y137 PolarHBondContact O-N 3.29Å; H135-Y137 VanDerWaalsContact C-N 3.33Å; H135-Y137 PolarHBondContact O-N 2.71Å; Y137-A139 VanDerWaalsContact C-N 3.33Å; Y137-A139 PolarHBondContact O-N 3.3Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.07Å; Y137-E140 WeakPolarHBondContact O-CB 3.26Å; Y137-E140 PolarHBondContact O-N 3.14Å; Y137-F141 WeakPolarHBondContact O-CD1 3.39Å; Y137-F141 WeakPolarHBondContact O-CE1 3.23Å
138L98.8Very high98.4Very high16 Ų1641.5 Ų41.58%0.08423%0.225CC..Hα-helixtrans-59.9-43.7171.1-68.5172.7000111.3C103 L107 Y134 H135 R136 E140 F141 K142 A150C103-L138 HydrophobicContact CB-CD1 4.13Å; C103-L138 HydrophobicContact CB-CD2 3.69Å; C103-L138 HydrophobicContact CB-CG 3.78Å; L107-L138 HydrophobicContact CD1-CD1 3.83Å; Y134-L138 PolarHBondContact O-N 3.46Å; Y134-L138 VanDerWaalsContact O-N 3.11Å; H135-L138 WeakPolarHBondContact O-CB 3.46Å; H135-L138 PolarHBondContact O-N 3.23Å; R136-L138 VanDerWaalsContact C-N 3.31Å; R136-L138 PolarHBondContact O-N 3.11Å; L138-E140 PolarHBondContact O-N 2.69Å; L138-F141 HydrophobicContact CD2-CE1 4.17Å; L138-F141 HydrophobicContact CD2-CZ 3.71Å; L138-F141 PolarHBondContact O-N 2.98Å; L138-K142 HydrophobicContact CB-CG 4.4Å; L138-K142 WeakPolarHBondContact O-CB 3.43Å; L138-K142 WeakPolarHBondContact O-CG 3.33Å; L138-K142 PolarHBondContact O-N 2.82Å; L138-A150 HydrophobicContact CB-CB 3.89Å
139A98.6Very high98.4Very high0 Ų045.9 Ų45.90%024%0.244CC..Hα-helixtrans-65-19.7179.700000114.2H135 R136 Y137 A150 I190H135-A139 PolarHBondContact O-N 3.15Å; R136-A139 WeakPolarHBondContact O-CB 3.4Å; R136-A139 PolarHBondContact O-N 3.41Å; Y137-A139 VanDerWaalsContact C-N 3.33Å; Y137-A139 PolarHBondContact O-N 3.3Å; A139-A150 HydrophobicContact CB-CB 3.87Å; A139-I190 HydrophobicContact CB-CD1 4.31Å; A139-I190 HydrophobicContact CB-CG2 3.85Å
140E98Very high98.4Very high30 Ų3044.3 Ų44.314%0.1424%0.238CC..Hα-helixtrans-65.6-38.4176.9-71.9171.5-153.700112.6R63 W66 R67 R136 Y137 L138 I190R63-E140 IonicContact CZ-OE1 3.47Å; R63-E140 IonicContact CZ-OE2 3.88Å; R63-E140 IonicContact NE-OE1 2.66Å; R63-E140 PolarHBondContact NE-OE1 3.25Å; R63-E140 IonicContact NE-OE2 3.79Å; R63-E140 PolarHBondContact NE-OE2 2.97Å; R63-E140 VanDerWaalsContact NH2-CD 3.26Å; R63-E140 IonicContact NH2-OE1 3.61Å; R63-E140 PolarHBondContact NH2-OE1 2.96Å; R63-E140 IonicContact NH2-OE2 3.09Å; R63-E140 PolarHBondContact NH2-OE2 3.43Å; W66-E140 HydrophobicContact CH2-CB 4.47Å; W66-E140 WeakPolarHBondContact CH2-O 3.22Å; W66-E140 HydrophobicContact CZ3-CB 4.4Å; R67-E140 IonicContact CZ-OE2 2.96Å; R67-E140 IonicContact NH2-OE2 2.66Å; R67-E140 PolarHBondContact NH2-OE2 3.31Å; R136-E140 IonicContact NH1-OE1 2.65Å; R136-E140 PolarHBondContact O-N 3.17Å; R136-E140 VanDerWaalsContact O-N 3.15Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.07Å; Y137-E140 WeakPolarHBondContact O-CB 3.26Å; Y137-E140 PolarHBondContact O-N 3.14Å; L138-E140 PolarHBondContact O-N 2.69Å; E140-I190 HydrophobicContact CG-CD1 3.98Å
141F97.5Very high98.4Very high20 Ų2044.5 Ų44.59%0.08824%0.242CC..Hα-helixtrans-120.4-18.9-171.168.2-94.2000114.4W66 E96 L99 S100 Y137 L138W66-F141 HydrophobicContact CD2-CB 4.21Å; W66-F141 VanDerWaalsContact CE2-CB 3.42Å; W66-F141 HydrophobicContact CH2-CB 4.05Å; W66-F141 HydrophobicContact CZ2-CB 3.35Å; E96-F141 HydrophobicContact CB-CD2 3.74Å; E96-F141 HydrophobicContact CB-CE2 3.94Å; E96-F141 HydrophobicContact CG-CB 4.16Å; E96-F141 HydrophobicContact CG-CD2 3.62Å; E96-F141 HydrophobicContact CG-CE2 4.32Å; E96-F141 HydrophobicContact CG-CG 4.11Å; E96-F141 WeakPolarHBondContact O-CE2 3.24Å; L99-F141 HydrophobicContact CB-CD1 4.45Å; L99-F141 HydrophobicContact CB-CE1 3.71Å; L99-F141 HydrophobicContact CB-CZ 3.73Å; L99-F141 HydrophobicContact CD1-CD1 3.96Å; L99-F141 HydrophobicContact CD1-CE1 4.04Å; L99-F141 HydrophobicContact CD1-CG 4.48Å; L99-F141 HydrophobicContact CG-CE1 4.45Å; S100-F141 WeakPolarHBondContact OG-CE2 3.29Å; S100-F141 WeakPolarHBondContact OG-CZ 3.41Å; Y137-F141 WeakPolarHBondContact O-CD1 3.39Å; Y137-F141 WeakPolarHBondContact O-CE1 3.23Å; L138-F141 HydrophobicContact CD2-CE1 4.17Å; L138-F141 HydrophobicContact CD2-CZ 3.71Å; L138-F141 PolarHBondContact O-N 2.98Å
142K98.3Very high98.4Very high49 Ų4947.3 Ų47.321%0.21326%0.255CS..  trans-67.8162.7173.7-69.3-67.2-165.3162.10111.1L138 E146 R147L138-K142 HydrophobicContact CB-CG 4.4Å; L138-K142 WeakPolarHBondContact O-CB 3.43Å; L138-K142 WeakPolarHBondContact O-CG 3.33Å; L138-K142 PolarHBondContact O-N 2.82Å; K142-E146 HydrophobicContact CB-CB 4.08Å; K142-E146 HydrophobicContact CD-CB 4.13Å; K142-E146 WeakPolarHBondContact CD-OE2 3.44Å; K142-E146 HydrophobicContact CG-CB 4.32Å; K142-E146 IonicContact NZ-OE1 2.97Å; K142-E146 PolarHBondContact NZ-OE1 3.14Å; K142-E146 IonicContact NZ-OE2 3.81Å; K142-E146 PolarHBondContact NZ-OE2 3.33Å; K142-R147 HydrophobicContact CB-CB 4.27Å; K142-R147 WeakPolarHBondContact O-CB 3.39Å
143S97Very high98.4Very high86 Ų8649.9 Ų49.960%0.60127%0.269SS*.  trans-132.5166179.767.80000112.1A145 E146 R147S143-A145 PolarHBondContact O-N 3.14Å; S143-E146 PolarHBondContact O-N 3.29Å; S143-R147 PolarHBondContact O-N 2.9Å
144G97.4Very high98.4Very high61 Ų6149.5 Ų49.563%0.62927%0.267SS*.Hα-helixtrans54.7-130.5175.100000114R147 K148G144-R147 PolarHBondContact O-N 2.88Å; G144-K148 PolarHBondContact O-N 3.5Å
145A98.3Very high98.4Very high82 Ų8252.1 Ų52.168%0.67828%0.281SS*.Hα-helixtrans-64.1-39.9-178.100000112.8S143 R147 K148 E149S143-A145 PolarHBondContact O-N 3.14Å; A145-R147 VanDerWaalsContact C-N 3.33Å; A145-R147 PolarHBondContact O-N 2.89Å; A145-K148 PolarHBondContact O-N 3.27Å; A145-E149 PolarHBondContact O-N 3.39Å
146E98.2Very high98.4Very high100 Ų10055.5 Ų55.547%0.46730%0.303SS..Hα-helixtrans-62.8-40.5179.1-63.5-175.2114.600111.4K142 S143 A150K142-E146 HydrophobicContact CB-CB 4.08Å; K142-E146 HydrophobicContact CD-CB 4.13Å; K142-E146 WeakPolarHBondContact CD-OE2 3.44Å; K142-E146 HydrophobicContact CG-CB 4.32Å; K142-E146 IonicContact NZ-OE1 2.97Å; K142-E146 PolarHBondContact NZ-OE1 3.14Å; K142-E146 IonicContact NZ-OE2 3.81Å; K142-E146 PolarHBondContact NZ-OE2 3.33Å; S143-E146 PolarHBondContact O-N 3.29Å; E146-A150 WeakPolarHBondContact O-CB 3.42Å; E146-A150 PolarHBondContact O-N 3.13Å
147R98.4Very high98.4Very high110 Ų11055.2 Ų55.242%0.41530%0.303SS..Hα-helixtrans-62.8-43.7175.3-177.2175.3169.9172.2-1.5111.6K142 S143 G144 A145 A150 A151K142-R147 HydrophobicContact CB-CB 4.27Å; K142-R147 WeakPolarHBondContact O-CB 3.39Å; S143-R147 PolarHBondContact O-N 2.9Å; G144-R147 PolarHBondContact O-N 2.88Å; A145-R147 VanDerWaalsContact C-N 3.33Å; A145-R147 PolarHBondContact O-N 2.89Å; R147-A150 PolarHBondContact O-N 3.08Å; R147-A151 WeakPolarHBondContact O-CB 3.16Å; R147-A151 PolarHBondContact O-N 3.09Å
148K98.5Very high98.4Very high133 Ų13354 Ų5458%0.57830%0.298SS*.Hα-helixtrans-62.4-47.9180-179.5177.9170.7-1790110.9G144 A145 A150 A151 E152G144-K148 PolarHBondContact O-N 3.5Å; A145-K148 PolarHBondContact O-N 3.27Å; K148-A150 PolarHBondContact O-N 3.29Å; K148-A151 PolarHBondContact O-N 3.06Å; K148-E152 WeakPolarHBondContact CE-OE1 3.24Å; K148-E152 IonicContact NZ-OE1 3.68Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.22Å
149E98.6Very high98.4Very high117 Ų11757.2 Ų57.255%0.54731%0.311SS..Hα-helixtrans-59.9-44.3176.5179177.3-175.600111.7A145 A151 E152 N153A145-E149 PolarHBondContact O-N 3.39Å; E149-A151 VanDerWaalsContact C-N 3.35Å; E149-A151 PolarHBondContact O-N 3.02Å; E149-E152 PolarHBondContact O-N 2.81Å; E149-N153 WeakPolarHBondContact CG-ND2 3.14Å; E149-N153 WeakPolarHBondContact O-CB 3.3Å; E149-N153 PolarHBondContact O-N 2.86Å; E149-N153 PolarHBondContact O-ND2 2.75Å; E149-N153 VanDerWaalsContact O-ND2 3.13Å
150A98.8Very high98.4Very high4 Ų459.5 Ų59.53%0.03333%0.327CS..Hα-helixtrans-61.2-41.9176.100000112.2L138 A139 E146 R147 K148 T154L138-A150 HydrophobicContact CB-CB 3.89Å; A139-A150 HydrophobicContact CB-CB 3.87Å; E146-A150 WeakPolarHBondContact O-CB 3.42Å; E146-A150 PolarHBondContact O-N 3.13Å; R147-A150 PolarHBondContact O-N 3.08Å; K148-A150 PolarHBondContact O-N 3.29Å; A150-T154 WeakPolarHBondContact O-CB 3.34Å; A150-T154 PolarHBondContact O-N 3.16Å; A150-T154 PolarHBondContact O-OG1 3.43Å
151A98.7Very high98.5Very high14 Ų1458.1 Ų58.112%0.11632%0.321CS..Hα-helixtrans-66.6-41.1176.500000112.5R147 K148 E149 T154 L155 F186 I190 L191R147-A151 WeakPolarHBondContact O-CB 3.16Å; R147-A151 PolarHBondContact O-N 3.09Å; K148-A151 PolarHBondContact O-N 3.06Å; E149-A151 VanDerWaalsContact C-N 3.35Å; E149-A151 PolarHBondContact O-N 3.02Å; A151-T154 WeakPolarHBondContact O-CB 3.5Å; A151-T154 PolarHBondContact O-N 2.82Å; A151-L155 PolarHBondContact O-N 3.06Å; A151-F186 HydrophobicContact CB-CE2 4.27Å; A151-F186 HydrophobicContact CB-CZ 4.43Å; A151-F186 WeakPolarHBondContact O-CZ 3.49Å; A151-I190 HydrophobicContact CB-CG2 4.05Å; A151-L191 HydrophobicContact CB-CD2 4.5Å
152E98.8Very high98.5Very high101 Ų10158.4 Ų58.447%0.47232%0.323SS..Hα-helixtrans-63.1-47.2175.9-73.9172.317400111.2K148 E149 T154 L155 V156K148-E152 WeakPolarHBondContact CE-OE1 3.24Å; K148-E152 IonicContact NZ-OE1 3.68Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.22Å; E149-E152 PolarHBondContact O-N 2.81Å; E152-T154 VanDerWaalsContact C-N 3.32Å; E152-T154 PolarHBondContact O-N 3.12Å; E152-L155 PolarHBondContact O-N 2.74Å; E152-V156 WeakPolarHBondContact O-CG2 3.49Å; E152-V156 PolarHBondContact O-N 2.77Å
153N98.8Very high98.5Very high53 Ų5361.1 Ų61.128%0.28334%0.339SS..Hα-helixtrans-63.4-36.6176.5-76.3-41.7000112.6H135 E149 A157H135-N153 HydrophobicContact CB-CB 4.23Å; E149-N153 WeakPolarHBondContact CG-ND2 3.14Å; E149-N153 WeakPolarHBondContact O-CB 3.3Å; E149-N153 PolarHBondContact O-N 2.86Å; E149-N153 PolarHBondContact O-ND2 2.75Å; E149-N153 VanDerWaalsContact O-ND2 3.13Å; N153-A157 WeakPolarHBondContact O-CB 3.28Å; N153-A157 PolarHBondContact O-N 2.84Å
154T98.9Very high98.6Very high0 Ų058.9 Ų58.90%032%0.32CS..Hα-helixtrans-59.1-50.4172.4-58.50000111G132 H135 R136 A150 A151 E152 V156 A157 Y158 F186G132-T154 WeakPolarHBondContact O-CG2 3.24Å; H135-T154 VanDerWaalsContact CB-OG1 3.27Å; H135-T154 WeakPolarHBondContact CB-OG1 3.35Å; R136-T154 WeakPolarHBondContact CA-OG1 3.42Å; R136-T154 HydrophobicContact CB-CG2 3.82Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.01Å; A150-T154 WeakPolarHBondContact O-CB 3.34Å; A150-T154 PolarHBondContact O-N 3.16Å; A150-T154 PolarHBondContact O-OG1 3.43Å; A151-T154 WeakPolarHBondContact O-CB 3.5Å; A151-T154 PolarHBondContact O-N 2.82Å; E152-T154 VanDerWaalsContact C-N 3.32Å; E152-T154 PolarHBondContact O-N 3.12Å; T154-V156 PolarHBondContact O-N 3.45Å; T154-A157 PolarHBondContact O-N 3.4Å; T154-Y158 HydrophobicContact CG2-CD2 3.61Å; T154-Y158 HydrophobicContact CG2-CE2 3.42Å; T154-Y158 VanDerWaalsContact CG2-CE2 3.42Å; T154-Y158 PolarHBondContact O-N 2.96Å; T154-F186 HydrophobicContact CG2-CB 4.37Å; T154-F186 HydrophobicContact CG2-CD1 4.09Å; T154-F186 HydrophobicContact CG2-CD2 3.38Å; T154-F186 HydrophobicContact CG2-CE1 4.17Å; T154-F186 HydrophobicContact CG2-CE2 3.5Å; T154-F186 HydrophobicContact CG2-CG 3.68Å; T154-F186 HydrophobicContact CG2-CZ 3.9Å
155L98.7Very high98.7Very high63 Ų6356 Ų5633%0.3329%0.291SS..Hα-helixtrans-62.1-44.5-178.4179.861.8000111.5A151 E152 K159 F183 F186A151-L155 PolarHBondContact O-N 3.06Å; E152-L155 PolarHBondContact O-N 2.74Å; L155-K159 HydrophobicContact CD1-CG 4.14Å; L155-K159 WeakPolarHBondContact O-CB 3.27Å; L155-K159 WeakPolarHBondContact O-CG 3.44Å; L155-K159 PolarHBondContact O-N 2.92Å; L155-F183 HydrophobicContact CD1-CE2 3.83Å; L155-F183 HydrophobicContact CD1-CZ 3.78Å; L155-F186 HydrophobicContact CB-CE1 3.96Å; L155-F186 HydrophobicContact CB-CZ 4.15Å; L155-F186 HydrophobicContact CD1-CE1 4.15Å
156V98.8Very high98.7Very high90 Ų9056.4 Ų56.455%0.54528%0.281SS..Hα-helixtrans-59.7-51.5176.8170.60000110.5E152 T154 Y158 K159 S160E152-V156 WeakPolarHBondContact O-CG2 3.49Å; E152-V156 PolarHBondContact O-N 2.77Å; T154-V156 PolarHBondContact O-N 3.45Å; V156-Y158 PolarHBondContact O-N 2.85Å; V156-K159 PolarHBondContact O-N 3.3Å; V156-S160 PolarHBondContact O-N 3.07Å; V156-S160 PolarHBondContact O-OG 2.85Å
157A98.9Very high98.6Very high4 Ų455.2 Ų55.23%0.03329%0.288CS..Hα-helixtrans-61.7-44.6-177.600000112.3K131 N153 T154 S160 A161K131-A157 HydrophobicContact CB-CB 4.17Å; K131-A157 HydrophobicContact CD-CB 4.43Å; K131-A157 HydrophobicContact CG-CB 4.05Å; N153-A157 WeakPolarHBondContact O-CB 3.28Å; N153-A157 PolarHBondContact O-N 2.84Å; T154-A157 PolarHBondContact O-N 3.4Å; A157-S160 PolarHBondContact O-N 3.15Å; A157-A161 WeakPolarHBondContact O-CB 3.49Å; A157-A161 PolarHBondContact O-N 2.82Å
158Y98.9Very high98.6Very high0 Ų055 Ų550%030%0.295CS..Hα-helixtrans-68.5-35.6176.9-73.1-29.5000113.6K129 D133 R136 T154 V156 A161 Q162 L179 F183 F186K129-Y158 HydrophobicContact CG-CE1 4.4Å; K129-Y158 WeakPolarHBondContact O-CE1 3.42Å; D133-Y158 PolarHBondContact N-OH 2.81Å; D133-Y158 PolarHBondContact OD1-OH 3.29Å; R136-Y158 PolarHBondContact NE-OH 3.13Å; T154-Y158 HydrophobicContact CG2-CD2 3.61Å; T154-Y158 HydrophobicContact CG2-CE2 3.42Å; T154-Y158 VanDerWaalsContact CG2-CE2 3.42Å; T154-Y158 PolarHBondContact O-N 2.96Å; V156-Y158 PolarHBondContact O-N 2.85Å; Y158-A161 PolarHBondContact O-N 3.24Å; Y158-Q162 WeakPolarHBondContact O-CB 3.42Å; Y158-Q162 PolarHBondContact O-N 3.43Å; Y158-L179 HydrophobicContact CD1-CD1 3.58Å; Y158-L179 HydrophobicContact CE1-CD1 4.21Å; Y158-L179 HydrophobicContact CG-CD1 4.24Å; Y158-F183 HydrophobicContact CD2-CB 3.96Å; Y158-F183 AromaticContact CD2-CD2 3.34Å; Y158-F183 HydrophobicContact CD2-CD2 3.34Å; Y158-F183 AromaticContact CD2-CE2 3.88Å; Y158-F183 HydrophobicContact CD2-CE2 3.88Å; Y158-F183 AromaticContact CD2-CG 3.75Å; Y158-F183 HydrophobicContact CD2-CG 3.75Å; Y158-F183 HydrophobicContact CE2-CB 4.32Å; Y158-F183 HydrophobicContact CE2-CD2 4.17Å; Y158-F183 HydrophobicContact CG-CB 4.15Å; Y158-F183 HydrophobicContact CG-CD1 4.39Å; Y158-F183 AromaticContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CE2 4.33Å; Y158-F183 AromaticContact CG-CG 3.93Å; Y158-F183 HydrophobicContact CG-CG 3.93Å; Y158-F186 HydrophobicContact CD2-CB 4.32Å; Y158-F186 HydrophobicContact CD2-CD1 4.32Å; Y158-F186 HydrophobicContact CD2-CG 4.42Å; Y158-F186 HydrophobicContact CE2-CB 3.8Å; Y158-F186 HydrophobicContact CE2-CG 4.21Å
159K98.7Very high98.6Very high84 Ų8449.2 Ų49.237%0.36527%0.271SS..Hα-helixtrans-65.3-46.3174.4-79.6-70.9174.8-168.90111.6L155 V156 A161 Q162 D163 F183L155-K159 HydrophobicContact CD1-CG 4.14Å; L155-K159 WeakPolarHBondContact O-CB 3.27Å; L155-K159 WeakPolarHBondContact O-CG 3.44Å; L155-K159 PolarHBondContact O-N 2.92Å; V156-K159 PolarHBondContact O-N 3.3Å; K159-A161 VanDerWaalsContact C-N 3.32Å; K159-A161 PolarHBondContact O-N 3.3Å; K159-Q162 PolarHBondContact O-N 3.19Å; K159-Q162 VanDerWaalsContact O-N 3.08Å; K159-D163 VanDerWaalsContact O-CG 3.25Å; K159-D163 PolarHBondContact O-N 3.46Å; K159-F183 HydrophobicContact CD-CE1 4.24Å; K159-F183 HydrophobicContact CD-CZ 4.22Å; K159-F183 HydrophobicContact CG-CE1 4.39Å; K159-F183 HydrophobicContact CG-CZ 4.05Å
160S98.7Very high98.5Very high49 Ų4946.9 Ų46.934%0.34327%0.266SS..Hα-helixtrans-60.8-40174.7-58.90000112.6V156 A157 Q162 I164V156-S160 PolarHBondContact O-N 3.07Å; V156-S160 PolarHBondContact O-OG 2.85Å; A157-S160 PolarHBondContact O-N 3.15Å; S160-Q162 VanDerWaalsContact C-N 3.34Å; S160-I164 WeakPolarHBondContact O-CG1 3.49Å
161A98.8Very high98.4Very high0 Ų047.4 Ų47.40%027%0.269CS..Hα-helixtrans-64.1-40.8173.800000111.7V125 L128 A157 Y158 K159 A165 L179V125-A161 HydrophobicContact CG1-CB 4.27Å; L128-A161 HydrophobicContact CB-CB 3.68Å; A157-A161 WeakPolarHBondContact O-CB 3.49Å; A157-A161 PolarHBondContact O-N 2.82Å; Y158-A161 PolarHBondContact O-N 3.24Å; K159-A161 VanDerWaalsContact C-N 3.32Å; K159-A161 PolarHBondContact O-N 3.3Å; A161-A165 VanDerWaalsContact O-CB 3.26Å; A161-A165 WeakPolarHBondContact O-CB 3.37Å; A161-A165 PolarHBondContact O-N 3.35Å; A161-L179 VanDerWaalsContact C-CD2 3.49Å; A161-L179 HydrophobicContact CB-CD1 3.84Å; A161-L179 HydrophobicContact CB-CD2 3.65Å; A161-L179 HydrophobicContact CB-CG 4.41Å
162Q98.6Very high98.3Very high27 Ų2747 Ų4713%0.12627%0.265CS..Hα-helixtrans-67.5-42.6-177.6175.4169.368.300111.3Y158 K159 S160 I164 A165 L166 L179Y158-Q162 WeakPolarHBondContact O-CB 3.42Å; Y158-Q162 PolarHBondContact O-N 3.43Å; K159-Q162 PolarHBondContact O-N 3.19Å; K159-Q162 VanDerWaalsContact O-N 3.08Å; S160-Q162 VanDerWaalsContact C-N 3.34Å; Q162-I164 VanDerWaalsContact C-N 3.31Å; Q162-I164 PolarHBondContact O-N 2.9Å; Q162-A165 PolarHBondContact O-N 2.99Å; Q162-L166 HydrophobicContact CG-CD1 3.72Å; Q162-L166 HydrophobicContact CG-CG 4.06Å; Q162-L166 WeakPolarHBondContact O-CB 3.38Å; Q162-L166 WeakPolarHBondContact O-CG 3.35Å; Q162-L166 PolarHBondContact O-N 2.97Å; Q162-L179 HydrophobicContact CB-CD2 4.08Å
163D98.6Very high98.2Very high105 Ų10543.4 Ų43.456%0.56125%0.248SC*.Hα-helixtrans-59-43.8179.2-65.9-20.1000111.3K159 A167K159-D163 VanDerWaalsContact O-CG 3.25Å; K159-D163 PolarHBondContact O-N 3.46Å; D163-A167 PolarHBondContact O-N 3.08Å
164I98.7Very high98.1Very high40 Ų4041.9 Ų41.921%0.20524%0.241CC..Hα-helixtrans-69.5-45.2175.8-59.1170.9000110.6A121 K124 V125 L128 S160 Q162 L166 A167 D168A121-I164 HydrophobicContact CB-CG2 4.15Å; K124-I164 HydrophobicContact CB-CD1 3.94Å; K124-I164 HydrophobicContact CD-CD1 4.35Å; V125-I164 HydrophobicContact CG2-CB 3.85Å; V125-I164 HydrophobicContact CG2-CG2 3.56Å; L128-I164 HydrophobicContact CD1-CD1 3.82Å; S160-I164 WeakPolarHBondContact O-CG1 3.49Å; Q162-I164 VanDerWaalsContact C-N 3.31Å; Q162-I164 PolarHBondContact O-N 2.9Å; I164-L166 VanDerWaalsContact C-N 3.31Å; I164-L166 PolarHBondContact O-N 3.35Å; I164-A167 PolarHBondContact O-N 3.36Å; I164-D168 WeakPolarHBondContact O-CB 3.34Å; I164-D168 PolarHBondContact O-N 2.68Å
165A98.7Very high98.1Very high1 Ų142.9 Ų42.91%0.00825%0.246CC..Hα-helixtrans-62.6-37.3-17800000112.8V125 A161 Q162 L169 R176 L179V125-A165 HydrophobicContact CG1-CB 3.91Å; V125-A165 HydrophobicContact CG2-CB 4.01Å; A161-A165 VanDerWaalsContact O-CB 3.26Å; A161-A165 WeakPolarHBondContact O-CB 3.37Å; A161-A165 PolarHBondContact O-N 3.35Å; Q162-A165 PolarHBondContact O-N 2.99Å; A165-L169 HydrophobicContact CB-CD1 4.23Å; A165-L169 WeakPolarHBondContact O-CB 3.37Å; A165-L169 PolarHBondContact O-N 3.36Å; A165-L169 VanDerWaalsContact O-O 3.09Å; A165-R176 HydrophobicContact CB-CB 4.31Å; A165-R176 HydrophobicContact CB-CG 4.11Å; A165-L179 HydrophobicContact CB-CD2 4.06Å
166L98Very high98.1Very high89 Ų8941.8 Ų41.847%0.46624%0.238SC..Hα-helixtrans-69.9-33.7177.6-71.6175.9000112.2Q162 I164 R176Q162-L166 HydrophobicContact CG-CD1 3.72Å; Q162-L166 HydrophobicContact CG-CG 4.06Å; Q162-L166 WeakPolarHBondContact O-CB 3.38Å; Q162-L166 WeakPolarHBondContact O-CG 3.35Å; Q162-L166 PolarHBondContact O-N 2.97Å; I164-L166 VanDerWaalsContact C-N 3.31Å; I164-L166 PolarHBondContact O-N 3.35Å; L166-R176 VanDerWaalsContact CD2-NH2 3.34Å
167A98Very high98.1Very high76 Ų7637.6 Ų37.663%0.62821%0.212SC*.Hα-helixtrans-80.6-42.8-179.600000112.8D163 I164D163-A167 PolarHBondContact O-N 3.08Å; I164-A167 PolarHBondContact O-N 3.36Å
168D98.1Very high98Very high104 Ų10437.9 Ų37.956%0.55622%0.215SC*.Hα-helixtrans-117.1-11.2-161.3-62.5-30.1000114.4A121 I164A121-D168 HydrophobicContact CB-CB 3.52Å; I164-D168 WeakPolarHBondContact O-CB 3.34Å; I164-D168 PolarHBondContact O-N 2.68Å
169L97.4Very high98Very high12 Ų1238 Ų386%0.06322%0.216CC..SBendtrans-117.7136.9-178.2-56.2-178.7000111.7A121 E122 V125 A165 H173 I175 R176A121-L169 HydrophobicContact CB-CD2 4.41Å; E122-L169 HydrophobicContact CG-CD2 3.71Å; V125-L169 HydrophobicContact CB-CD1 4.05Å; V125-L169 HydrophobicContact CG1-CD1 4.22Å; V125-L169 HydrophobicContact CG2-CD1 3.77Å; V125-L169 HydrophobicContact CG2-CG 4.49Å; A165-L169 HydrophobicContact CB-CD1 4.23Å; A165-L169 WeakPolarHBondContact O-CB 3.37Å; A165-L169 PolarHBondContact O-N 3.36Å; A165-L169 VanDerWaalsContact O-O 3.09Å; L169-H173 HydrophobicContact CB-CB 4.09Å; L169-I175 HydrophobicContact CD1-CB 4.47Å; L169-R176 HydrophobicContact CB-CB 4.28Å; L169-R176 HydrophobicContact CD1-CB 4.41Å; L169-R176 PolarHBondContact O-NH1 3.37Å
170P96.5Very high98Very high69 Ų6934.4 Ų34.445%0.44820%0.202SC..  trans-62.7154.5176.324.3-30.1000111.3T172 H173 R176P170-T172 PolarHBondContact O-N 3.08Å; P170-T172 VanDerWaalsContact O-N 3.16Å; P170-H173 HydrophobicContact CG-CB 3.95Å; P170-H173 WeakPolarHBondContact O-CB 3.5Å; P170-H173 PolarHBondContact O-N 3.5Å; P170-R176 WeakPolarHBondContact O-CD 3.3Å
171T97.3Very high98Very high15 Ų1533 Ų339%0.09219%0.19CC..THydrogen-bonded Turntrans-58-31.8-177.458.60000112.2H173 D207 E211T171-H173 VanDerWaalsContact C-N 3.34Å; T171-D207 HydrophobicContact CG2-CB 3.91Å; T171-D207 PolarHBondContact OG1-O 3.26Å; T171-E211 VanDerWaalsContact OG1-CD 3.32Å; T171-E211 PolarHBondContact OG1-OE2 2.83Å
172T96.7Very high98Very high6 Ų634.4 Ų34.44%0.03720%0.198CC..THydrogen-bonded Turntrans-83.2-1.5178.253.40000114.1P170 A208 E211 S223P170-T172 PolarHBondContact O-N 3.08Å; P170-T172 VanDerWaalsContact O-N 3.16Å; T172-A208 HydrophobicContact CG2-CB 4.41Å; T172-E211 HydrophobicContact CG2-CB 3.91Å; T172-S223 WeakPolarHBondContact O-CB 3.17Å; T172-S223 PolarHBondContact O-OG 3.18Å
173H96.7Very high98Very high24 Ų2433.1 Ų33.111%0.11119%0.192CC..  trans-67128.8-177.3-165.4-84.8000111.9E122 L169 P170 T171 I175 R176 L177E122-H173 IonicContact OE1-NE2 3.37Å; E122-H173 PolarHBondContact OE1-NE2 2.93Å; L169-H173 HydrophobicContact CB-CB 4.09Å; P170-H173 HydrophobicContact CG-CB 3.95Å; P170-H173 WeakPolarHBondContact O-CB 3.5Å; P170-H173 PolarHBondContact O-N 3.5Å; T171-H173 VanDerWaalsContact C-N 3.34Å; H173-I175 VanDerWaalsContact C-N 3.3Å; H173-I175 WeakPolarHBondContact ND1-CB 3.35Å; H173-I175 PolarHBondContact ND1-N 3.42Å; H173-I175 VanDerWaalsContact ND1-N 3.16Å; H173-I175 PolarHBondContact O-N 3.15Å; H173-R176 HydrophobicContact CB-CB 4.13Å; H173-R176 PolarHBondContact O-N 2.94Å; H173-L177 PolarHBondContact O-N 3.17Å
174P97Very high98.1Very high22 Ų2228.1 Ų28.114%0.14317%0.165CC..Hα-helixtrans-55-39.8-177.4-26.331.4000114.2G178 D222 S223 I226P174-G178 PolarHBondContact O-N 3.42Å; P174-D222 HydrophobicContact CB-CB 4.13Å; P174-D222 HydrophobicContact CG-CB 4.04Å; P174-S223 WeakPolarHBondContact CD-OG 3.32Å; P174-S223 WeakPolarHBondContact CG-OG 3.27Å; P174-I226 HydrophobicContact CB-CD1 4.08Å; P174-I226 VanDerWaalsContact O-CD1 3.28Å; P174-I226 WeakPolarHBondContact O-CD1 3.36Å
175I97.9Very high98Very high21 Ų2127 Ų2711%0.10816%0.16CC..Hα-helixtrans-66.4-39.9178.1-59.2177.4000111.7E122 V125 F126 L169 H173 G178 L179E122-I175 HydrophobicContact CB-CD1 4.09Å; V125-I175 HydrophobicContact CB-CG2 3.96Å; V125-I175 HydrophobicContact CG1-CG2 3.61Å; F126-I175 HydrophobicContact CB-CD1 4.29Å; F126-I175 HydrophobicContact CD2-CD1 4.05Å; F126-I175 HydrophobicContact CD2-CG1 4.42Å; L169-I175 HydrophobicContact CD1-CB 4.47Å; H173-I175 VanDerWaalsContact C-N 3.3Å; H173-I175 WeakPolarHBondContact ND1-CB 3.35Å; H173-I175 PolarHBondContact ND1-N 3.42Å; H173-I175 VanDerWaalsContact ND1-N 3.16Å; H173-I175 PolarHBondContact O-N 3.15Å; I175-G178 PolarHBondContact O-N 3.47Å; I175-L179 WeakPolarHBondContact O-CB 3.49Å; I175-L179 PolarHBondContact O-N 3.33Å
176R98.3Very high98Very high40 Ų4027 Ų2715%0.15116%0.16CC..Hα-helixtrans-67.5-45.2178.7177176170.9168.4-6.4110.6A165 L166 L169 P170 H173 L179 A180A165-R176 HydrophobicContact CB-CB 4.31Å; A165-R176 HydrophobicContact CB-CG 4.11Å; L166-R176 VanDerWaalsContact CD2-NH2 3.34Å; L169-R176 HydrophobicContact CB-CB 4.28Å; L169-R176 HydrophobicContact CD1-CB 4.41Å; L169-R176 PolarHBondContact O-NH1 3.37Å; P170-R176 WeakPolarHBondContact O-CD 3.3Å; H173-R176 HydrophobicContact CB-CB 4.13Å; H173-R176 PolarHBondContact O-N 2.94Å; R176-L179 WeakPolarHBondContact O-CB 3.46Å; R176-L179 PolarHBondContact O-N 3.25Å; R176-A180 PolarHBondContact O-N 2.86Å
177L98.6Very high98.1Very high2 Ų223.7 Ų23.71%0.0114%0.141CC..Hα-helixtrans-62-45174.8-71.6168.3000111.6H173 L179 A180 L181 A208 I226 M227 L230H173-L177 PolarHBondContact O-N 3.17Å; L177-L179 VanDerWaalsContact C-N 3.28Å; L177-L179 PolarHBondContact O-N 3.01Å; L177-A180 PolarHBondContact O-N 3.41Å; L177-A180 VanDerWaalsContact O-N 3.17Å; L177-L181 PolarHBondContact O-N 2.96Å; L177-A208 HydrophobicContact CD1-CB 4.46Å; L177-A208 HydrophobicContact CD2-CB 3.73Å; L177-I226 HydrophobicContact CB-CB 4.16Å; L177-I226 HydrophobicContact CB-CD1 4.47Å; L177-I226 HydrophobicContact CB-CG2 3.6Å; L177-M227 HydrophobicContact CD1-CG 4Å; L177-M227 HydrophobicContact CD1-SD 4.47Å; L177-M227 HydrophobicContact CD2-CG 4.16Å; L177-L230 HydrophobicContact CD2-CD1 4.05Å
178G98.6Very high98.1Very high9 Ų922.9 Ų22.99%0.09312%0.123CC..Hα-helixtrans-63.1-34.6177.700000112.6K129 P174 I175 N182K129-G178 WeakPolarHBondContact CE-O 3.42Å; P174-G178 PolarHBondContact O-N 3.42Å; I175-G178 PolarHBondContact O-N 3.47Å; G178-N182 PolarHBondContact O-N 2.85Å; G178-N182 VanDerWaalsContact O-N 3.07Å
179L98.9Very high98Very high4 Ų422.6 Ų22.62%0.02112%0.118CC..Hα-helixtrans-64.4-48.3171.9172.763.9000111.1V125 K129 Y158 A161 Q162 A165 I175 R176 L177 L181 N182 F183V125-L179 HydrophobicContact CG1-CD2 4.09Å; K129-L179 HydrophobicContact CB-CD1 4.08Å; K129-L179 HydrophobicContact CD-CB 4.08Å; K129-L179 HydrophobicContact CG-CB 4.32Å; K129-L179 HydrophobicContact CG-CD1 3.99Å; Y158-L179 HydrophobicContact CD1-CD1 3.58Å; Y158-L179 HydrophobicContact CE1-CD1 4.21Å; Y158-L179 HydrophobicContact CG-CD1 4.24Å; A161-L179 VanDerWaalsContact C-CD2 3.49Å; A161-L179 HydrophobicContact CB-CD1 3.84Å; A161-L179 HydrophobicContact CB-CD2 3.65Å; A161-L179 HydrophobicContact CB-CG 4.41Å; Q162-L179 HydrophobicContact CB-CD2 4.08Å; A165-L179 HydrophobicContact CB-CD2 4.06Å; I175-L179 WeakPolarHBondContact O-CB 3.49Å; I175-L179 PolarHBondContact O-N 3.33Å; R176-L179 WeakPolarHBondContact O-CB 3.46Å; R176-L179 PolarHBondContact O-N 3.25Å; L177-L179 VanDerWaalsContact C-N 3.28Å; L177-L179 PolarHBondContact O-N 3.01Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.43Å; L179-N182 PolarHBondContact O-N 2.97Å; L179-F183 WeakPolarHBondContact O-CB 3.49Å; L179-F183 PolarHBondContact O-N 3.14Å
180A98.8Very high98.1Very high8 Ų822.8 Ų22.87%0.06612%0.119CC..Hα-helixtrans-60.5-40.317800000112.2R176 L177 S184 A204R176-A180 PolarHBondContact O-N 2.86Å; L177-A180 PolarHBondContact O-N 3.41Å; L177-A180 VanDerWaalsContact O-N 3.17Å; A180-S184 WeakPolarHBondContact O-CB 3.17Å; A180-S184 PolarHBondContact O-N 2.71Å; A180-S184 PolarHBondContact O-OG 2.95Å; A180-A204 HydrophobicContact CB-CB 3.39Å
181L98.8Very high98.1Very high18 Ų1822.2 Ų22.29%0.09411%0.112CC..Hα-helixtrans-58.7-53.9174.3177.664.3000111.2L177 L179 F183 S184 V185 I226 L229 L230 N233L177-L181 PolarHBondContact O-N 2.96Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.43Å; L181-F183 PolarHBondContact O-N 3.45Å; L181-S184 PolarHBondContact O-N 2.92Å; L181-S184 PolarHBondContact O-OG 3.2Å; L181-V185 WeakPolarHBondContact O-CG2 3.05Å; L181-V185 PolarHBondContact O-N 3.41Å; L181-V185 VanDerWaalsContact O-N 3.16Å; L181-I226 HydrophobicContact CB-CG2 4.3Å; L181-I226 HydrophobicContact CD2-CG2 4.19Å; L181-L229 HydrophobicContact CD1-CB 4.08Å; L181-L229 HydrophobicContact CD2-CB 3.89Å; L181-L229 HydrophobicContact CD2-CD1 3.89Å; L181-L230 HydrophobicContact CB-CD2 3.91Å; L181-L230 HydrophobicContact CB-CG 4.24Å; L181-L230 HydrophobicContact CD1-CD2 3.98Å; L181-L230 HydrophobicContact CD1-CG 4.2Å; L181-N233 VanDerWaalsContact CD1-ND2 3.31Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.48Å
182N98.7Very high98.1Very high30 Ų3028.2 Ų28.216%0.1614%0.143CC..Hα-helixtrans-72.7-30.3-175.3-72.44.3000113K129 D133 G178 L179 F186K129-N182 PolarHBondContact NZ-ND2 2.83Å; D133-N182 WeakPolarHBondContact OD1-CB 3.07Å; D133-N182 PolarHBondContact OD1-ND2 3.25Å; D133-N182 PolarHBondContact OD2-ND2 2.98Å; G178-N182 PolarHBondContact O-N 2.85Å; G178-N182 VanDerWaalsContact O-N 3.07Å; L179-N182 PolarHBondContact O-N 2.97Å; N182-F186 PolarHBondContact O-N 3.11Å; N182-F186 VanDerWaalsContact O-N 3.14Å
183F98.8Very high98.2Very high0 Ų029.4 Ų29.40%015%0.152CC..Hα-helixtrans-74.7-35.8176.9-165.6-175.7000111.7L155 Y158 K159 L179 L181 F186 Y187 L200L155-F183 HydrophobicContact CD1-CE2 3.83Å; L155-F183 HydrophobicContact CD1-CZ 3.78Å; Y158-F183 HydrophobicContact CD2-CB 3.96Å; Y158-F183 AromaticContact CD2-CD2 3.34Å; Y158-F183 HydrophobicContact CD2-CD2 3.34Å; Y158-F183 AromaticContact CD2-CE2 3.88Å; Y158-F183 HydrophobicContact CD2-CE2 3.88Å; Y158-F183 AromaticContact CD2-CG 3.75Å; Y158-F183 HydrophobicContact CD2-CG 3.75Å; Y158-F183 HydrophobicContact CE2-CB 4.32Å; Y158-F183 HydrophobicContact CE2-CD2 4.17Å; Y158-F183 HydrophobicContact CG-CB 4.15Å; Y158-F183 HydrophobicContact CG-CD1 4.39Å; Y158-F183 AromaticContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CE2 4.33Å; Y158-F183 AromaticContact CG-CG 3.93Å; Y158-F183 HydrophobicContact CG-CG 3.93Å; K159-F183 HydrophobicContact CD-CE1 4.24Å; K159-F183 HydrophobicContact CD-CZ 4.22Å; K159-F183 HydrophobicContact CG-CE1 4.39Å; K159-F183 HydrophobicContact CG-CZ 4.05Å; L179-F183 WeakPolarHBondContact O-CB 3.49Å; L179-F183 PolarHBondContact O-N 3.14Å; L181-F183 PolarHBondContact O-N 3.45Å; F183-F186 HydrophobicContact CD2-CB 4.45Å; F183-F186 AromaticContact CD2-CD1 3.85Å; F183-F186 HydrophobicContact CD2-CD1 3.85Å; F183-F186 AromaticContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CE1 4.23Å; F183-F186 WeakPolarHBondContact O-CB 3.36Å; F183-F186 PolarHBondContact O-N 2.88Å; F183-Y187 HydrophobicContact CD1-CE2 4.34Å; F183-Y187 AromaticContact CD2-CD2 3.94Å; F183-Y187 HydrophobicContact CD2-CD2 3.94Å; F183-Y187 AromaticContact CD2-CE2 3.53Å; F183-Y187 HydrophobicContact CD2-CE2 3.53Å; F183-Y187 HydrophobicContact CE1-CE2 4.2Å; F183-Y187 HydrophobicContact CE2-CD2 4.11Å; F183-Y187 HydrophobicContact CE2-CE1 4.3Å; F183-Y187 AromaticContact CE2-CE2 3.34Å; F183-Y187 HydrophobicContact CE2-CE2 3.34Å; F183-Y187 AromaticContact CE2-CZ 3.45Å; F183-Y187 VanDerWaalsContact CE2-CZ 3.45Å; F183-Y187 WeakPolarHBondContact CE2-OH 3.33Å; F183-Y187 HydrophobicContact CG-CE2 4.05Å; F183-Y187 AromaticContact CZ-CE2 3.71Å; F183-Y187 HydrophobicContact CZ-CE2 3.71Å; F183-Y187 AromaticContact CZ-CZ 3.69Å; F183-Y187 WeakPolarHBondContact CZ-OH 3.39Å; F183-Y187 VanDerWaalsContact O-CD2 3.26Å; F183-Y187 WeakPolarHBondContact O-CD2 3.26Å; F183-Y187 PolarHBondContact O-N 3.16Å; F183-Y187 VanDerWaalsContact O-N 3.09Å; F183-L200 HydrophobicContact CB-CD2 3.78Å; F183-L200 HydrophobicContact CD1-CD2 3.78Å; F183-L200 HydrophobicContact CG-CD2 3.75Å
184S98.7Very high98.2Very high0 Ų029.6 Ų29.60%016%0.155CC..Hα-helixtrans-65.1-41.9172.559.70000111.7A180 L181 F186 Y187 Y188 A197A180-S184 WeakPolarHBondContact O-CB 3.17Å; A180-S184 PolarHBondContact O-N 2.71Å; A180-S184 PolarHBondContact O-OG 2.95Å; L181-S184 PolarHBondContact O-N 2.92Å; L181-S184 PolarHBondContact O-OG 3.2Å; S184-F186 VanDerWaalsContact C-N 3.28Å; S184-F186 PolarHBondContact O-N 3.49Å; S184-Y187 PolarHBondContact O-N 3.37Å; S184-Y187 VanDerWaalsContact O-N 3.13Å; S184-Y188 PolarHBondContact O-N 3.27Å; S184-A197 WeakPolarHBondContact CB-O 3.44Å; S184-A197 VanDerWaalsContact O-CB 3.23Å; S184-A197 WeakPolarHBondContact O-CB 3.47Å
185V98.5Very high98.1Very high18 Ų1834 Ų3411%0.10918%0.177CC..Hα-helixtrans-57.5-40.1172.5172.90000111.7L181 Y188 E189 W237L181-V185 WeakPolarHBondContact O-CG2 3.05Å; L181-V185 PolarHBondContact O-N 3.41Å; L181-V185 VanDerWaalsContact O-N 3.16Å; V185-Y188 PolarHBondContact O-N 3.07Å; V185-E189 VanDerWaalsContact CG1-CD 3.43Å; V185-E189 HydrophobicContact CG1-CG 3.99Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.45Å; V185-E189 WeakPolarHBondContact O-CB 3.17Å; V185-E189 PolarHBondContact O-N 3.16Å; V185-W237 HydrophobicContact CG2-CH2 4.01Å; V185-W237 HydrophobicContact CG2-CZ2 3.96Å
186F98.7Very high98.1Very high1 Ų140.3 Ų40.30%0.00420%0.2CC..Hα-helixtrans-61.8-45.8174.3169.7-112.3000113.3R136 A151 T154 L155 Y158 N182 F183 S184 Y188 I190 L191R136-F186 HydrophobicContact CG-CD2 4.19Å; A151-F186 HydrophobicContact CB-CE2 4.27Å; A151-F186 HydrophobicContact CB-CZ 4.43Å; A151-F186 WeakPolarHBondContact O-CZ 3.49Å; T154-F186 HydrophobicContact CG2-CB 4.37Å; T154-F186 HydrophobicContact CG2-CD1 4.09Å; T154-F186 HydrophobicContact CG2-CD2 3.38Å; T154-F186 HydrophobicContact CG2-CE1 4.17Å; T154-F186 HydrophobicContact CG2-CE2 3.5Å; T154-F186 HydrophobicContact CG2-CG 3.68Å; T154-F186 HydrophobicContact CG2-CZ 3.9Å; L155-F186 HydrophobicContact CB-CE1 3.96Å; L155-F186 HydrophobicContact CB-CZ 4.15Å; L155-F186 HydrophobicContact CD1-CE1 4.15Å; Y158-F186 HydrophobicContact CD2-CB 4.32Å; Y158-F186 HydrophobicContact CD2-CD1 4.32Å; Y158-F186 HydrophobicContact CD2-CG 4.42Å; Y158-F186 HydrophobicContact CE2-CB 3.8Å; Y158-F186 HydrophobicContact CE2-CG 4.21Å; N182-F186 PolarHBondContact O-N 3.11Å; N182-F186 VanDerWaalsContact O-N 3.14Å; F183-F186 HydrophobicContact CD2-CB 4.45Å; F183-F186 AromaticContact CD2-CD1 3.85Å; F183-F186 HydrophobicContact CD2-CD1 3.85Å; F183-F186 AromaticContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CE1 4.23Å; F183-F186 WeakPolarHBondContact O-CB 3.36Å; F183-F186 PolarHBondContact O-N 2.88Å; S184-F186 VanDerWaalsContact C-N 3.28Å; S184-F186 PolarHBondContact O-N 3.49Å; F186-Y188 VanDerWaalsContact C-N 3.25Å; F186-Y188 PolarHBondContact O-N 3.44Å; F186-I190 HydrophobicContact CD2-CB 3.56Å; F186-I190 HydrophobicContact CD2-CG1 3.78Å; F186-I190 HydrophobicContact CD2-CG2 3.98Å; F186-I190 HydrophobicContact CE2-CB 3.72Å; F186-I190 HydrophobicContact CE2-CG1 4.29Å; F186-I190 HydrophobicContact CE2-CG2 3.61Å; F186-I190 WeakPolarHBondContact O-CB 3.43Å; F186-I190 PolarHBondContact O-N 3.48Å; F186-L191 HydrophobicContact CD1-CD1 4.04Å; F186-L191 HydrophobicContact CD1-CG 4.28Å; F186-L191 HydrophobicContact CE1-CD1 3.31Å; F186-L191 HydrophobicContact CE1-CD2 4.35Å; F186-L191 HydrophobicContact CE1-CG 3.68Å; F186-L191 HydrophobicContact CE2-CD2 4.29Å; F186-L191 HydrophobicContact CE2-CG 4.07Å; F186-L191 HydrophobicContact CZ-CD1 3.64Å; F186-L191 HydrophobicContact CZ-CD2 3.78Å; F186-L191 HydrophobicContact CZ-CG 3.55Å; F186-L191 PolarHBondContact O-N 2.92Å; F186-L191 VanDerWaalsContact O-N 3.13Å
187Y98.6Very high98.1Very high18 Ų1838.4 Ų38.47%0.07119%0.193CC..Hα-helixtrans-59.2-41.5177-79.6-60.9000111.4F183 S184 L191 N192 S193 R196 L200F183-Y187 HydrophobicContact CD1-CE2 4.34Å; F183-Y187 AromaticContact CD2-CD2 3.94Å; F183-Y187 HydrophobicContact CD2-CD2 3.94Å; F183-Y187 AromaticContact CD2-CE2 3.53Å; F183-Y187 HydrophobicContact CD2-CE2 3.53Å; F183-Y187 HydrophobicContact CE1-CE2 4.2Å; F183-Y187 HydrophobicContact CE2-CD2 4.11Å; F183-Y187 HydrophobicContact CE2-CE1 4.3Å; F183-Y187 AromaticContact CE2-CE2 3.34Å; F183-Y187 HydrophobicContact CE2-CE2 3.34Å; F183-Y187 AromaticContact CE2-CZ 3.45Å; F183-Y187 VanDerWaalsContact CE2-CZ 3.45Å; F183-Y187 WeakPolarHBondContact CE2-OH 3.33Å; F183-Y187 HydrophobicContact CG-CE2 4.05Å; F183-Y187 AromaticContact CZ-CE2 3.71Å; F183-Y187 HydrophobicContact CZ-CE2 3.71Å; F183-Y187 AromaticContact CZ-CZ 3.69Å; F183-Y187 WeakPolarHBondContact CZ-OH 3.39Å; F183-Y187 VanDerWaalsContact O-CD2 3.26Å; F183-Y187 WeakPolarHBondContact O-CD2 3.26Å; F183-Y187 PolarHBondContact O-N 3.16Å; F183-Y187 VanDerWaalsContact O-N 3.09Å; S184-Y187 PolarHBondContact O-N 3.37Å; S184-Y187 VanDerWaalsContact O-N 3.13Å; Y187-L191 HydrophobicContact CD1-CD1 3.72Å; Y187-L191 HydrophobicContact CE1-CD1 3.88Å; Y187-L191 CarbonylContact O-C 3.53Å; Y187-N192 PolarHBondContact O-N 3.23Å; Y187-S193 WeakPolarHBondContact O-CA 3.24Å; Y187-S193 PolarHBondContact O-N 2.95Å; Y187-R196 HydrophobicContact CD1-CB 3.86Å; Y187-R196 HydrophobicContact CD2-CB 4.38Å; Y187-R196 HydrophobicContact CE1-CB 4.34Å; Y187-R196 HydrophobicContact CG-CB 3.9Å; Y187-L200 HydrophobicContact CD2-CD2 4.06Å; Y187-L200 HydrophobicContact CE2-CD2 3.9Å
188Y98.3Very high98.1Very high60 Ų6039 Ų3924%0.23520%0.197CC..Hα-helixtrans-71-63179.6-172.8-87.6000111.5S184 V185 F186 N192 P194 W237 D240S184-Y188 PolarHBondContact O-N 3.27Å; V185-Y188 PolarHBondContact O-N 3.07Å; F186-Y188 VanDerWaalsContact C-N 3.25Å; F186-Y188 PolarHBondContact O-N 3.44Å; Y188-N192 WeakPolarHBondContact O-CA 3.07Å; Y188-N192 PolarHBondContact O-N 3.03Å; Y188-P194 HydrophobicContact CD2-CB 3.97Å; Y188-P194 HydrophobicContact CE2-CB 4.13Å; Y188-W237 AromaticContact CD1-CD1 3.95Å; Y188-W237 AromaticContact CD1-NE1 3.54Å; Y188-W237 HydrophobicContact CD2-CB 3.94Å; Y188-W237 AromaticContact CD2-CD1 3.42Å; Y188-W237 VanDerWaalsContact CD2-CD1 3.42Å; Y188-W237 AromaticContact CD2-CD2 3.71Å; Y188-W237 HydrophobicContact CD2-CD2 3.71Å; Y188-W237 AromaticContact CD2-CE2 3.86Å; Y188-W237 HydrophobicContact CD2-CE3 4.49Å; Y188-W237 AromaticContact CD2-CG 3.41Å; Y188-W237 HydrophobicContact CD2-CG 3.41Å; Y188-W237 VanDerWaalsContact CD2-CG 3.41Å; Y188-W237 AromaticContact CD2-NE1 3.67Å; Y188-W237 AromaticContact CE1-CD1 3.72Å; Y188-W237 AromaticContact CE1-NE1 3.66Å; Y188-W237 HydrophobicContact CE2-CB 3.66Å; Y188-W237 AromaticContact CE2-CD1 3.15Å; Y188-W237 HydrophobicContact CE2-CD2 4.18Å; Y188-W237 AromaticContact CE2-CG 3.39Å; Y188-W237 HydrophobicContact CE2-CG 3.39Å; Y188-W237 AromaticContact CE2-NE1 3.78Å; Y188-W237 AromaticContact CG-CD1 3.82Å; Y188-W237 HydrophobicContact CG-CD2 4.02Å; Y188-W237 AromaticContact CG-CE2 3.69Å; Y188-W237 HydrophobicContact CG-CG 4.08Å; Y188-W237 HydrophobicContact CG-CZ2 4.21Å; Y188-W237 AromaticContact CG-NE1 3.55Å; Y188-W237 AromaticContact CZ-CD1 3.31Å; Y188-W237 AromaticContact CZ-NE1 3.77Å; Y188-D240 PolarHBondContact OH-OD2 3.19Å
189E96.9Very high98.1Very high97 Ų9743.8 Ų43.845%0.45322%0.22SC..Hα-helixtrans-76.5-33.6-167.7-63.5-177.4167.500113.9R136 V185R136-E189 IonicContact NH1-OE2 2.74Å; V185-E189 VanDerWaalsContact CG1-CD 3.43Å; V185-E189 HydrophobicContact CG1-CG 3.99Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.45Å; V185-E189 WeakPolarHBondContact O-CB 3.17Å; V185-E189 PolarHBondContact O-N 3.16Å
190I98.3Very high98Very high17 Ų1744.6 Ų44.69%0.08722%0.224CC..THydrogen-bonded Turntrans-104.3-44-171.8-54.3-56.6000112.1R136 A139 E140 A151 F186R136-I190 HydrophobicContact CG-CG1 3.98Å; A139-I190 HydrophobicContact CB-CD1 4.31Å; A139-I190 HydrophobicContact CB-CG2 3.85Å; E140-I190 HydrophobicContact CG-CD1 3.98Å; A151-I190 HydrophobicContact CB-CG2 4.05Å; F186-I190 HydrophobicContact CD2-CB 3.56Å; F186-I190 HydrophobicContact CD2-CG1 3.78Å; F186-I190 HydrophobicContact CD2-CG2 3.98Å; F186-I190 HydrophobicContact CE2-CB 3.72Å; F186-I190 HydrophobicContact CE2-CG1 4.29Å; F186-I190 HydrophobicContact CE2-CG2 3.61Å; F186-I190 WeakPolarHBondContact O-CB 3.43Å; F186-I190 PolarHBondContact O-N 3.48Å
191L97.9Very high98Very high57 Ų5744.2 Ų44.230%0.29822%0.221SC..THydrogen-bonded Turntrans-91.8-0.9-179.6-62.2-173000113.8A151 F186 Y187 S193A151-L191 HydrophobicContact CB-CD2 4.5Å; F186-L191 HydrophobicContact CD1-CD1 4.04Å; F186-L191 HydrophobicContact CD1-CG 4.28Å; F186-L191 HydrophobicContact CE1-CD1 3.31Å; F186-L191 HydrophobicContact CE1-CD2 4.35Å; F186-L191 HydrophobicContact CE1-CG 3.68Å; F186-L191 HydrophobicContact CE2-CD2 4.29Å; F186-L191 HydrophobicContact CE2-CG 4.07Å; F186-L191 HydrophobicContact CZ-CD1 3.64Å; F186-L191 HydrophobicContact CZ-CD2 3.78Å; F186-L191 HydrophobicContact CZ-CG 3.55Å; F186-L191 PolarHBondContact O-N 2.92Å; F186-L191 VanDerWaalsContact O-N 3.13Å; Y187-L191 HydrophobicContact CD1-CD1 3.72Å; Y187-L191 HydrophobicContact CE1-CD1 3.88Å; Y187-L191 CarbonylContact O-C 3.53Å; L191-S193 PolarHBondContact O-N 2.98Å; L191-S193 VanDerWaalsContact O-N 3.14Å; L191-S193 PolarHBondContact O-OG 3.13Å
192N97Very high98Very high140 Ų14048.8 Ų48.875%0.74924%0.241SC*.  trans46.945-179.2-164.548.9000112.3Y187 Y188 P194Y187-N192 PolarHBondContact O-N 3.23Å; Y188-N192 WeakPolarHBondContact O-CA 3.07Å; Y188-N192 PolarHBondContact O-N 3.03Å; N192-P194 VanDerWaalsContact C-CD 3.42Å; N192-P194 WeakPolarHBondContact O-CD 3.4Å
193S97.6Very high98Very high32 Ų3252.6 Ų52.622%0.22426%0.258CS..  trans-12367.3-173.3-65.80000109.8Y187 L191 D195 R196 A197Y187-S193 WeakPolarHBondContact O-CA 3.24Å; Y187-S193 PolarHBondContact O-N 2.95Å; L191-S193 PolarHBondContact O-N 2.98Å; L191-S193 VanDerWaalsContact O-N 3.14Å; L191-S193 PolarHBondContact O-OG 3.13Å; S193-D195 VanDerWaalsContact C-N 3.3Å; S193-D195 PolarHBondContact O-N 3.24Å; S193-R196 PolarHBondContact O-N 3.24Å; S193-R196 VanDerWaalsContact O-N 3.08Å; S193-A197 PolarHBondContact O-N 2.85Å
194P96.7Very high98Very high28 Ų2853.4 Ų53.418%0.18226%0.264CS..Hα-helixtrans-59.3-37.6-173.823.8-34.4000112.7Y188 N192 R196 A197 C198Y188-P194 HydrophobicContact CD2-CB 3.97Å; Y188-P194 HydrophobicContact CE2-CB 4.13Å; N192-P194 VanDerWaalsContact C-CD 3.42Å; N192-P194 WeakPolarHBondContact O-CD 3.4Å; P194-R196 VanDerWaalsContact C-N 3.31Å; P194-R196 PolarHBondContact O-N 2.84Å; P194-A197 WeakPolarHBondContact O-CB 3.28Å; P194-A197 PolarHBondContact O-N 3.22Å; P194-A197 VanDerWaalsContact O-N 3.15Å; P194-C198 WeakPolarHBondContact O-CB 3.37Å; P194-C198 PolarHBondContact O-N 2.98Å; P194-C198 PolarHBondContact O-SG 3.45Å; P194-C198 VanDerWaalsContact O-SG 3.4Å
195D96.5Very high97.9Very high113 Ų11355.3 Ų55.360%0.60427%0.272SS*.Hα-helixtrans-58.9-42.5176.2-63.3-41.5000112.3S193 N199S193-D195 VanDerWaalsContact C-N 3.3Å; S193-D195 PolarHBondContact O-N 3.24Å; D195-N199 VanDerWaalsContact O-CB 3.25Å; D195-N199 WeakPolarHBondContact O-CB 3.25Å; D195-N199 PolarHBondContact O-N 2.94Å; D195-N199 PolarHBondContact O-ND2 3.44Å
196R97.7Very high97.9Very high154 Ų15457.8 Ų57.858%0.58129%0.285SS*.Hα-helixtrans-69.1-38.6177.8-67.6-173.9179.7-176.41.5111.4Y187 S193 P194 L200Y187-R196 HydrophobicContact CD1-CB 3.86Å; Y187-R196 HydrophobicContact CD2-CB 4.38Å; Y187-R196 HydrophobicContact CE1-CB 4.34Å; Y187-R196 HydrophobicContact CG-CB 3.9Å; S193-R196 PolarHBondContact O-N 3.24Å; S193-R196 VanDerWaalsContact O-N 3.08Å; P194-R196 VanDerWaalsContact C-N 3.31Å; P194-R196 PolarHBondContact O-N 2.84Å; R196-L200 WeakPolarHBondContact O-CB 3.46Å; R196-L200 PolarHBondContact O-N 3.33Å
197A98.1Very high97.9Very high0 Ų060.4 Ų60.40%030%0.299CS..Hα-helixtrans-61.4-51.7176.100000111.2S184 S193 P194 L200 A201 W237S184-A197 WeakPolarHBondContact CB-O 3.44Å; S184-A197 VanDerWaalsContact O-CB 3.23Å; S184-A197 WeakPolarHBondContact O-CB 3.47Å; S193-A197 PolarHBondContact O-N 2.85Å; P194-A197 WeakPolarHBondContact O-CB 3.28Å; P194-A197 PolarHBondContact O-N 3.22Å; P194-A197 VanDerWaalsContact O-N 3.15Å; A197-L200 PolarHBondContact O-N 2.76Å; A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 3.48Å; A197-W237 HydrophobicContact CB-CE3 4.04Å; A197-W237 HydrophobicContact CB-CH2 4.48Å; A197-W237 HydrophobicContact CB-CZ3 3.91Å
198C98.1Very high97.8Very high16 Ų1659.6 Ų59.611%0.10830%0.296CS..Hα-helixtrans-63-45.1179.3-700000111.9P194 L200 A201 K202 L234P194-C198 WeakPolarHBondContact O-CB 3.37Å; P194-C198 PolarHBondContact O-N 2.98Å; P194-C198 PolarHBondContact O-SG 3.45Å; P194-C198 VanDerWaalsContact O-SG 3.4Å; C198-L200 PolarHBondContact O-N 2.81Å; C198-A201 PolarHBondContact O-N 2.71Å; C198-K202 WeakPolarHBondContact O-CB 3.43Å; C198-K202 PolarHBondContact O-N 2.93Å; C198-L234 HydrophobicContact CB-CD2 4.12Å; C198-L234 WeakPolarHBondContact O-CD2 3.46Å
199N98.1Very high97.7Very high108 Ų10860.7 Ų60.758%0.57831%0.305SS*.Hα-helixtrans-60-44.9177.9-75.2-31.4000111.9D195 Q203D195-N199 VanDerWaalsContact O-CB 3.25Å; D195-N199 WeakPolarHBondContact O-CB 3.25Å; D195-N199 PolarHBondContact O-N 2.94Å; D195-N199 PolarHBondContact O-ND2 3.44Å; N199-Q203 VanDerWaalsContact O-CB 3.27Å; N199-Q203 WeakPolarHBondContact O-CB 3.26Å; N199-Q203 PolarHBondContact O-N 3.31Å
200L98.4Very high97.7Very high21 Ų2160.2 Ų60.211%0.1132%0.317CS..Hα-helixtrans-66.6-46.3178.9178.860.4000112.3F183 Y187 R196 A197 C198 A204F183-L200 HydrophobicContact CB-CD2 3.78Å; F183-L200 HydrophobicContact CD1-CD2 3.78Å; F183-L200 HydrophobicContact CG-CD2 3.75Å; Y187-L200 HydrophobicContact CD2-CD2 4.06Å; Y187-L200 HydrophobicContact CE2-CD2 3.9Å; R196-L200 WeakPolarHBondContact O-CB 3.46Å; R196-L200 PolarHBondContact O-N 3.33Å; A197-L200 PolarHBondContact O-N 2.76Å; C198-L200 PolarHBondContact O-N 2.81Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.34Å
201A98.3Very high97.5Very high0 Ų063.3 Ų63.30%033%0.331CS..Hα-helixtrans-65.6-41.8-179.500000111.7A197 C198 A204 F205 L230 L234 W237A197-A201 WeakPolarHBondContact O-CB 3.39Å; A197-A201 PolarHBondContact O-N 3.48Å; C198-A201 PolarHBondContact O-N 2.71Å; A201-A204 PolarHBondContact O-N 2.99Å; A201-F205 WeakPolarHBondContact O-CB 3.11Å; A201-F205 PolarHBondContact O-N 3.43Å; A201-L230 HydrophobicContact CB-CD2 3.86Å; A201-L234 HydrophobicContact CB-CD1 4.3Å; A201-L234 HydrophobicContact CB-CD2 3.83Å; A201-L234 HydrophobicContact CB-CG 3.88Å; A201-W237 HydrophobicContact CB-CZ3 4.29Å
202K98.1Very high97.2Very high115 Ų11561.5 Ų61.550%0.532%0.322SS..Hα-helixtrans-63.9-48.8177.2-175.3-173.517881.40111C198 A204 F205 D206 L234C198-K202 WeakPolarHBondContact O-CB 3.43Å; C198-K202 PolarHBondContact O-N 2.93Å; K202-A204 VanDerWaalsContact C-N 3.34Å; K202-A204 PolarHBondContact O-N 3.4Å; K202-F205 PolarHBondContact O-N 3.38Å; K202-D206 WeakPolarHBondContact CE-OD2 3.42Å; K202-D206 WeakPolarHBondContact CG-OD2 3.38Å; K202-D206 WeakPolarHBondContact O-CB 3.27Å; K202-D206 VanDerWaalsContact O-CG 3.28Å; K202-D206 PolarHBondContact O-N 3.42Å; K202-L234 HydrophobicContact CB-CD1 4.19Å; K202-L234 HydrophobicContact CB-CD2 4.07Å
203Q98.4Very high97Very high110 Ų11062.8 Ų62.851%0.51433%0.329SS..Hα-helixtrans-57.8-47.7177.8-177.4-178.2-0.500111.4N199 F205 D206 D207N199-Q203 VanDerWaalsContact O-CB 3.27Å; N199-Q203 WeakPolarHBondContact O-CB 3.26Å; N199-Q203 PolarHBondContact O-N 3.31Å; Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 2.83Å; Q203-D206 PolarHBondContact O-N 3.17Å; Q203-D207 VanDerWaalsContact O-CB 3.29Å; Q203-D207 WeakPolarHBondContact O-CB 3.48Å; Q203-D207 PolarHBondContact O-N 3.04Å
204A98.4Very high96.5Very high16 Ų1666.6 Ų66.613%0.13235%0.351CS..Hα-helixtrans-63.4-37.2179.400000112.9A180 L200 A201 K202 A208 L230A180-A204 HydrophobicContact CB-CB 3.39Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.34Å; A201-A204 PolarHBondContact O-N 2.99Å; K202-A204 VanDerWaalsContact C-N 3.34Å; K202-A204 PolarHBondContact O-N 3.4Å; A204-A208 VanDerWaalsContact O-CB 3.3Å; A204-A208 WeakPolarHBondContact O-CB 3.49Å; A204-A208 PolarHBondContact O-N 2.92Å; A204-L230 HydrophobicContact CB-CD1 4.27Å
205F98.1Very high96.2Very high41 Ų4166.8 Ų66.818%0.1835%0.35CS..Hα-helixtrans-67.1-47.6175.4-175.7-87.7000111.8A201 K202 Q203 A208 I209 M227 L230 R231A201-F205 WeakPolarHBondContact O-CB 3.11Å; A201-F205 PolarHBondContact O-N 3.43Å; K202-F205 PolarHBondContact O-N 3.38Å; Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 2.83Å; F205-A208 PolarHBondContact O-N 2.99Å; F205-I209 HydrophobicContact CE1-CB 4.48Å; F205-I209 WeakPolarHBondContact O-CB 3.37Å; F205-I209 PolarHBondContact O-N 3.07Å; F205-M227 HydrophobicContact CD2-CB 4.11Å; F205-M227 WeakPolarHBondContact CD2-O 3.29Å; F205-M227 HydrophobicContact CE2-CB 4.08Å; F205-M227 HydrophobicContact CE2-CE 4.39Å; F205-M227 WeakPolarHBondContact CE2-O 3.27Å; F205-L230 HydrophobicContact CD2-CB 4.47Å; F205-R231 HydrophobicContact CD2-CB 4.29Å; F205-R231 HydrophobicContact CE2-CB 3.92Å; F205-R231 HydrophobicContact CE2-CG 4.49Å
206D98.1Very high95.7Very high69 Ų6963.7 Ų63.737%0.36935%0.345SS..Hα-helixtrans-68-37.5-178.1-69.3-13.2000111.8K202 Q203 I209 A210K202-D206 WeakPolarHBondContact CE-OD2 3.42Å; K202-D206 WeakPolarHBondContact CG-OD2 3.38Å; K202-D206 WeakPolarHBondContact O-CB 3.27Å; K202-D206 VanDerWaalsContact O-CG 3.28Å; K202-D206 PolarHBondContact O-N 3.42Å; Q203-D206 PolarHBondContact O-N 3.17Å; D206-I209 VanDerWaalsContact O-CG2 3.32Å; D206-I209 WeakPolarHBondContact O-CG2 3.02Å; D206-A210 PolarHBondContact O-N 2.95Å
207D97.6Very high95.2Very high57 Ų5765.3 Ų65.331%0.30536%0.359SS..Hα-helixtrans-66.2-40.5174.9-72.5-10.2000111.2T171 Q203T171-D207 HydrophobicContact CG2-CB 3.91Å; T171-D207 PolarHBondContact OG1-O 3.26Å; Q203-D207 VanDerWaalsContact O-CB 3.29Å; Q203-D207 WeakPolarHBondContact O-CB 3.48Å; Q203-D207 PolarHBondContact O-N 3.04Å
208A97.2Very high94.6Very high0 Ų074.1 Ų74.10%040%0.4CS..Hα-helixtrans-77.8-35.7-178.700000113.2T172 L177 A204 F205 A210 E211 L212 M227T172-A208 HydrophobicContact CG2-CB 4.41Å; L177-A208 HydrophobicContact CD1-CB 4.46Å; L177-A208 HydrophobicContact CD2-CB 3.73Å; A204-A208 VanDerWaalsContact O-CB 3.3Å; A204-A208 WeakPolarHBondContact O-CB 3.49Å; A204-A208 PolarHBondContact O-N 2.92Å; F205-A208 PolarHBondContact O-N 2.99Å; A208-A210 PolarHBondContact O-N 3.01Å; A208-E211 PolarHBondContact O-N 2.92Å; A208-L212 WeakPolarHBondContact O-CB 3.17Å; A208-L212 PolarHBondContact O-N 3.37Å; A208-M227 HydrophobicContact CB-CE 3.92Å; A208-M227 HydrophobicContact CB-CG 4.35Å; A208-M227 HydrophobicContact CB-SD 3.92Å
209I96.4Very high94.2Very high84 Ų8475.2 Ų75.243%0.43141%0.408SS..Hα-helixtrans-64.3-33.6176.8-160.770.1000111.1F205 D206 E211 L212 M227F205-I209 HydrophobicContact CE1-CB 4.48Å; F205-I209 WeakPolarHBondContact O-CB 3.37Å; F205-I209 PolarHBondContact O-N 3.07Å; D206-I209 VanDerWaalsContact O-CG2 3.32Å; D206-I209 WeakPolarHBondContact O-CG2 3.02Å; I209-E211 VanDerWaalsContact C-N 3.25Å; I209-E211 PolarHBondContact O-N 3.46Å; I209-L212 HydrophobicContact CD1-CD2 3.97Å; I209-L212 PolarHBondContact O-N 3.3Å; I209-M227 HydrophobicContact CB-CE 3.98Å; I209-M227 HydrophobicContact CD1-CE 3.81Å
210A96.4Very high93.9Very high86 Ų8675.3 Ų75.371%0.71140%0.401SS*.Hα-helixtrans-66-25.917800000113.5D206 A208D206-A210 PolarHBondContact O-N 2.95Å; A208-A210 PolarHBondContact O-N 3.01Å
211E94.8Very high93.7Very high82 Ų8282 Ų8238%0.38343%0.429SS..Hα-helixtrans-112.92.1-178.1-67.3-176-163.900113.1T171 T172 A208 I209 D213 T214T171-E211 VanDerWaalsContact OG1-CD 3.32Å; T171-E211 PolarHBondContact OG1-OE2 2.83Å; T172-E211 HydrophobicContact CG2-CB 3.91Å; A208-E211 PolarHBondContact O-N 2.92Å; I209-E211 VanDerWaalsContact C-N 3.25Å; I209-E211 PolarHBondContact O-N 3.46Å; E211-D213 VanDerWaalsContact C-N 3.27Å; E211-D213 PolarHBondContact O-N 3.16Å; E211-T214 WeakPolarHBondContact O-CB 3.49Å; E211-T214 PolarHBondContact O-N 3.17Å; E211-T214 PolarHBondContact O-OG1 2.86Å
212L92.3Very high93.5Very high20 Ų2086 Ų8611%0.10545%0.451CS..G310 helixtrans-59.9-35.3-170.9-173.262.2000113.1A208 I209 T214 L215 Y220 T224 M227A208-L212 WeakPolarHBondContact O-CB 3.17Å; A208-L212 PolarHBondContact O-N 3.37Å; I209-L212 HydrophobicContact CD1-CD2 3.97Å; I209-L212 PolarHBondContact O-N 3.3Å; L212-T214 PolarHBondContact O-N 2.91Å; L212-T214 VanDerWaalsContact O-N 3.14Å; L212-L215 HydrophobicContact CD1-CD2 3.99Å; L212-L215 VanDerWaalsContact O-CB 3.25Å; L212-L215 WeakPolarHBondContact O-CB 2.89Å; L212-L215 PolarHBondContact O-N 2.99Å; L212-L215 VanDerWaalsContact O-N 3.12Å; L212-Y220 HydrophobicContact CD1-CE2 4.29Å; L212-Y220 HydrophobicContact CG-CE2 4.3Å; L212-T224 HydrophobicContact CD1-CG2 4.06Å; L212-T224 HydrophobicContact CD2-CG2 4.34Å; L212-M227 HydrophobicContact CD1-SD 3.95Å; L212-M227 HydrophobicContact CD2-CE 4.27Å; L212-M227 HydrophobicContact CD2-SD 4.48Å
213D91Very high93.4Very high167 Ų16780.6 Ų80.689%0.89343%0.427SS*.G310 helixtrans-65.5-14.5179.3-68.5-21.6000113.4E211E211-D213 VanDerWaalsContact C-N 3.27Å; E211-D213 PolarHBondContact O-N 3.16Å
214T88.8Confident93.3Very high112 Ų11277.4 Ų77.469%0.68742%0.415SS*.G310 helixtrans-90.2-7.5178.272.40000113.3E211 L212E211-T214 WeakPolarHBondContact O-CB 3.49Å; E211-T214 PolarHBondContact O-N 3.17Å; E211-T214 PolarHBondContact O-OG1 2.86Å; L212-T214 PolarHBondContact O-N 2.91Å; L212-T214 VanDerWaalsContact O-N 3.14Å
215L88.6Confident93.3Very high32 Ų3281.6 Ų81.617%0.16844%0.435CS..  trans-77.8129.2-171-168.461000111.6L212 Y220L212-L215 HydrophobicContact CD1-CD2 3.99Å; L212-L215 VanDerWaalsContact O-CB 3.25Å; L212-L215 WeakPolarHBondContact O-CB 2.89Å; L212-L215 PolarHBondContact O-N 2.99Å; L212-L215 VanDerWaalsContact O-N 3.12Å; L215-Y220 HydrophobicContact CB-CD2 4.33Å; L215-Y220 HydrophobicContact CD2-CD2 4.27Å
216G87.7Confident93.3Very high47 Ų4781 Ų8149%0.48543%0.433SS..  trans-69.4158.9174.200000113.2E218 S219 Y220G216-E218 PolarHBondContact O-N 3.48Å; G216-E218 VanDerWaalsContact O-N 3.15Å; G216-S219 PolarHBondContact O-N 3Å; G216-Y220 PolarHBondContact O-N 3.32Å
217E86.8Confident93.3Very high188 Ų18878 Ų7888%0.87942%0.417SS*.Hα-helixtrans-55.9-34.3-175.8-67-175.5173.900113.7S219 Y220E217-S219 PolarHBondContact O-N 3.41Å; E217-Y220 PolarHBondContact O-N 3.43Å
218E85.4Confident93.3Very high186 Ų18678.3 Ų78.387%0.86942%0.417SS*.Hα-helixtrans-62.4-40.7-176-173.1175.7-171.400113G216G216-E218 PolarHBondContact O-N 3.48Å; G216-E218 VanDerWaalsContact O-N 3.15Å
219S89.2Confident93.4Very high38 Ų3881.9 Ų81.927%0.26644%0.436SS..Hα-helixtrans-96.2-14.9-179.9-67.30000113.4G216 E217 K221 D222 S223G216-S219 PolarHBondContact O-N 3Å; E217-S219 PolarHBondContact O-N 3.41Å; S219-K221 VanDerWaalsContact C-N 3.35Å; S219-K221 PolarHBondContact O-N 3.06Å; S219-D222 PolarHBondContact O-N 3.16Å; S219-S223 WeakPolarHBondContact O-CB 3.34Å; S219-S223 PolarHBondContact O-N 3.18Å; S219-S223 PolarHBondContact O-OG 3.44Å
220Y91.7Very high93.5Very high111 Ų11177.9 Ų77.944%0.43542%0.415SS..Hα-helixtrans-55.3-47.2-171.5-169.6-90.3000113.1L212 L215 G216 E217 T224L212-Y220 HydrophobicContact CD1-CE2 4.29Å; L212-Y220 HydrophobicContact CG-CE2 4.3Å; L215-Y220 HydrophobicContact CB-CD2 4.33Å; L215-Y220 HydrophobicContact CD2-CD2 4.27Å; G216-Y220 PolarHBondContact O-N 3.32Å; E217-Y220 PolarHBondContact O-N 3.43Å; Y220-T224 HydrophobicContact CD1-CG2 4.11Å; Y220-T224 HydrophobicContact CE1-CG2 3.8Å; Y220-T224 HydrophobicContact CE2-CG2 4.3Å; Y220-T224 HydrophobicContact CG-CG2 4.49Å; Y220-T224 WeakPolarHBondContact O-CB 3.22Å; Y220-T224 VanDerWaalsContact O-CG2 3.27Å; Y220-T224 WeakPolarHBondContact O-CG2 3.26Å; Y220-T224 PolarHBondContact O-N 3.29Å; Y220-T224 PolarHBondContact O-OG1 3.02Å
221K94.1Very high93.5Very high160 Ų16079.4 Ų79.470%0.69640%0.402SS*.Hα-helixtrans-63.7-44.9-178.3-175.3-176.8175.5-172.90112.4S219 T224 L225S219-K221 VanDerWaalsContact C-N 3.35Å; S219-K221 PolarHBondContact O-N 3.06Å; K221-T224 PolarHBondContact O-OG1 3.15Å; K221-L225 WeakPolarHBondContact O-CB 3.36Å; K221-L225 PolarHBondContact O-N 3.27Å; K221-L225 VanDerWaalsContact O-N 3.14Å
222D94.5Very high93.7Very high86 Ų8678.7 Ų78.746%0.4640%0.401SS..Hα-helixtrans-72-43.6-176.5-71.7-13.3000111.1P174 S219 L225 I226P174-D222 HydrophobicContact CB-CB 4.13Å; P174-D222 HydrophobicContact CG-CB 4.04Å; S219-D222 PolarHBondContact O-N 3.16Å; D222-L225 PolarHBondContact O-N 2.98Å; D222-I226 VanDerWaalsContact O-CG1 3.27Å; D222-I226 WeakPolarHBondContact O-CG1 3.34Å; D222-I226 PolarHBondContact O-N 3.38Å; D222-I226 VanDerWaalsContact O-N 3.08Å
223S96.4Very high93.9Very high0 Ų079.4 Ų79.40%041%0.405CS..Hα-helixtrans-63.6-45.7178-60.50000112.2T172 P174 S219 L225 I226 M227T172-S223 WeakPolarHBondContact O-CB 3.17Å; T172-S223 PolarHBondContact O-OG 3.18Å; P174-S223 WeakPolarHBondContact CD-OG 3.32Å; P174-S223 WeakPolarHBondContact CG-OG 3.27Å; S219-S223 WeakPolarHBondContact O-CB 3.34Å; S219-S223 PolarHBondContact O-N 3.18Å; S219-S223 PolarHBondContact O-OG 3.44Å; S223-L225 VanDerWaalsContact C-N 3.35Å; S223-L225 PolarHBondContact O-N 2.88Å; S223-I226 PolarHBondContact O-N 3.43Å; S223-M227 VanDerWaalsContact O-CG 3.26Å; S223-M227 WeakPolarHBondContact O-CG 3.4Å; S223-M227 PolarHBondContact O-N 2.84Å
224T96.7Very high94.2Very high44 Ų4472.8 Ų72.827%0.2737%0.369SS..Hα-helixtrans-65.4-37179.2520000112.5L212 Y220 K221 I226 M227 Q228L212-T224 HydrophobicContact CD1-CG2 4.06Å; L212-T224 HydrophobicContact CD2-CG2 4.34Å; Y220-T224 HydrophobicContact CD1-CG2 4.11Å; Y220-T224 HydrophobicContact CE1-CG2 3.8Å; Y220-T224 HydrophobicContact CE2-CG2 4.3Å; Y220-T224 HydrophobicContact CG-CG2 4.49Å; Y220-T224 WeakPolarHBondContact O-CB 3.22Å; Y220-T224 VanDerWaalsContact O-CG2 3.27Å; Y220-T224 WeakPolarHBondContact O-CG2 3.26Å; Y220-T224 PolarHBondContact O-N 3.29Å; Y220-T224 PolarHBondContact O-OG1 3.02Å; K221-T224 PolarHBondContact O-OG1 3.15Å; T224-I226 VanDerWaalsContact C-N 3.35Å; T224-I226 PolarHBondContact O-N 2.9Å; T224-M227 PolarHBondContact O-N 2.69Å; T224-Q228 WeakPolarHBondContact O-CB 3.18Å; T224-Q228 PolarHBondContact O-N 3.41Å
225L97.3Very high94.5Very high103 Ų10371.4 Ų71.454%0.53936%0.361SS..Hα-helixtrans-61.4-42.6172.717962.2000111.7K221 D222 S223 Q228 L229K221-L225 WeakPolarHBondContact O-CB 3.36Å; K221-L225 PolarHBondContact O-N 3.27Å; K221-L225 VanDerWaalsContact O-N 3.14Å; D222-L225 PolarHBondContact O-N 2.98Å; S223-L225 VanDerWaalsContact C-N 3.35Å; S223-L225 PolarHBondContact O-N 2.88Å; L225-Q228 WeakPolarHBondContact O-CB 3.44Å; L225-Q228 PolarHBondContact O-N 3.32Å; L225-L229 WeakPolarHBondContact O-CG 3.32Å; L225-L229 PolarHBondContact O-N 3.35Å; L225-L229 VanDerWaalsContact O-N 3.15Å
226I98.1Very high94.8Very high29 Ų2974.2 Ų74.215%0.14938%0.376CS..Hα-helixtrans-70.5-40.3178.9-61.7164.7000111.2P174 L177 L181 D222 S223 T224 Q228 L229 L230P174-I226 HydrophobicContact CB-CD1 4.08Å; P174-I226 VanDerWaalsContact O-CD1 3.28Å; P174-I226 WeakPolarHBondContact O-CD1 3.36Å; L177-I226 HydrophobicContact CB-CB 4.16Å; L177-I226 HydrophobicContact CB-CD1 4.47Å; L177-I226 HydrophobicContact CB-CG2 3.6Å; L181-I226 HydrophobicContact CB-CG2 4.3Å; L181-I226 HydrophobicContact CD2-CG2 4.19Å; D222-I226 VanDerWaalsContact O-CG1 3.27Å; D222-I226 WeakPolarHBondContact O-CG1 3.34Å; D222-I226 PolarHBondContact O-N 3.38Å; D222-I226 VanDerWaalsContact O-N 3.08Å; S223-I226 PolarHBondContact O-N 3.43Å; T224-I226 VanDerWaalsContact C-N 3.35Å; T224-I226 PolarHBondContact O-N 2.9Å; I226-Q228 VanDerWaalsContact C-N 3.27Å; I226-Q228 PolarHBondContact O-N 3.08Å; I226-L229 WeakPolarHBondContact O-CB 3.3Å; I226-L229 PolarHBondContact O-N 3.06Å; I226-L230 PolarHBondContact O-N 3.27Å
227M98.1Very high95.2Very high6 Ų672.3 Ų72.33%0.0335%0.354CS..Hα-helixtrans-60.4-38.8174.2-70.8172.172.100111.7L177 F205 A208 I209 L212 S223 T224 L230 R231L177-M227 HydrophobicContact CD1-CG 4Å; L177-M227 HydrophobicContact CD1-SD 4.47Å; L177-M227 HydrophobicContact CD2-CG 4.16Å; F205-M227 HydrophobicContact CD2-CB 4.11Å; F205-M227 WeakPolarHBondContact CD2-O 3.29Å; F205-M227 HydrophobicContact CE2-CB 4.08Å; F205-M227 HydrophobicContact CE2-CE 4.39Å; F205-M227 WeakPolarHBondContact CE2-O 3.27Å; A208-M227 HydrophobicContact CB-CE 3.92Å; A208-M227 HydrophobicContact CB-CG 4.35Å; A208-M227 HydrophobicContact CB-SD 3.92Å; I209-M227 HydrophobicContact CB-CE 3.98Å; I209-M227 HydrophobicContact CD1-CE 3.81Å; L212-M227 HydrophobicContact CD1-SD 3.95Å; L212-M227 HydrophobicContact CD2-CE 4.27Å; L212-M227 HydrophobicContact CD2-SD 4.48Å; S223-M227 VanDerWaalsContact O-CG 3.26Å; S223-M227 WeakPolarHBondContact O-CG 3.4Å; S223-M227 PolarHBondContact O-N 2.84Å; T224-M227 PolarHBondContact O-N 2.69Å; M227-L230 WeakPolarHBondContact O-CB 3.37Å; M227-L230 PolarHBondContact O-N 3.4Å; M227-R231 PolarHBondContact O-N 2.6Å
228Q98.1Very high95.4Very high63 Ų6367 Ų6729%0.29434%0.335SS..Hα-helixtrans-59.9-46.4173.5177.455.242.200111.3T224 L225 I226 L230 R231 D232T224-Q228 WeakPolarHBondContact O-CB 3.18Å; T224-Q228 PolarHBondContact O-N 3.41Å; L225-Q228 WeakPolarHBondContact O-CB 3.44Å; L225-Q228 PolarHBondContact O-N 3.32Å; I226-Q228 VanDerWaalsContact C-N 3.27Å; I226-Q228 PolarHBondContact O-N 3.08Å; Q228-L230 PolarHBondContact O-N 2.92Å; Q228-R231 WeakPolarHBondContact O-CB 3.37Å; Q228-R231 PolarHBondContact O-N 2.91Å; Q228-D232 PolarHBondContact NE2-OD1 2.85Å; Q228-D232 PolarHBondContact NE2-OD2 3.34Å; Q228-D232 PolarHBondContact O-N 3.17Å
229L98.4Very high95.5Very high76 Ų7660.6 Ų60.640%0.39831%0.31SS..Hα-helixtrans-63.2-39176.3-66171.6000112.8L181 L225 I226 D232 N233L181-L229 HydrophobicContact CD1-CB 4.08Å; L181-L229 HydrophobicContact CD2-CB 3.89Å; L181-L229 HydrophobicContact CD2-CD1 3.89Å; L225-L229 WeakPolarHBondContact O-CG 3.32Å; L225-L229 PolarHBondContact O-N 3.35Å; L225-L229 VanDerWaalsContact O-N 3.15Å; I226-L229 WeakPolarHBondContact O-CB 3.3Å; I226-L229 PolarHBondContact O-N 3.06Å; L229-D232 PolarHBondContact O-N 3.35Å; L229-N233 PolarHBondContact O-N 3.39Å
230L98.4Very high95Very high0 Ų061.1 Ų61.10%031%0.31CS..Hα-helixtrans-59.8-45.9173.9-78167.7000111.4L177 L181 A201 A204 F205 I226 M227 Q228 N233 L234L177-L230 HydrophobicContact CD2-CD1 4.05Å; L181-L230 HydrophobicContact CB-CD2 3.91Å; L181-L230 HydrophobicContact CB-CG 4.24Å; L181-L230 HydrophobicContact CD1-CD2 3.98Å; L181-L230 HydrophobicContact CD1-CG 4.2Å; A201-L230 HydrophobicContact CB-CD2 3.86Å; A204-L230 HydrophobicContact CB-CD1 4.27Å; F205-L230 HydrophobicContact CD2-CB 4.47Å; I226-L230 PolarHBondContact O-N 3.27Å; M227-L230 WeakPolarHBondContact O-CB 3.37Å; M227-L230 PolarHBondContact O-N 3.4Å; Q228-L230 PolarHBondContact O-N 2.92Å; L230-N233 PolarHBondContact O-N 2.97Å; L230-L234 WeakPolarHBondContact O-CG 3.32Å; L230-L234 PolarHBondContact O-N 3.16Å
231R97.8Very high94.1Very high117 Ų11758.9 Ų58.944%0.44231%0.306SS..Hα-helixtrans-63.2-41.4177.4-170.5-171.674.3-167.14112.3F205 M227 Q228 L234 T235F205-R231 HydrophobicContact CD2-CB 4.29Å; F205-R231 HydrophobicContact CE2-CB 3.92Å; F205-R231 HydrophobicContact CE2-CG 4.49Å; M227-R231 PolarHBondContact O-N 2.6Å; Q228-R231 WeakPolarHBondContact O-CB 3.37Å; Q228-R231 PolarHBondContact O-N 2.91Å; R231-L234 PolarHBondContact O-N 3.2Å; R231-T235 PolarHBondContact O-N 3.22Å; R231-T235 PolarHBondContact O-OG1 2.86Å
232D98Very high92.7Very high68 Ų6854.6 Ų54.636%0.36430%0.3SS..Hα-helixtrans-66.7-41.4-179.4-64.9-14.3000110.9Q228 L229 T235 L236Q228-D232 PolarHBondContact NE2-OD1 2.85Å; Q228-D232 PolarHBondContact NE2-OD2 3.34Å; Q228-D232 PolarHBondContact O-N 3.17Å; L229-D232 PolarHBondContact O-N 3.35Å; D232-T235 WeakPolarHBondContact O-CB 3.41Å; D232-T235 PolarHBondContact O-N 3.37Å; D232-L236 PolarHBondContact O-N 3.41Å
233N97Very high91Very high35 Ų3558.2 Ų58.219%0.18731%0.314CS..Hα-helixtrans-61.6-45.5172.4-78.70.4000112.3L181 L229 L230 T235 L236 W237L181-N233 VanDerWaalsContact CD1-ND2 3.31Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.48Å; L229-N233 PolarHBondContact O-N 3.39Å; L230-N233 PolarHBondContact O-N 2.97Å; N233-T235 VanDerWaalsContact C-N 3.26Å; N233-T235 PolarHBondContact O-N 2.94Å; N233-L236 PolarHBondContact O-N 2.6Å; N233-W237 HydrophobicContact CB-CD2 4.22Å; N233-W237 HydrophobicContact CB-CE3 4.1Å; N233-W237 HydrophobicContact CB-CH2 3.65Å; N233-W237 HydrophobicContact CB-CZ2 3.76Å; N233-W237 HydrophobicContact CB-CZ3 3.82Å; N233-W237 WeakPolarHBondContact O-CB 3.43Å; N233-W237 VanDerWaalsContact O-CD2 3.25Å; N233-W237 PolarHBondContact O-N 2.96Å
234L96.7Very high89Confident27 Ų2765.4 Ų65.414%0.14135%0.353CS..Hα-helixtrans-57.2-41.9175.5-77.2167.7000111.8C198 A201 K202 L230 R231 T238C198-L234 HydrophobicContact CB-CD2 4.12Å; C198-L234 WeakPolarHBondContact O-CD2 3.46Å; A201-L234 HydrophobicContact CB-CD1 4.3Å; A201-L234 HydrophobicContact CB-CD2 3.83Å; A201-L234 HydrophobicContact CB-CG 3.88Å; K202-L234 HydrophobicContact CB-CD1 4.19Å; K202-L234 HydrophobicContact CB-CD2 4.07Å; L230-L234 WeakPolarHBondContact O-CG 3.32Å; L230-L234 PolarHBondContact O-N 3.16Å; R231-L234 PolarHBondContact O-N 3.2Å; L234-T238 WeakPolarHBondContact O-CB 3.25Å; L234-T238 VanDerWaalsContact O-CG2 3.24Å; L234-T238 WeakPolarHBondContact O-CG2 3.45Å; L234-T238 PolarHBondContact O-N 3.35Å; L234-T238 VanDerWaalsContact O-N 3.08Å; L234-T238 PolarHBondContact O-OG1 3.35Å
235T96Very high86.5Confident84 Ų8465.9 Ų65.952%0.51537%0.366SS..Hα-helixtrans-63.1-47.9178.7-540000110.7R231 D232 N233 T238 S239R231-T235 PolarHBondContact O-N 3.22Å; R231-T235 PolarHBondContact O-OG1 2.86Å; D232-T235 WeakPolarHBondContact O-CB 3.41Å; D232-T235 PolarHBondContact O-N 3.37Å; N233-T235 VanDerWaalsContact C-N 3.26Å; N233-T235 PolarHBondContact O-N 2.94Å; T235-T238 PolarHBondContact O-OG1 3.21Å; T235-S239 PolarHBondContact O-N 3.24Å; T235-S239 VanDerWaalsContact O-N 3.14Å; T235-S239 PolarHBondContact O-OG 3.14Å
236L94.6Very high83.8Confident91 Ų9163.8 Ų63.848%0.47637%0.37SS..Hα-helixtrans-60.9-51.1179-179.266.6000112.1D232 N233 T238 S239 D240D232-L236 PolarHBondContact O-N 3.41Å; N233-L236 PolarHBondContact O-N 2.6Å; L236-T238 VanDerWaalsContact C-N 3.3Å; L236-T238 PolarHBondContact O-N 3.34Å; L236-S239 PolarHBondContact O-N 2.84Å; L236-S239 PolarHBondContact O-OG 2.86Å; L236-D240 PolarHBondContact O-N 3.49Å; L236-D240 VanDerWaalsContact O-N 3.1Å
237W95.2Very high80.8Confident6 Ų670.3 Ų70.32%0.02341%0.405CS..Hα-helixtrans-71.8-25.8-174.3-57.5-26.7000113.3V185 Y188 A197 A201 N233 N241V185-W237 HydrophobicContact CG2-CH2 4.01Å; V185-W237 HydrophobicContact CG2-CZ2 3.96Å; Y188-W237 AromaticContact CD1-CD1 3.95Å; Y188-W237 AromaticContact CD1-NE1 3.54Å; Y188-W237 HydrophobicContact CD2-CB 3.94Å; Y188-W237 AromaticContact CD2-CD1 3.42Å; Y188-W237 VanDerWaalsContact CD2-CD1 3.42Å; Y188-W237 AromaticContact CD2-CD2 3.71Å; Y188-W237 HydrophobicContact CD2-CD2 3.71Å; Y188-W237 AromaticContact CD2-CE2 3.86Å; Y188-W237 HydrophobicContact CD2-CE3 4.49Å; Y188-W237 AromaticContact CD2-CG 3.41Å; Y188-W237 HydrophobicContact CD2-CG 3.41Å; Y188-W237 VanDerWaalsContact CD2-CG 3.41Å; Y188-W237 AromaticContact CD2-NE1 3.67Å; Y188-W237 AromaticContact CE1-CD1 3.72Å; Y188-W237 AromaticContact CE1-NE1 3.66Å; Y188-W237 HydrophobicContact CE2-CB 3.66Å; Y188-W237 AromaticContact CE2-CD1 3.15Å; Y188-W237 HydrophobicContact CE2-CD2 4.18Å; Y188-W237 AromaticContact CE2-CG 3.39Å; Y188-W237 HydrophobicContact CE2-CG 3.39Å; Y188-W237 AromaticContact CE2-NE1 3.78Å; Y188-W237 AromaticContact CG-CD1 3.82Å; Y188-W237 HydrophobicContact CG-CD2 4.02Å; Y188-W237 AromaticContact CG-CE2 3.69Å; Y188-W237 HydrophobicContact CG-CG 4.08Å; Y188-W237 HydrophobicContact CG-CZ2 4.21Å; Y188-W237 AromaticContact CG-NE1 3.55Å; Y188-W237 AromaticContact CZ-CD1 3.31Å; Y188-W237 AromaticContact CZ-NE1 3.77Å; A197-W237 HydrophobicContact CB-CE3 4.04Å; A197-W237 HydrophobicContact CB-CH2 4.48Å; A197-W237 HydrophobicContact CB-CZ3 3.91Å; A201-W237 HydrophobicContact CB-CZ3 4.29Å; N233-W237 HydrophobicContact CB-CD2 4.22Å; N233-W237 HydrophobicContact CB-CE3 4.1Å; N233-W237 HydrophobicContact CB-CH2 3.65Å; N233-W237 HydrophobicContact CB-CZ2 3.76Å; N233-W237 HydrophobicContact CB-CZ3 3.82Å; N233-W237 WeakPolarHBondContact O-CB 3.43Å; N233-W237 VanDerWaalsContact O-CD2 3.25Å; N233-W237 PolarHBondContact O-N 2.96Å; W237-N241 PolarHBondContact O-N 3.36Å
238T91.1Very high78Confident77 Ų7778.7 Ų78.747%0.47244%0.444SS..Hα-helixtrans-80.3-28.4175.153.90000112.7L234 T235 L236 A242L234-T238 WeakPolarHBondContact O-CB 3.25Å; L234-T238 VanDerWaalsContact O-CG2 3.24Å; L234-T238 WeakPolarHBondContact O-CG2 3.45Å; L234-T238 PolarHBondContact O-N 3.35Å; L234-T238 VanDerWaalsContact O-N 3.08Å; L234-T238 PolarHBondContact O-OG1 3.35Å; T235-T238 PolarHBondContact O-OG1 3.21Å; L236-T238 VanDerWaalsContact C-N 3.3Å; L236-T238 PolarHBondContact O-N 3.34Å; T238-A242 PolarHBondContact O-N 3.18Å
239S88Confident75.1Confident51 Ų5182.6 Ų82.636%0.35747%0.466SS..Hα-helixtrans-69.6-43169.952.30000112.1T235 L236 N241 A242 E243T235-S239 PolarHBondContact O-N 3.24Å; T235-S239 VanDerWaalsContact O-N 3.14Å; T235-S239 PolarHBondContact O-OG 3.14Å; L236-S239 PolarHBondContact O-N 2.84Å; L236-S239 PolarHBondContact O-OG 2.86Å; S239-N241 VanDerWaalsContact C-N 3.31Å; S239-N241 PolarHBondContact O-N 3.34Å; S239-A242 PolarHBondContact O-N 3.39Å; S239-E243 PolarHBondContact O-N 3.12Å
240D79Confident72.1Confident50 Ų5089 Ų8927%0.26749%0.49SS..Hα-helixtrans-59.6-43.4179.9-62.3-18.3000111.3Y188 L236 A242 E243 D244Y188-D240 PolarHBondContact OH-OD2 3.19Å; L236-D240 PolarHBondContact O-N 3.49Å; L236-D240 VanDerWaalsContact O-N 3.1Å; D240-A242 VanDerWaalsContact C-N 3.28Å; D240-A242 PolarHBondContact O-N 3.05Å; D240-E243 PolarHBondContact O-N 3.39Å; D240-D244 PolarHBondContact O-N 2.87Å
241N72.2Confident69Low63 Ų6398 Ų9834%0.33753%0.532SS..Hα-helixtrans-66.8-26.6177.4-73.6-3.3000113.5W237 S239W237-N241 PolarHBondContact O-N 3.36Å; S239-N241 VanDerWaalsContact C-N 3.31Å; S239-N241 PolarHBondContact O-N 3.34Å
242A66.1Low66.3Low71 Ų7197.2 Ų97.259%0.58755%0.551SS**Hα-helixtrans-77.9-29.9178.200000112.1T238 S239 D240T238-A242 PolarHBondContact O-N 3.18Å; S239-A242 PolarHBondContact O-N 3.39Å; D240-A242 VanDerWaalsContact C-N 3.28Å; D240-A242 PolarHBondContact O-N 3.05Å
243E58.3Low63.6Low161 Ų16198.6 Ų98.675%0.75257%0.571SS**Hα-helixtrans-73.1-37176.2-67.9-173.5176.600112S239 D240 G245S239-E243 PolarHBondContact O-N 3.12Å; D240-E243 PolarHBondContact O-N 3.39Å; E243-G245 VanDerWaalsContact C-N 3.28Å; E243-G245 PolarHBondContact O-N 2.79Å
244D54Low61Low152 Ų152106.3 Ų106.381%0.81360%0.603SS**Hα-helixtrans-71.3-19.4175.6-83.7-15.8000113.7D240D240-D244 PolarHBondContact O-N 2.87Å
245G45.1Very low58.5Low53 Ų53111 Ų11155%0.54664%0.635SS.*THydrogen-bonded Turntrans-880.4179.300000115.5E243 D247E243-G245 VanDerWaalsContact C-N 3.28Å; E243-G245 PolarHBondContact O-N 2.79Å; G245-D247 PolarHBondContact O-N 2.98Å
246G38.9Very low55.8Low60 Ų60116.6 Ų116.662%0.61966%0.656SS**  trans-82.6-5.2-167.100000117.7
247D36.4Very low53.3Low165 Ų165115.2 Ų115.288%0.88266%0.664SS**  trans-101.333-175.5-93.8-17.6000114.2G245 I249G245-D247 PolarHBondContact O-N 2.98Å; D247-I249 VanDerWaalsContact C-N 3.3Å; D247-I249 PolarHBondContact O-N 3.31Å
248E39.4Very low50.6Low183 Ų183124.5 Ų124.586%0.85571%0.707SS**  trans-74.185.5164.5-73.7-164.2166.800111.4
249I35.9Very low48.1Very low145 Ų145124 Ų12474%0.74472%0.717SS**  trans49.3104.8141.4-54.8174.5000117.1D247 E251D247-I249 VanDerWaalsContact C-N 3.3Å; D247-I249 PolarHBondContact O-N 3.31Å; I249-E251 PolarHBondContact O-N 2.66Å
250K36.5Very low46Very low210 Ų210134.9 Ų134.991%0.91376%0.762SS**  trans-49.599.2156-64.8171.3178.9169.50112.1
251E33.7Very low44.3Very low189 Ų189139.1 Ų139.188%0.88379%0.786SS**  trans-119.970.1151.3-84-163.7155.400110I249I249-E251 PolarHBondContact O-N 2.66Å
252A40.9Very low42.9Very low100 Ų100143.1 Ų143.183%0.82681%0.81SS**  trans-96.2101.2154.200000107
253A40.5Very low41.6Very low97 Ų97147.1 Ų147.180%0.80282%0.822SS**  trans-44.9133.9177.600000112.2
254K43Very low40.6Very low197 Ų197146.3 Ų146.386%0.85783%0.827SS**  trans-57.3133.3172.3-79.4177.8174177.30110.1E256K254-E256 PolarHBondContact O-N 3Å
255P43Very low39.8Very low126 Ų126145.9 Ų145.982%0.81883%0.827SS**  trans-75114.8165.629.7-28000108.4G257P255-G257 PolarHBondContact O-N 3.2Å
256E39.8Very low39.4Very low202 Ų202152.1 Ų152.194%0.94485%0.846SS**  trans-72.5110.6159.3-71.7-174.2158.800107.4K254K254-E256 PolarHBondContact O-N 3Å
257G41.9Very low39.4Very low62 Ų62158.7 Ų158.764%0.63986%0.862SS**  trans-166.593.9-176.700000113.3P255P255-G257 PolarHBondContact O-N 3.2Å
258E38.4Very low39.7Very low201 Ų201158.2 Ų158.294%0.93986%0.861SS**  trans73122.5138.7-59.2-176.516500121.3
259G38.9Very low39.7Very low66 Ų66156.2 Ų156.268%0.6886%0.861SS**  106.595115.300000117.5
260H43.8Very low40Very low279 Ų279157.2 Ų157.2100%1.29287%0.872SS**  -176.20110.4-93.5-57.6000111.7

Retrieved 260 of 260 residues in 517.4 ms (Link to these results)

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