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14-3-3-like protein GF14-12

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

AlphaFold DB , UniProt , Accession Q01526, Species MAIZE (Zea mays, Maize), Gene GRF2, Length 261 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
1M41.6Very low80.1Confident240 Ų240101.1 Ų101.1100%1.18257%0.572SS**  0121.10-64.3-179.2-168.300105.6S3M1-S3 PolarHBondContact O-N 3.42Å; M1-S3 VanDerWaalsContact O-N 3.12Å
2A50.5Low81.6Confident101 Ų10193.9 Ų93.984%0.83553%0.532SS*.PPolyproline II helixtrans-59.2119.1169.300000105.9A4A2-A4 PolarHBondContact O-N 3.41Å; A2-A4 VanDerWaalsContact O-N 3.16Å
3S58.8Low82.9Confident107 Ų10797.7 Ų97.775%0.74853%0.534SS*.PPolyproline II helixtrans-49126.6166.61760000106.2M1 E5M1-S3 PolarHBondContact O-N 3.42Å; M1-S3 VanDerWaalsContact O-N 3.12Å; S3-E5 PolarHBondContact O-N 3.24Å
4A74.9Confident84Confident82 Ų8295.3 Ų95.368%0.67852%0.519SS*.PPolyproline II helixtrans-51.3136.3170.100000107.6A2 L6A2-A4 PolarHBondContact O-N 3.41Å; A2-A4 VanDerWaalsContact O-N 3.16Å; A4-L6 PolarHBondContact O-N 2.89Å
5E85.7Confident85Confident171 Ų17188.9 Ų88.980%0.79948%0.484SS*.PPolyproline II helixtrans-64.3124.8174.9-166.2167.4-162.700107.4S3S3-E5 PolarHBondContact O-N 3.24Å
6L90.2Very high85.8Confident56 Ų5686.9 Ų86.929%0.29347%0.469SS..PPolyproline II helixtrans-62.8141.9179.5-64.1179.9000109.5A4 E10 N11 M14 F30A4-L6 PolarHBondContact O-N 2.89Å; L6-E10 HydrophobicContact CB-CB 3.86Å; L6-E10 HydrophobicContact CD2-CB 4.17Å; L6-E10 HydrophobicContact CG-CB 4.41Å; L6-N11 PolarHBondContact O-ND2 2.86Å; L6-M14 HydrophobicContact CD1-CG 3.75Å; L6-F30 HydrophobicContact CD1-CD1 4.42Å; L6-F30 HydrophobicContact CD1-CE1 4.09Å
7S94.1Very high86.6Confident55 Ų5585.5 Ų85.539%0.38546%0.461SS..PPolyproline II helixtrans-62.8168.9169.563.40000112E9 E10 N11S7-E9 PolarHBondContact O-N 3.48Å; S7-E10 VanDerWaalsContact CB-OE2 3.3Å; S7-E10 WeakPolarHBondContact CB-OE2 3.43Å; S7-E10 PolarHBondContact N-OE2 3.06Å; S7-E10 PolarHBondContact O-N 3.44Å; S7-E10 WeakPolarHBondContact OG-CB 3.36Å; S7-E10 VanDerWaalsContact OG-CD 3.26Å; S7-E10 WeakPolarHBondContact OG-CG 3.34Å; S7-E10 PolarHBondContact OG-N 2.69Å; S7-E10 PolarHBondContact OG-OE2 3.41Å; S7-N11 PolarHBondContact O-N 3.05Å; S7-N11 PolarHBondContact O-ND2 2.76Å
8R95.2Very high87.2Confident36 Ų3681.1 Ų81.114%0.13644%0.438CS..Hα-helixtrans-56.7-49.4176.7-174.9179.2178.7150.8-20.9111.4E10 N11 V12 V34 T37 E41 E42 E47R8-E10 VanDerWaalsContact C-N 3.34Å; R8-E10 PolarHBondContact O-N 3.09Å; R8-N11 PolarHBondContact O-N 2.78Å; R8-V12 WeakPolarHBondContact O-CG2 3.38Å; R8-V12 PolarHBondContact O-N 3.22Å; R8-V34 HydrophobicContact CG-CG1 4.05Å; R8-V34 HydrophobicContact CG-CG2 4.48Å; R8-T37 WeakPolarHBondContact CD-OG1 3.48Å; R8-T37 PolarHBondContact NH1-OG1 3.42Å; R8-T37 VanDerWaalsContact NH1-OG1 3.15Å; R8-E41 PolarHBondContact NH1-O 2.95Å; R8-E41 PolarHBondContact NH2-O 3.49Å; R8-E42 PolarHBondContact NH2-O 3.08Å; R8-E47 IonicContact CZ-OE1 3.9Å; R8-E47 IonicContact CZ-OE2 2.82Å; R8-E47 IonicContact NE-OE1 2.76Å; R8-E47 PolarHBondContact NE-OE1 3.28Å; R8-E47 IonicContact NE-OE2 3.47Å; R8-E47 IonicContact NH2-OE1 3.68Å; R8-E47 PolarHBondContact NH2-OE1 3.49Å; R8-E47 IonicContact NH2-OE2 2.79Å; R8-E47 PolarHBondContact NH2-OE2 2.93Å
9E95.6Very high87.8Confident164 Ų16480.5 Ų80.577%0.76643%0.432SS*.Hα-helixtrans-60.5-41.8178.6-64.9-179.1179.500112.1S7 V12 Y13S7-E9 PolarHBondContact O-N 3.48Å; E9-V12 PolarHBondContact O-N 3.49Å; E9-Y13 WeakPolarHBondContact O-CB 2.85Å; E9-Y13 PolarHBondContact O-N 3.44Å
10E97.1Very high88.3Confident95 Ų9584.4 Ų84.444%0.44445%0.447SS..Hα-helixtrans-66.6-40.2176.4-72.9167.6133.300112L6 S7 R8 Y13 M14L6-E10 HydrophobicContact CB-CB 3.86Å; L6-E10 HydrophobicContact CD2-CB 4.17Å; L6-E10 HydrophobicContact CG-CB 4.41Å; S7-E10 VanDerWaalsContact CB-OE2 3.3Å; S7-E10 WeakPolarHBondContact CB-OE2 3.43Å; S7-E10 PolarHBondContact N-OE2 3.06Å; S7-E10 PolarHBondContact O-N 3.44Å; S7-E10 WeakPolarHBondContact OG-CB 3.36Å; S7-E10 VanDerWaalsContact OG-CD 3.26Å; S7-E10 WeakPolarHBondContact OG-CG 3.34Å; S7-E10 PolarHBondContact OG-N 2.69Å; S7-E10 PolarHBondContact OG-OE2 3.41Å; R8-E10 VanDerWaalsContact C-N 3.34Å; R8-E10 PolarHBondContact O-N 3.09Å; E10-Y13 PolarHBondContact O-N 2.89Å; E10-M14 WeakPolarHBondContact O-CB 3.5Å; E10-M14 VanDerWaalsContact O-CG 3.24Å; E10-M14 WeakPolarHBondContact O-CG 3.4Å; E10-M14 PolarHBondContact O-N 2.83Å
11N97.8Very high88.7Confident5 Ų583.2 Ų83.23%0.02745%0.45CS..Hα-helixtrans-65.2-40.8174.8-74.7-69.7000111.6L6 S7 R8 Y13 M14 A15 F30 K33 V34L6-N11 PolarHBondContact O-ND2 2.86Å; S7-N11 PolarHBondContact O-N 3.05Å; S7-N11 PolarHBondContact O-ND2 2.76Å; R8-N11 PolarHBondContact O-N 2.78Å; N11-Y13 VanDerWaalsContact C-N 3.34Å; N11-Y13 PolarHBondContact O-N 3.36Å; N11-M14 PolarHBondContact O-N 2.91Å; N11-A15 WeakPolarHBondContact O-CB 3.44Å; N11-A15 PolarHBondContact O-N 3.38Å; N11-F30 HydrophobicContact CB-CB 4.44Å; N11-F30 WeakPolarHBondContact O-CB 3.39Å; N11-K33 WeakPolarHBondContact OD1-CD 3.42Å; N11-V34 HydrophobicContact CB-CG2 3.55Å
12V98.1Very high91.4Very high15 Ų1578.6 Ų78.69%0.09143%0.425CS..Hα-helixtrans-61.5-43.8174.4171.80000110.7R8 E9 A15 K16 V34 E47 L50R8-V12 WeakPolarHBondContact O-CG2 3.38Å; R8-V12 PolarHBondContact O-N 3.22Å; E9-V12 PolarHBondContact O-N 3.49Å; V12-A15 PolarHBondContact O-N 2.97Å; V12-K16 WeakPolarHBondContact O-CG 3.32Å; V12-K16 PolarHBondContact O-N 2.79Å; V12-V34 HydrophobicContact CG2-CG1 4.04Å; V12-V34 HydrophobicContact CG2-CG2 3.71Å; V12-E47 HydrophobicContact CG2-CG 3.86Å; V12-L50 HydrophobicContact CG1-CD1 4.03Å
13Y98.2Very high93.7Very high143 Ų14380.2 Ų80.256%0.56141%0.41SS*.Hα-helixtrans-61.2-45.9175.8178.7-111.7000112E9 E10 N11 A15 K16 L17E9-Y13 WeakPolarHBondContact O-CB 2.85Å; E9-Y13 PolarHBondContact O-N 3.44Å; E10-Y13 PolarHBondContact O-N 2.89Å; N11-Y13 VanDerWaalsContact C-N 3.34Å; N11-Y13 PolarHBondContact O-N 3.36Å; Y13-A15 VanDerWaalsContact C-N 3.32Å; Y13-A15 PolarHBondContact O-N 2.89Å; Y13-K16 PolarHBondContact O-N 2.76Å; Y13-L17 HydrophobicContact CD1-CD1 4.1Å; Y13-L17 HydrophobicContact CE1-CD1 3.55Å; Y13-L17 HydrophobicContact CE1-CG 4.17Å; Y13-L17 HydrophobicContact CE2-CD2 4.46Å; Y13-L17 HydrophobicContact CE2-CG 4.44Å; Y13-L17 PolarHBondContact O-N 3.19Å
14M98.4Very high95.6Very high64 Ų6477.4 Ų77.432%0.31538%0.383SS..Hα-helixtrans-64.1-36176.7-70.5-57.3-62.100112.4L6 E10 N11 L17 A18 F30L6-M14 HydrophobicContact CD1-CG 3.75Å; E10-M14 WeakPolarHBondContact O-CB 3.5Å; E10-M14 VanDerWaalsContact O-CG 3.24Å; E10-M14 WeakPolarHBondContact O-CG 3.4Å; E10-M14 PolarHBondContact O-N 2.83Å; N11-M14 PolarHBondContact O-N 2.91Å; M14-L17 PolarHBondContact O-N 3.37Å; M14-L17 HydrophobicContact SD-CD1 4Å; M14-A18 WeakPolarHBondContact O-CB 3.42Å; M14-A18 PolarHBondContact O-N 3.19Å; M14-F30 HydrophobicContact CB-CD1 3.65Å; M14-F30 HydrophobicContact CB-CD2 3.74Å; M14-F30 HydrophobicContact CB-CE1 3.62Å; M14-F30 HydrophobicContact CB-CE2 3.72Å; M14-F30 HydrophobicContact CB-CG 3.74Å; M14-F30 HydrophobicContact CB-CZ 3.68Å; M14-F30 HydrophobicContact CE-CE1 4.36Å; M14-F30 HydrophobicContact CE-CE2 4.21Å; M14-F30 HydrophobicContact CE-CZ 3.71Å; M14-F30 HydrophobicContact CG-CD1 4.4Å; M14-F30 HydrophobicContact CG-CE1 4.04Å; M14-F30 HydrophobicContact CG-CZ 4.21Å
15A98.5Very high96.7Very high0 Ų077.7 Ų77.70%037%0.371CS..Hα-helixtrans-62.9-41.6173.300000111.8N11 V12 Y13 A18 E19 M27 F30 M31N11-A15 WeakPolarHBondContact O-CB 3.44Å; N11-A15 PolarHBondContact O-N 3.38Å; V12-A15 PolarHBondContact O-N 2.97Å; Y13-A15 VanDerWaalsContact C-N 3.32Å; Y13-A15 PolarHBondContact O-N 2.89Å; A15-A18 PolarHBondContact O-N 3.09Å; A15-E19 WeakPolarHBondContact O-CB 3.35Å; A15-E19 PolarHBondContact O-N 3.11Å; A15-M27 HydrophobicContact CB-CG 4.1Å; A15-F30 HydrophobicContact CB-CB 4.01Å; A15-M31 HydrophobicContact CB-CG 3.77Å; A15-M31 HydrophobicContact CB-SD 3.53Å; A15-M31 VanDerWaalsContact CB-SD 3.53Å
16K98.5Very high97.2Very high56 Ų5672.6 Ų72.624%0.24335%0.346CS..Hα-helixtrans-64.9-37.4174.8-67.7178.7-172.7-172.50112.2V12 Y13 Q20 E46 L50V12-K16 WeakPolarHBondContact O-CG 3.32Å; V12-K16 PolarHBondContact O-N 2.79Å; Y13-K16 PolarHBondContact O-N 2.76Å; K16-Q20 WeakPolarHBondContact O-CG 3.24Å; K16-Q20 PolarHBondContact O-N 3.33Å; K16-Q20 VanDerWaalsContact O-N 3.13Å; K16-E46 VanDerWaalsContact CE-OE1 3.25Å; K16-E46 WeakPolarHBondContact CE-OE1 3.35Å; K16-E46 IonicContact NZ-OE1 2.71Å; K16-E46 PolarHBondContact NZ-OE1 3.17Å; K16-E46 IonicContact NZ-OE2 2.71Å; K16-E46 PolarHBondContact NZ-OE2 3.18Å; K16-L50 HydrophobicContact CG-CD1 4.08Å; K16-L50 HydrophobicContact CG-CD2 4.17Å
17L98.5Very high97.6Very high64 Ų6469.9 Ų69.934%0.33533%0.333SS..Hα-helixtrans-66.4-42.7173.1-68.5-178.6000111.7Y13 M14 E19 Q20 A21Y13-L17 HydrophobicContact CD1-CD1 4.1Å; Y13-L17 HydrophobicContact CE1-CD1 3.55Å; Y13-L17 HydrophobicContact CE1-CG 4.17Å; Y13-L17 HydrophobicContact CE2-CD2 4.46Å; Y13-L17 HydrophobicContact CE2-CG 4.44Å; Y13-L17 PolarHBondContact O-N 3.19Å; M14-L17 PolarHBondContact O-N 3.37Å; M14-L17 HydrophobicContact SD-CD1 4Å; L17-E19 VanDerWaalsContact C-N 3.34Å; L17-Q20 PolarHBondContact O-N 2.63Å; L17-A21 WeakPolarHBondContact O-CB 3.27Å; L17-A21 PolarHBondContact O-N 2.98Å
18A98.3Very high97.8Very high5 Ų567.9 Ų67.94%0.04132%0.318CS..Hα-helixtrans-63.9-39.3177.200000111.7M14 A15 A21 E22 R23 E26 M27 F30M14-A18 WeakPolarHBondContact O-CB 3.42Å; M14-A18 PolarHBondContact O-N 3.19Å; A15-A18 PolarHBondContact O-N 3.09Å; A18-A21 CarbonylContact O-C 3.54Å; A18-A21 PolarHBondContact O-N 3.41Å; A18-E22 PolarHBondContact O-N 3.4Å; A18-R23 HydrophobicContact CB-CB 4.46Å; A18-R23 PolarHBondContact O-N 2.96Å; A18-E26 HydrophobicContact CB-CB 4.32Å; A18-M27 HydrophobicContact CB-CB 3.9Å; A18-M27 HydrophobicContact CB-CG 4.48Å; A18-F30 HydrophobicContact CB-CD2 4.36Å; A18-F30 HydrophobicContact CB-CE2 4.39Å
19E98.2Very high98Very high70 Ų7071.6 Ų71.633%0.32734%0.337SS..Hα-helixtrans-59.1-50.7173-175.7-178.1-161.400111.6A15 L17 A21 E22 M27 L50A15-E19 WeakPolarHBondContact O-CB 3.35Å; A15-E19 PolarHBondContact O-N 3.11Å; L17-E19 VanDerWaalsContact C-N 3.34Å; E19-A21 PolarHBondContact O-N 3.48Å; E19-E22 PolarHBondContact O-N 2.88Å; E19-M27 HydrophobicContact CB-CE 3.86Å; E19-M27 HydrophobicContact CB-SD 3.87Å; E19-M27 HydrophobicContact CG-CE 4.14Å; E19-M27 HydrophobicContact CG-SD 4.31Å; E19-L50 WeakPolarHBondContact OE2-CD2 3.34Å
20Q97.8Very high98.1Very high159 Ų15964.8 Ų64.874%0.74331%0.305SS*.Hα-helixtrans-62.8-27178.4-72175.644.300113.2K16 L17K16-Q20 WeakPolarHBondContact O-CG 3.24Å; K16-Q20 PolarHBondContact O-N 3.33Å; K16-Q20 VanDerWaalsContact O-N 3.13Å; L17-Q20 PolarHBondContact O-N 2.63Å
21A97.9Very high98.1Very high60 Ų6060.2 Ų60.250%0.49628%0.283SS..THydrogen-bonded Turntrans-91.22.9176.100000113.4L17 A18 E19 R23L17-A21 WeakPolarHBondContact O-CB 3.27Å; L17-A21 PolarHBondContact O-N 2.98Å; A18-A21 CarbonylContact O-C 3.54Å; A18-A21 PolarHBondContact O-N 3.41Å; E19-A21 PolarHBondContact O-N 3.48Å; A21-R23 HydrophobicContact CB-CG 3.94Å; A21-R23 WeakPolarHBondContact O-CG 3.41Å; A21-R23 PolarHBondContact O-N 3.49Å; A21-R23 VanDerWaalsContact O-N 3.16Å
22E97.7Very high98.1Very high143 Ų14362.4 Ų62.467%0.66829%0.293SS*.THydrogen-bonded Turntrans53.728.3-174-57.6-175.1-173.500113.9A18 E19 Y24A18-E22 PolarHBondContact O-N 3.4Å; E19-E22 PolarHBondContact O-N 2.88Å; E22-Y24 HydrophobicContact CB-CE2 3.88Å; E22-Y24 HydrophobicContact CG-CE2 4.42Å; E22-Y24 WeakPolarHBondContact O-CD2 3.42Å; E22-Y24 PolarHBondContact O-N 3.28Å
23R98.2Very high98Very high134 Ų13465.4 Ų65.451%0.50631%0.305SS..  trans-93.364.8178.1-59.9-174.172.187.14.2110.2A18 A21 E25 E26 M27A18-R23 HydrophobicContact CB-CB 4.46Å; A18-R23 PolarHBondContact O-N 2.96Å; A21-R23 HydrophobicContact CB-CG 3.94Å; A21-R23 WeakPolarHBondContact O-CG 3.41Å; A21-R23 PolarHBondContact O-N 3.49Å; A21-R23 VanDerWaalsContact O-N 3.16Å; R23-E25 VanDerWaalsContact C-N 3.29Å; R23-E25 PolarHBondContact O-N 3.12Å; R23-E26 HydrophobicContact CB-CB 4.38Å; R23-E26 IonicContact CZ-OE1 3.85Å; R23-E26 VanDerWaalsContact NE-CD 3.31Å; R23-E26 IonicContact NE-OE1 2.74Å; R23-E26 PolarHBondContact NE-OE1 3.33Å; R23-E26 IonicContact NE-OE2 3.34Å; R23-E26 PolarHBondContact NE-OE2 2.97Å; R23-E26 IonicContact NH2-OE1 2.65Å; R23-E26 PolarHBondContact NH2-OE1 3.46Å; R23-E26 PolarHBondContact O-N 3.16Å; R23-E26 VanDerWaalsContact O-N 3.13Å; R23-M27 PolarHBondContact O-N 3.22Å
24Y98.2Very high98Very high48 Ų4858.6 Ų58.619%0.18828%0.278CS..Hα-helixtrans-65.8-26.7-169.8-56.6-71.7000114.4E22 M27 V28 N57 V58E22-Y24 HydrophobicContact CB-CE2 3.88Å; E22-Y24 HydrophobicContact CG-CE2 4.42Å; E22-Y24 WeakPolarHBondContact O-CD2 3.42Å; E22-Y24 PolarHBondContact O-N 3.28Å; Y24-M27 HydrophobicContact CD1-SD 4.06Å; Y24-M27 WeakPolarHBondContact O-CB 3.49Å; Y24-M27 PolarHBondContact O-N 3.16Å; Y24-V28 WeakPolarHBondContact O-CG2 3.25Å; Y24-V28 PolarHBondContact O-N 2.75Å; Y24-N57 HydrophobicContact CD1-CB 3.56Å; Y24-N57 HydrophobicContact CD2-CB 3.52Å; Y24-N57 HydrophobicContact CE1-CB 3.88Å; Y24-N57 WeakPolarHBondContact CE1-ND2 3.39Å; Y24-N57 HydrophobicContact CE2-CB 3.83Å; Y24-N57 HydrophobicContact CG-CB 3.36Å; Y24-N57 VanDerWaalsContact CZ-CG 3.5Å; Y24-V58 VanDerWaalsContact C-CG2 3.48Å; Y24-V58 WeakPolarHBondContact O-CG2 3.37Å
25E97.8Very high97.9Very high89 Ų8955.5 Ų55.542%0.41626%0.263SS..Hα-helixtrans-62-45172.5-68.179.5-178.400111.3R23 M27 V28 E29 V58 R62R23-E25 VanDerWaalsContact C-N 3.29Å; R23-E25 PolarHBondContact O-N 3.12Å; E25-M27 VanDerWaalsContact C-N 3.35Å; E25-V28 WeakPolarHBondContact O-CB 3.11Å; E25-V28 PolarHBondContact O-N 3.24Å; E25-E29 PolarHBondContact O-N 3.41Å; E25-E29 VanDerWaalsContact O-N 3.15Å; E25-V58 HydrophobicContact CG-CG2 4.37Å; E25-R62 IonicContact OE1-CZ 3.7Å; E25-R62 IonicContact OE1-NH1 2.73Å; E25-R62 PolarHBondContact OE1-NH1 3.08Å; E25-R62 IonicContact OE1-NH2 2.9Å; E25-R62 PolarHBondContact OE1-NH2 2.95Å
26E97.9Very high97.7Very high63 Ų6360.4 Ų60.429%0.29428%0.284SS..Hα-helixtrans-68.5-37.4174.7-76.1168-132.100111.3A18 R23 V28 E29 F30A18-E26 HydrophobicContact CB-CB 4.32Å; R23-E26 HydrophobicContact CB-CB 4.38Å; R23-E26 IonicContact CZ-OE1 3.85Å; R23-E26 VanDerWaalsContact NE-CD 3.31Å; R23-E26 IonicContact NE-OE1 2.74Å; R23-E26 PolarHBondContact NE-OE1 3.33Å; R23-E26 IonicContact NE-OE2 3.34Å; R23-E26 PolarHBondContact NE-OE2 2.97Å; R23-E26 IonicContact NH2-OE1 2.65Å; R23-E26 PolarHBondContact NH2-OE1 3.46Å; R23-E26 PolarHBondContact O-N 3.16Å; R23-E26 VanDerWaalsContact O-N 3.13Å; E26-V28 VanDerWaalsContact C-N 3.26Å; E26-V28 PolarHBondContact O-N 3.41Å; E26-E29 WeakPolarHBondContact O-CB 3.27Å; E26-E29 PolarHBondContact O-N 3.46Å; E26-E29 VanDerWaalsContact O-N 3.08Å; E26-F30 HydrophobicContact CB-CD2 4.5Å; E26-F30 HydrophobicContact CB-CE2 4.03Å; E26-F30 WeakPolarHBondContact O-CD2 3.48Å; E26-F30 PolarHBondContact O-N 2.89Å
27M98.2Very high97.4Very high0 Ų060 Ų600%029%0.287CS..Hα-helixtrans-56.8-41.6173.3-164.9-171.8-179.500111.5A15 A18 E19 R23 Y24 E25 F30 M31 L50 V53 A54A15-M27 HydrophobicContact CB-CG 4.1Å; A18-M27 HydrophobicContact CB-CB 3.9Å; A18-M27 HydrophobicContact CB-CG 4.48Å; E19-M27 HydrophobicContact CB-CE 3.86Å; E19-M27 HydrophobicContact CB-SD 3.87Å; E19-M27 HydrophobicContact CG-CE 4.14Å; E19-M27 HydrophobicContact CG-SD 4.31Å; R23-M27 PolarHBondContact O-N 3.22Å; Y24-M27 HydrophobicContact CD1-SD 4.06Å; Y24-M27 WeakPolarHBondContact O-CB 3.49Å; Y24-M27 PolarHBondContact O-N 3.16Å; E25-M27 VanDerWaalsContact C-N 3.35Å; M27-F30 PolarHBondContact O-N 3.24Å; M27-M31 WeakPolarHBondContact O-CB 3.43Å; M27-M31 WeakPolarHBondContact O-CG 3.45Å; M27-M31 PolarHBondContact O-N 3.04Å; M27-L50 HydrophobicContact CE-CB 3.99Å; M27-L50 HydrophobicContact CE-CD2 3.56Å; M27-L50 HydrophobicContact CE-CG 4.4Å; M27-L50 VanDerWaalsContact CE-O 3.27Å; M27-L50 WeakPolarHBondContact CE-O 3.11Å; M27-V53 HydrophobicContact CE-CB 4.23Å; M27-V53 HydrophobicContact CE-CG1 4.12Å; M27-V53 HydrophobicContact SD-CG1 4.32Å; M27-A54 HydrophobicContact CB-CB 3.94Å; M27-A54 HydrophobicContact CE-CB 4.23Å; M27-A54 HydrophobicContact CG-CB 3.61Å; M27-A54 HydrophobicContact SD-CB 3.59Å; M27-A54 VanDerWaalsContact SD-CB 3.59Å
28V98.4Very high97Very high13 Ų1357.3 Ų57.38%0.07927%0.273CS..Hα-helixtrans-61.8-46.1173.2166.80000110.9Y24 E25 E26 F30 M31 E32 A54 Y55 V58Y24-V28 WeakPolarHBondContact O-CG2 3.25Å; Y24-V28 PolarHBondContact O-N 2.75Å; E25-V28 WeakPolarHBondContact O-CB 3.11Å; E25-V28 PolarHBondContact O-N 3.24Å; E26-V28 VanDerWaalsContact C-N 3.26Å; E26-V28 PolarHBondContact O-N 3.41Å; V28-F30 VanDerWaalsContact C-N 3.32Å; V28-F30 PolarHBondContact O-N 3.26Å; V28-M31 PolarHBondContact O-N 3.24Å; V28-E32 HydrophobicContact CG1-CG 4.16Å; V28-E32 WeakPolarHBondContact O-CB 3.39Å; V28-E32 WeakPolarHBondContact O-CG 3.48Å; V28-E32 PolarHBondContact O-N 2.63Å; V28-A54 HydrophobicContact CG2-CB 3.72Å; V28-Y55 HydrophobicContact CG1-CD1 4.36Å; V28-Y55 HydrophobicContact CG1-CD2 4.42Å; V28-Y55 HydrophobicContact CG1-CE1 3.74Å; V28-Y55 HydrophobicContact CG1-CE2 3.81Å; V28-Y55 VanDerWaalsContact CG1-CZ 3.47Å; V28-Y55 HydrophobicContact CG2-CD1 4.09Å; V28-Y55 HydrophobicContact CG2-CD2 3.98Å; V28-Y55 HydrophobicContact CG2-CE1 4.3Å; V28-Y55 HydrophobicContact CG2-CE2 4.2Å; V28-Y55 HydrophobicContact CG2-CG 3.93Å; V28-V58 HydrophobicContact CG2-CB 4.41Å; V28-V58 HydrophobicContact CG2-CG2 3.85Å
29E98Very high96.2Very high113 Ų11363.6 Ų63.653%0.52831%0.306SS..Hα-helixtrans-59-40.7179.1-68.1179.7-167.900113E25 E26 K33E25-E29 PolarHBondContact O-N 3.41Å; E25-E29 VanDerWaalsContact O-N 3.15Å; E26-E29 WeakPolarHBondContact O-CB 3.27Å; E26-E29 PolarHBondContact O-N 3.46Å; E26-E29 VanDerWaalsContact O-N 3.08Å; E29-K33 WeakPolarHBondContact O-CG 3.48Å
30F98.2Very high95.5Very high21 Ų2165.7 Ų65.79%0.09233%0.329CS..Hα-helixtrans-70.1-45.9175.9-63.9-57.1000111.8L6 N11 M14 A15 A18 E26 M27 V28 E32 K33 V34L6-F30 HydrophobicContact CD1-CD1 4.42Å; L6-F30 HydrophobicContact CD1-CE1 4.09Å; N11-F30 HydrophobicContact CB-CB 4.44Å; N11-F30 WeakPolarHBondContact O-CB 3.39Å; M14-F30 HydrophobicContact CB-CD1 3.65Å; M14-F30 HydrophobicContact CB-CD2 3.74Å; M14-F30 HydrophobicContact CB-CE1 3.62Å; M14-F30 HydrophobicContact CB-CE2 3.72Å; M14-F30 HydrophobicContact CB-CG 3.74Å; M14-F30 HydrophobicContact CB-CZ 3.68Å; M14-F30 HydrophobicContact CE-CE1 4.36Å; M14-F30 HydrophobicContact CE-CE2 4.21Å; M14-F30 HydrophobicContact CE-CZ 3.71Å; M14-F30 HydrophobicContact CG-CD1 4.4Å; M14-F30 HydrophobicContact CG-CE1 4.04Å; M14-F30 HydrophobicContact CG-CZ 4.21Å; A15-F30 HydrophobicContact CB-CB 4.01Å; A18-F30 HydrophobicContact CB-CD2 4.36Å; A18-F30 HydrophobicContact CB-CE2 4.39Å; E26-F30 HydrophobicContact CB-CD2 4.5Å; E26-F30 HydrophobicContact CB-CE2 4.03Å; E26-F30 WeakPolarHBondContact O-CD2 3.48Å; E26-F30 PolarHBondContact O-N 2.89Å; M27-F30 PolarHBondContact O-N 3.24Å; V28-F30 VanDerWaalsContact C-N 3.32Å; V28-F30 PolarHBondContact O-N 3.26Å; F30-E32 PolarHBondContact O-N 2.99Å; F30-K33 WeakPolarHBondContact O-CB 3.46Å; F30-K33 PolarHBondContact O-N 3.38Å; F30-K33 VanDerWaalsContact O-N 3.14Å; F30-V34 PolarHBondContact O-N 3.45Å
31M98.1Very high95.1Very high0 Ų063.6 Ų63.60%032%0.319CS..Hα-helixtrans-71.3-28.2-177.5-69.4-52.8-53.300113.4A15 M27 V28 K33 V34 A35 E47 L50 L51A15-M31 HydrophobicContact CB-CG 3.77Å; A15-M31 HydrophobicContact CB-SD 3.53Å; A15-M31 VanDerWaalsContact CB-SD 3.53Å; M27-M31 WeakPolarHBondContact O-CB 3.43Å; M27-M31 WeakPolarHBondContact O-CG 3.45Å; M27-M31 PolarHBondContact O-N 3.04Å; V28-M31 PolarHBondContact O-N 3.24Å; M31-K33 VanDerWaalsContact C-N 3.29Å; M31-K33 PolarHBondContact O-N 3.25Å; M31-V34 HydrophobicContact CE-CB 4.12Å; M31-V34 HydrophobicContact CE-CG1 4.08Å; M31-V34 HydrophobicContact CE-CG2 4.46Å; M31-V34 PolarHBondContact O-N 2.97Å; M31-V34 HydrophobicContact SD-CG2 4.31Å; M31-A35 VanDerWaalsContact O-CB 3.31Å; M31-A35 WeakPolarHBondContact O-CB 3.43Å; M31-A35 PolarHBondContact O-N 2.97Å; M31-E47 HydrophobicContact CE-CB 4.2Å; M31-E47 WeakPolarHBondContact CE-O 3.31Å; M31-L50 HydrophobicContact CE-CB 3.95Å; M31-L50 HydrophobicContact CG-CB 4.31Å; M31-L50 HydrophobicContact SD-CB 3.83Å; M31-L50 HydrophobicContact SD-CD1 4.35Å; M31-L51 HydrophobicContact CB-CB 4.34Å; M31-L51 HydrophobicContact CB-CD1 3.68Å; M31-L51 HydrophobicContact CE-CB 4.08Å
32E97.5Very high94.9Very high51 Ų5162.9 Ų62.924%0.23831%0.305CS..Hα-helixtrans-62.6-36.6169.6-82.2-168.5-167.100112V28 F30 K36 Y55 L109V28-E32 HydrophobicContact CG1-CG 4.16Å; V28-E32 WeakPolarHBondContact O-CB 3.39Å; V28-E32 WeakPolarHBondContact O-CG 3.48Å; V28-E32 PolarHBondContact O-N 2.63Å; F30-E32 PolarHBondContact O-N 2.99Å; E32-K36 WeakPolarHBondContact O-CD 3.25Å; E32-K36 WeakPolarHBondContact O-CG 3.5Å; E32-K36 PolarHBondContact O-N 3.03Å; E32-K36 VanDerWaalsContact O-N 3.14Å; E32-K36 IonicContact OE2-NZ 2.87Å; E32-K36 PolarHBondContact OE2-NZ 2.85Å; E32-Y55 VanDerWaalsContact CD-OH 3.3Å; E32-Y55 HydrophobicContact CG-CE2 4.42Å; E32-Y55 WeakPolarHBondContact CG-OH 3.43Å; E32-Y55 PolarHBondContact OE1-OH 2.99Å; E32-L109 HydrophobicContact CG-CD2 4.41Å
33K96.3Very high94.8Very high77 Ų7756.5 Ų56.534%0.33528%0.275SS..Hα-helixtrans-67.2-44.7175.7-66.4164.8-175.2167.10110.3N11 E29 F30 M31 A35 K36 T37N11-K33 WeakPolarHBondContact OD1-CD 3.42Å; E29-K33 WeakPolarHBondContact O-CG 3.48Å; F30-K33 WeakPolarHBondContact O-CB 3.46Å; F30-K33 PolarHBondContact O-N 3.38Å; F30-K33 VanDerWaalsContact O-N 3.14Å; M31-K33 VanDerWaalsContact C-N 3.29Å; M31-K33 PolarHBondContact O-N 3.25Å; K33-A35 PolarHBondContact O-N 3.38Å; K33-K36 PolarHBondContact O-N 3.5Å; K33-T37 WeakPolarHBondContact O-CG2 3.21Å
34V96.9Very high94.7Very high0 Ų053.2 Ų53.20%027%0.27CS..Hα-helixtrans-58.1-49.3175.4176.60000110.8R8 N11 V12 F30 M31 K36 T37 L43 E47R8-V34 HydrophobicContact CG-CG1 4.05Å; R8-V34 HydrophobicContact CG-CG2 4.48Å; N11-V34 HydrophobicContact CB-CG2 3.55Å; V12-V34 HydrophobicContact CG2-CG1 4.04Å; V12-V34 HydrophobicContact CG2-CG2 3.71Å; F30-V34 PolarHBondContact O-N 3.45Å; M31-V34 HydrophobicContact CE-CB 4.12Å; M31-V34 HydrophobicContact CE-CG1 4.08Å; M31-V34 HydrophobicContact CE-CG2 4.46Å; M31-V34 PolarHBondContact O-N 2.97Å; M31-V34 HydrophobicContact SD-CG2 4.31Å; V34-K36 PolarHBondContact O-N 3.26Å; V34-T37 WeakPolarHBondContact O-CB 3.46Å; V34-T37 PolarHBondContact O-N 2.94Å; V34-T37 PolarHBondContact O-OG1 3.44Å; V34-L43 HydrophobicContact CG1-CD2 3.7Å; V34-E47 HydrophobicContact CG1-CG 4.32Å
35A96.3Very high94.4Very high0 Ų054.9 Ų54.90%029%0.286CS..Hα-helixtrans-64.6-22.5179.900000114.4M31 K33 T37 V38 L43 L109 L114M31-A35 VanDerWaalsContact O-CB 3.31Å; M31-A35 WeakPolarHBondContact O-CB 3.43Å; M31-A35 PolarHBondContact O-N 2.97Å; K33-A35 PolarHBondContact O-N 3.38Å; A35-T37 VanDerWaalsContact C-N 3.27Å; A35-V38 WeakPolarHBondContact O-CG1 3.28Å; A35-V38 WeakPolarHBondContact O-CG2 3.31Å; A35-L43 HydrophobicContact CB-CD1 4.43Å; A35-L109 HydrophobicContact CB-CD1 3.67Å; A35-L109 HydrophobicContact CB-CD2 3.53Å; A35-L109 HydrophobicContact CB-CG 3.83Å; A35-L114 HydrophobicContact CB-CD2 3.97Å
36K94.9Very high94.3Very high102 Ų10255.7 Ų55.744%0.44329%0.289SS..THydrogen-bonded Turntrans-79.3-7.6172.6-72.7163.5-171.6158.60113.2E32 K33 V34 L109E32-K36 WeakPolarHBondContact O-CD 3.25Å; E32-K36 WeakPolarHBondContact O-CG 3.5Å; E32-K36 PolarHBondContact O-N 3.03Å; E32-K36 VanDerWaalsContact O-N 3.14Å; E32-K36 IonicContact OE2-NZ 2.87Å; E32-K36 PolarHBondContact OE2-NZ 2.85Å; K33-K36 PolarHBondContact O-N 3.5Å; V34-K36 PolarHBondContact O-N 3.26Å; K36-L109 HydrophobicContact CG-CD1 4.09Å
37T92.6Very high94.3Very high48 Ų4853.4 Ų53.429%0.29428%0.279SS..THydrogen-bonded Turntrans-93.74.8176.769.80000113.8R8 K33 V34 A35 D39 S40R8-T37 WeakPolarHBondContact CD-OG1 3.48Å; R8-T37 PolarHBondContact NH1-OG1 3.42Å; R8-T37 VanDerWaalsContact NH1-OG1 3.15Å; K33-T37 WeakPolarHBondContact O-CG2 3.21Å; V34-T37 WeakPolarHBondContact O-CB 3.46Å; V34-T37 PolarHBondContact O-N 2.94Å; V34-T37 PolarHBondContact O-OG1 3.44Å; A35-T37 VanDerWaalsContact C-N 3.27Å; T37-D39 PolarHBondContact O-N 2.91Å; T37-D39 VanDerWaalsContact O-N 3.16Å; T37-S40 WeakPolarHBondContact O-CB 3.06Å; T37-S40 PolarHBondContact O-N 3.39Å
38V88.7Confident94.2Very high7 Ų753.9 Ų53.94%0.04228%0.28CS..THydrogen-bonded Turntrans-66.1-18.7-172.7-63.80000115.2A35 S40 E41 L43 H113 L114A35-V38 WeakPolarHBondContact O-CG1 3.28Å; A35-V38 WeakPolarHBondContact O-CG2 3.31Å; V38-S40 PolarHBondContact O-N 2.82Å; V38-E41 VanDerWaalsContact CA-O 3.28Å; V38-E41 WeakPolarHBondContact CA-O 3.01Å; V38-E41 CarbonylContact O-C 3.49Å; V38-E41 PolarHBondContact O-N 2.79Å; V38-L43 HydrophobicContact CG1-CD2 3.73Å; V38-L43 HydrophobicContact CG1-CG 3.77Å; V38-H113 HydrophobicContact CG2-CB 3.67Å; V38-L114 HydrophobicContact CG1-CD2 4.11Å
39D82.8Confident94.1Very high137 Ų13756.7 Ų56.773%0.73330%0.295SS*.THydrogen-bonded Turntrans-61.8-23.3171.4-65-28.3000112.1T37T37-D39 PolarHBondContact O-N 2.91Å; T37-D39 VanDerWaalsContact O-N 3.16Å
40S83.7Confident94.1Very high115 Ų11551.8 Ų51.880%0.80427%0.272SS*.THydrogen-bonded Turntrans-89-40.4173.4-53.40000112.3T37 V38T37-S40 WeakPolarHBondContact O-CB 3.06Å; T37-S40 PolarHBondContact O-N 3.39Å; V38-S40 PolarHBondContact O-N 2.82Å
41E88.6Confident94.2Very high114 Ų11450.8 Ų50.853%0.53327%0.268SS..SBendtrans-159.2126.3-172.4178.7174.8-157.700110.9R8 V38R8-E41 PolarHBondContact NH1-O 2.95Å; R8-E41 PolarHBondContact NH2-O 3.49Å; V38-E41 VanDerWaalsContact CA-O 3.28Å; V38-E41 WeakPolarHBondContact CA-O 3.01Å; V38-E41 CarbonylContact O-C 3.49Å; V38-E41 PolarHBondContact O-N 2.79Å
42E93.9Very high94.1Very high46 Ų4652.3 Ų52.322%0.21528%0.278CS..PPolyproline II helixtrans-55.5150.2176.1-167175.8157.600110.8R8 T44 T119 S123R8-E42 PolarHBondContact NH2-O 3.08Å; E42-T44 PolarHBondContact O-N 2.98Å; E42-T119 PolarHBondContact OE2-N 3.45Å; E42-T119 VanDerWaalsContact OE2-N 3.09Å; E42-T119 PolarHBondContact OE2-OG1 3.35Å; E42-S123 VanDerWaalsContact OE1-CB 3.31Å; E42-S123 WeakPolarHBondContact OE1-CB 2.97Å; E42-S123 PolarHBondContact OE1-OG 2.98Å
43L95.5Very high94.2Very high8 Ų852 Ų524%0.04228%0.28CS..PPolyproline II helixtrans-63.3133.1174.4-63.5-168.5000110.5V34 A35 V38 E47 L51 L114V34-L43 HydrophobicContact CG1-CD2 3.7Å; A35-L43 HydrophobicContact CB-CD1 4.43Å; V38-L43 HydrophobicContact CG1-CD2 3.73Å; V38-L43 HydrophobicContact CG1-CG 3.77Å; L43-E47 HydrophobicContact CB-CB 4.13Å; L43-E47 HydrophobicContact CD2-CB 4.18Å; L43-L51 HydrophobicContact CD1-CD2 4.24Å; L43-L114 HydrophobicContact CD1-CD2 3.6Å; L43-L114 HydrophobicContact CG-CD2 4.02Å
44T95.4Very high94.3Very high65 Ų6548.4 Ų48.440%0.39926%0.264SS..PPolyproline II helixtrans-64.1163.2166.962.60000110.6E42 E46 E47 R48E42-T44 PolarHBondContact O-N 2.98Å; T44-E46 PolarHBondContact O-N 3Å; T44-E47 PolarHBondContact N-OE2 2.9Å; T44-E47 PolarHBondContact O-N 3.27Å; T44-E47 VanDerWaalsContact OG1-CG 3.25Å; T44-E47 WeakPolarHBondContact OG1-CG 3.37Å; T44-E47 PolarHBondContact OG1-N 2.92Å; T44-E47 PolarHBondContact OG1-OE2 2.69Å; T44-R48 WeakPolarHBondContact O-CB 3.26Å; T44-R48 PolarHBondContact O-N 2.92Å
45V93.4Very high94.3Very high84 Ų8448.5 Ų48.551%0.50927%0.265SS..Hα-helixtrans-56.9-39.1175.5174.90000111.4N49V45-N49 WeakPolarHBondContact O-CB 3.42Å; V45-N49 PolarHBondContact O-N 3.49Å; V45-N49 PolarHBondContact O-ND2 3.2Å; V45-N49 PolarHBondContact O-OD1 3.14Å
46E95.8Very high94.4Very high105 Ų10555.5 Ų55.549%0.49130%0.295SS..Hα-helixtrans-63.9-49.1176.9-172.2-179.3-148.500111.4K16 T44 R48 N49 L50K16-E46 VanDerWaalsContact CE-OE1 3.25Å; K16-E46 WeakPolarHBondContact CE-OE1 3.35Å; K16-E46 IonicContact NZ-OE1 2.71Å; K16-E46 PolarHBondContact NZ-OE1 3.17Å; K16-E46 IonicContact NZ-OE2 2.71Å; K16-E46 PolarHBondContact NZ-OE2 3.18Å; T44-E46 PolarHBondContact O-N 3Å; E46-R48 PolarHBondContact O-N 3.41Å; E46-N49 PolarHBondContact O-N 3.42Å; E46-L50 HydrophobicContact CG-CD1 4.31Å; E46-L50 WeakPolarHBondContact O-CG 3.42Å; E46-L50 PolarHBondContact O-N 3.15Å
47E97.4Very high94.6Very high16 Ų1653.4 Ų53.48%0.07529%0.289CS..Hα-helixtrans-63.5-41.7179.6-69.7167135.800112.1R8 V12 M31 V34 L43 T44 N49 L50 L51R8-E47 IonicContact CZ-OE1 3.9Å; R8-E47 IonicContact CZ-OE2 2.82Å; R8-E47 IonicContact NE-OE1 2.76Å; R8-E47 PolarHBondContact NE-OE1 3.28Å; R8-E47 IonicContact NE-OE2 3.47Å; R8-E47 IonicContact NH2-OE1 3.68Å; R8-E47 PolarHBondContact NH2-OE1 3.49Å; R8-E47 IonicContact NH2-OE2 2.79Å; R8-E47 PolarHBondContact NH2-OE2 2.93Å; V12-E47 HydrophobicContact CG2-CG 3.86Å; M31-E47 HydrophobicContact CE-CB 4.2Å; M31-E47 WeakPolarHBondContact CE-O 3.31Å; V34-E47 HydrophobicContact CG1-CG 4.32Å; L43-E47 HydrophobicContact CB-CB 4.13Å; L43-E47 HydrophobicContact CD2-CB 4.18Å; T44-E47 PolarHBondContact N-OE2 2.9Å; T44-E47 PolarHBondContact O-N 3.27Å; T44-E47 VanDerWaalsContact OG1-CG 3.25Å; T44-E47 WeakPolarHBondContact OG1-CG 3.37Å; T44-E47 PolarHBondContact OG1-N 2.92Å; T44-E47 PolarHBondContact OG1-OE2 2.69Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 3.01Å; E47-L50 PolarHBondContact O-N 2.97Å; E47-L51 PolarHBondContact O-N 3.08Å
48R96.8Very high94.8Very high9 Ų951.6 Ų51.63%0.03428%0.278CS..Hα-helixtrans-58.3-44173.7-179.2-170.575.8-1751.6111.2T44 E46 L51 S52 E122 F126 Y127T44-R48 WeakPolarHBondContact O-CB 3.26Å; T44-R48 PolarHBondContact O-N 2.92Å; E46-R48 PolarHBondContact O-N 3.41Å; R48-L51 PolarHBondContact O-N 3.48Å; R48-S52 PolarHBondContact O-N 3.12Å; R48-S52 VanDerWaalsContact O-N 3.09Å; R48-E122 IonicContact CZ-OE1 2.76Å; R48-E122 VanDerWaalsContact CZ-OE1 3.29Å; R48-E122 IonicContact NH1-OE1 3.29Å; R48-E122 PolarHBondContact NH1-OE1 2.98Å; R48-E122 IonicContact NH2-OE1 3.16Å; R48-E122 PolarHBondContact NH2-OE1 3.28Å; R48-F126 VanDerWaalsContact CD-CD1 3.48Å; R48-F126 HydrophobicContact CG-CD1 3.54Å; R48-F126 HydrophobicContact CG-CD2 4.45Å; R48-F126 HydrophobicContact CG-CE1 3.3Å; R48-F126 HydrophobicContact CG-CE2 4.23Å; R48-F126 HydrophobicContact CG-CG 4.12Å; R48-F126 HydrophobicContact CG-CZ 3.66Å; R48-Y127 HydrophobicContact CG-CE1 3.91Å
49N96Very high95.3Very high72 Ų7251.3 Ų51.339%0.38528%0.276SS..Hα-helixtrans-67.2-42.8178.8-70.6-11.4000111.4V45 E46 E47 L51 S52 V53V45-N49 WeakPolarHBondContact O-CB 3.42Å; V45-N49 PolarHBondContact O-N 3.49Å; V45-N49 PolarHBondContact O-ND2 3.2Å; V45-N49 PolarHBondContact O-OD1 3.14Å; E46-N49 PolarHBondContact O-N 3.42Å; E47-N49 VanDerWaalsContact C-N 3.3Å; E47-N49 PolarHBondContact O-N 3.01Å; N49-L51 PolarHBondContact O-N 3.09Å; N49-S52 WeakPolarHBondContact O-CB 3.45Å; N49-S52 PolarHBondContact O-N 2.89Å; N49-V53 WeakPolarHBondContact O-CG2 3.32Å; N49-V53 PolarHBondContact O-N 3.36Å
50L98.3Very high96Very high10 Ų1046.2 Ų46.25%0.05226%0.256CS..Hα-helixtrans-58.8-46.6175-72.6170000111.7V12 K16 E19 M27 M31 E46 E47 S52 V53 A54V12-L50 HydrophobicContact CG1-CD1 4.03Å; K16-L50 HydrophobicContact CG-CD1 4.08Å; K16-L50 HydrophobicContact CG-CD2 4.17Å; E19-L50 WeakPolarHBondContact OE2-CD2 3.34Å; M27-L50 HydrophobicContact CE-CB 3.99Å; M27-L50 HydrophobicContact CE-CD2 3.56Å; M27-L50 HydrophobicContact CE-CG 4.4Å; M27-L50 VanDerWaalsContact CE-O 3.27Å; M27-L50 WeakPolarHBondContact CE-O 3.11Å; M31-L50 HydrophobicContact CE-CB 3.95Å; M31-L50 HydrophobicContact CG-CB 4.31Å; M31-L50 HydrophobicContact SD-CB 3.83Å; M31-L50 HydrophobicContact SD-CD1 4.35Å; E46-L50 HydrophobicContact CG-CD1 4.31Å; E46-L50 WeakPolarHBondContact O-CG 3.42Å; E46-L50 PolarHBondContact O-N 3.15Å; E47-L50 PolarHBondContact O-N 2.97Å; L50-S52 VanDerWaalsContact C-N 3.28Å; L50-S52 PolarHBondContact O-N 2.89Å; L50-V53 PolarHBondContact O-N 3.21Å; L50-A54 WeakPolarHBondContact O-CB 3.22Å; L50-A54 PolarHBondContact O-N 2.97Å
51L98.3Very high96.7Very high0 Ų043 Ų430%024%0.237CC..Hα-helixtrans-57-44.7175.9-179.771.1000111M31 L43 E47 R48 N49 A54 Y55 I106 L109 L114M31-L51 HydrophobicContact CB-CB 4.34Å; M31-L51 HydrophobicContact CB-CD1 3.68Å; M31-L51 HydrophobicContact CE-CB 4.08Å; L43-L51 HydrophobicContact CD1-CD2 4.24Å; E47-L51 PolarHBondContact O-N 3.08Å; R48-L51 PolarHBondContact O-N 3.48Å; N49-L51 PolarHBondContact O-N 3.09Å; L51-A54 PolarHBondContact O-N 3.02Å; L51-Y55 HydrophobicContact CD1-CD2 3.83Å; L51-Y55 HydrophobicContact CD1-CE2 3.61Å; L51-Y55 HydrophobicContact CG-CD2 4.3Å; L51-Y55 HydrophobicContact CG-CE2 4.46Å; L51-Y55 WeakPolarHBondContact O-CD2 3.46Å; L51-Y55 PolarHBondContact O-N 3.31Å; L51-Y55 VanDerWaalsContact O-N 3.15Å; L51-I106 HydrophobicContact CD2-CD1 4.36Å; L51-L109 HydrophobicContact CD1-CD2 4.05Å; L51-L109 HydrophobicContact CD2-CD2 4.27Å; L51-L114 HydrophobicContact CD2-CD1 3.53Å
52S97.6Very high97.2Very high32 Ų3239.8 Ų39.822%0.22422%0.219CC..Hα-helixtrans-65.4-43.7178177.30000113.1R48 N49 L50 A54 K56R48-S52 PolarHBondContact O-N 3.12Å; R48-S52 VanDerWaalsContact O-N 3.09Å; N49-S52 WeakPolarHBondContact O-CB 3.45Å; N49-S52 PolarHBondContact O-N 2.89Å; L50-S52 VanDerWaalsContact C-N 3.28Å; L50-S52 PolarHBondContact O-N 2.89Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.41Å; S52-K56 WeakPolarHBondContact O-CB 3.44Å; S52-K56 PolarHBondContact O-N 3.47Å
53V98.1Very high97.4Very high46 Ų4639.1 Ų39.128%0.27922%0.215SC..Hα-helixtrans-60.6-45.1176.2169.30000110.6M27 N49 L50 K56 N57M27-V53 HydrophobicContact CE-CB 4.23Å; M27-V53 HydrophobicContact CE-CG1 4.12Å; M27-V53 HydrophobicContact SD-CG1 4.32Å; N49-V53 WeakPolarHBondContact O-CG2 3.32Å; N49-V53 PolarHBondContact O-N 3.36Å; L50-V53 PolarHBondContact O-N 3.21Å; V53-K56 PolarHBondContact O-N 2.86Å; V53-N57 PolarHBondContact O-N 2.95Å; V53-N57 VanDerWaalsContact O-N 3.12Å; V53-N57 PolarHBondContact O-ND2 3.45Å
54A98.5Very high97.5Very high0 Ų040.9 Ų40.90%023%0.231CC..Hα-helixtrans-56.3-59.3179.200000111.3M27 V28 L50 L51 S52 K56 N57 V58M27-A54 HydrophobicContact CB-CB 3.94Å; M27-A54 HydrophobicContact CE-CB 4.23Å; M27-A54 HydrophobicContact CG-CB 3.61Å; M27-A54 HydrophobicContact SD-CB 3.59Å; M27-A54 VanDerWaalsContact SD-CB 3.59Å; V28-A54 HydrophobicContact CG2-CB 3.72Å; L50-A54 WeakPolarHBondContact O-CB 3.22Å; L50-A54 PolarHBondContact O-N 2.97Å; L51-A54 PolarHBondContact O-N 3.02Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.41Å; A54-K56 PolarHBondContact O-N 3.37Å; A54-N57 PolarHBondContact O-N 3.02Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å; A54-V58 PolarHBondContact O-N 3.25Å; A54-V58 VanDerWaalsContact O-N 3.14Å
55Y98.6Very high97.7Very high3 Ų340.5 Ų40.51%0.01223%0.231CC..Hα-helixtrans-69.3-35.3-177.2-81.5-86000112.8V28 E32 L51 N57 V58 I59 I102 I106 Y134V28-Y55 HydrophobicContact CG1-CD1 4.36Å; V28-Y55 HydrophobicContact CG1-CD2 4.42Å; V28-Y55 HydrophobicContact CG1-CE1 3.74Å; V28-Y55 HydrophobicContact CG1-CE2 3.81Å; V28-Y55 VanDerWaalsContact CG1-CZ 3.47Å; V28-Y55 HydrophobicContact CG2-CD1 4.09Å; V28-Y55 HydrophobicContact CG2-CD2 3.98Å; V28-Y55 HydrophobicContact CG2-CE1 4.3Å; V28-Y55 HydrophobicContact CG2-CE2 4.2Å; V28-Y55 HydrophobicContact CG2-CG 3.93Å; E32-Y55 VanDerWaalsContact CD-OH 3.3Å; E32-Y55 HydrophobicContact CG-CE2 4.42Å; E32-Y55 WeakPolarHBondContact CG-OH 3.43Å; E32-Y55 PolarHBondContact OE1-OH 2.99Å; L51-Y55 HydrophobicContact CD1-CD2 3.83Å; L51-Y55 HydrophobicContact CD1-CE2 3.61Å; L51-Y55 HydrophobicContact CG-CD2 4.3Å; L51-Y55 HydrophobicContact CG-CE2 4.46Å; L51-Y55 WeakPolarHBondContact O-CD2 3.46Å; L51-Y55 PolarHBondContact O-N 3.31Å; L51-Y55 VanDerWaalsContact O-N 3.15Å; Y55-N57 VanDerWaalsContact C-N 3.32Å; Y55-N57 PolarHBondContact O-N 2.68Å; Y55-V58 PolarHBondContact O-N 3Å; Y55-I59 WeakPolarHBondContact O-CB 3.25Å; Y55-I59 WeakPolarHBondContact O-CG2 3.29Å; Y55-I59 PolarHBondContact O-N 3.42Å; Y55-I102 HydrophobicContact CD1-CG2 4.04Å; Y55-I102 HydrophobicContact CE1-CG2 4.45Å; Y55-I106 HydrophobicContact CD1-CB 3.88Å; Y55-I106 HydrophobicContact CD1-CG2 4.28Å; Y55-I106 HydrophobicContact CD2-CB 4.47Å; Y55-I106 HydrophobicContact CD2-CD1 3.97Å; Y55-I106 HydrophobicContact CD2-CG1 4.38Å; Y55-I106 HydrophobicContact CE1-CB 3.63Å; Y55-I106 HydrophobicContact CE1-CG2 4.3Å; Y55-I106 HydrophobicContact CE2-CB 4.23Å; Y55-I106 HydrophobicContact CE2-CD1 3.77Å; Y55-I106 HydrophobicContact CE2-CG1 4.38Å; Y55-I106 HydrophobicContact CG-CB 4.28Å; Y55-I106 HydrophobicContact CG-CD1 4.5Å; Y55-I106 HydrophobicContact CG-CG1 4.42Å; Y55-Y134 WeakPolarHBondContact CB-OH 3.45Å
56K97.7Very high97.9Very high147 Ų14738.1 Ų38.164%0.63921%0.212SC*.Hα-helixtrans-59.1-42.8177.4-179.2-178.8176.7-175.30111.7S52 V53 A54 G60S52-K56 WeakPolarHBondContact O-CB 3.44Å; S52-K56 PolarHBondContact O-N 3.47Å; V53-K56 PolarHBondContact O-N 2.86Å; A54-K56 PolarHBondContact O-N 3.37Å; K56-G60 WeakPolarHBondContact O-CA 3.3Å; K56-G60 PolarHBondContact O-N 2.63Å
57N98.2Very high98Very high58 Ų5838.1 Ų38.131%0.3121%0.208SC..Hα-helixtrans-69.2-46177.5-79.8-72.4000111.4Y24 V53 A54 Y55 I59 G60 A61Y24-N57 HydrophobicContact CD1-CB 3.56Å; Y24-N57 HydrophobicContact CD2-CB 3.52Å; Y24-N57 HydrophobicContact CE1-CB 3.88Å; Y24-N57 WeakPolarHBondContact CE1-ND2 3.39Å; Y24-N57 HydrophobicContact CE2-CB 3.83Å; Y24-N57 HydrophobicContact CG-CB 3.36Å; Y24-N57 VanDerWaalsContact CZ-CG 3.5Å; V53-N57 PolarHBondContact O-N 2.95Å; V53-N57 VanDerWaalsContact O-N 3.12Å; V53-N57 PolarHBondContact O-ND2 3.45Å; A54-N57 PolarHBondContact O-N 3.02Å; Y55-N57 VanDerWaalsContact C-N 3.32Å; Y55-N57 PolarHBondContact O-N 2.68Å; N57-I59 PolarHBondContact O-N 3Å; N57-G60 PolarHBondContact O-N 3.15Å; N57-A61 PolarHBondContact O-N 3.23Å
58V98.4Very high98.1Very high9 Ų942.3 Ų42.36%0.05523%0.23CC..Hα-helixtrans-60.7-48.7179.9166.80000111.7Y24 E25 V28 A54 Y55 R62 I102Y24-V58 VanDerWaalsContact C-CG2 3.48Å; Y24-V58 WeakPolarHBondContact O-CG2 3.37Å; E25-V58 HydrophobicContact CG-CG2 4.37Å; V28-V58 HydrophobicContact CG2-CB 4.41Å; V28-V58 HydrophobicContact CG2-CG2 3.85Å; A54-V58 WeakPolarHBondContact O-CG2 3.4Å; A54-V58 PolarHBondContact O-N 3.25Å; A54-V58 VanDerWaalsContact O-N 3.14Å; Y55-V58 PolarHBondContact O-N 3Å; V58-R62 VanDerWaalsContact O-CZ 3.27Å; V58-R62 PolarHBondContact O-N 2.76Å; V58-R62 PolarHBondContact O-NE 3.33Å; V58-R62 PolarHBondContact O-NH2 3.41Å; V58-R62 VanDerWaalsContact O-NH2 3.07Å; V58-I102 HydrophobicContact CG1-CD1 3.71Å; V58-I102 HydrophobicContact CG1-CG1 3.86Å; V58-I102 HydrophobicContact CG1-CG2 3.92Å
59I98.4Very high98.2Very high2 Ų243.2 Ų43.21%0.0124%0.235CC..Hα-helixtrans-72.9-35.5179.9-161.872.8000111.3Y55 N57 R62 R63 L99 I102 Y134 Y137Y55-I59 WeakPolarHBondContact O-CB 3.25Å; Y55-I59 WeakPolarHBondContact O-CG2 3.29Å; Y55-I59 PolarHBondContact O-N 3.42Å; N57-I59 PolarHBondContact O-N 3Å; I59-R62 PolarHBondContact O-N 3.05Å; I59-R63 HydrophobicContact CG1-CG 4.18Å; I59-R63 WeakPolarHBondContact O-CB 3.15Å; I59-R63 VanDerWaalsContact O-CG 3.31Å; I59-R63 WeakPolarHBondContact O-CG 3.34Å; I59-R63 PolarHBondContact O-N 2.96Å; I59-L99 HydrophobicContact CD1-CD2 3.55Å; I59-L99 HydrophobicContact CG1-CD2 4.27Å; I59-I102 HydrophobicContact CB-CG2 4.17Å; I59-I102 HydrophobicContact CD1-CB 3.89Å; I59-I102 HydrophobicContact CD1-CD1 4.37Å; I59-I102 HydrophobicContact CD1-CG2 3.64Å; I59-I102 HydrophobicContact CG1-CG2 4.46Å; I59-Y134 HydrophobicContact CB-CE1 3.98Å; I59-Y134 HydrophobicContact CD1-CE1 4.34Å; I59-Y134 HydrophobicContact CG1-CD1 4.49Å; I59-Y134 HydrophobicContact CG1-CE1 3.99Å; I59-Y134 HydrophobicContact CG2-CE1 3.99Å; I59-Y137 HydrophobicContact CG1-CD2 3.77Å; I59-Y137 HydrophobicContact CG1-CE2 4.2Å; I59-Y137 HydrophobicContact CG2-CD2 4.38Å; I59-Y137 HydrophobicContact CG2-CE2 3.97Å
60G98.1Very high98.3Very high30 Ų3040.7 Ų40.731%0.30922%0.223SC..Hα-helixtrans-59.9-48.1178.900000112.2K56 N57 R63 A64K56-G60 WeakPolarHBondContact O-CA 3.3Å; K56-G60 PolarHBondContact O-N 2.63Å; N57-G60 PolarHBondContact O-N 3.15Å; G60-R63 PolarHBondContact O-N 2.84Å; G60-A64 WeakPolarHBondContact O-CB 3.24Å; G60-A64 PolarHBondContact O-N 2.78Å
61A98Very high98.3Very high48 Ų4842.3 Ų42.340%0.39724%0.235SC..Hα-helixtrans-59.6-48.5176.800000111.8N57 A64 S65N57-A61 PolarHBondContact O-N 3.23Å; A61-A64 PolarHBondContact O-N 2.82Å; A61-S65 PolarHBondContact O-N 3.34Å; A61-S65 PolarHBondContact O-OG 3.29Å
62R98.3Very high98.2Very high46 Ų4645.7 Ų45.717%0.17425%0.252CS..Hα-helixtrans-65.4-40.2179.4-96.753.868.7162.35.5112.6E25 V58 I59 A64 S65 W66 E98 L99 I102E25-R62 IonicContact OE1-CZ 3.7Å; E25-R62 IonicContact OE1-NH1 2.73Å; E25-R62 PolarHBondContact OE1-NH1 3.08Å; E25-R62 IonicContact OE1-NH2 2.9Å; E25-R62 PolarHBondContact OE1-NH2 2.95Å; V58-R62 VanDerWaalsContact O-CZ 3.27Å; V58-R62 PolarHBondContact O-N 2.76Å; V58-R62 PolarHBondContact O-NE 3.33Å; V58-R62 PolarHBondContact O-NH2 3.41Å; V58-R62 VanDerWaalsContact O-NH2 3.07Å; I59-R62 PolarHBondContact O-N 3.05Å; R62-A64 VanDerWaalsContact C-N 3.34Å; R62-A64 PolarHBondContact O-N 3.24Å; R62-S65 PolarHBondContact O-N 2.71Å; R62-W66 PolarHBondContact O-N 2.99Å; R62-E98 HydrophobicContact CG-CB 4.4Å; R62-L99 HydrophobicContact CB-CD2 3.6Å; R62-L99 HydrophobicContact CB-CG 4.09Å; R62-I102 HydrophobicContact CB-CD1 4.18Å; R62-I102 HydrophobicContact CG-CD1 3.91Å
63R98.3Very high98.3Very high31 Ų3144.8 Ų44.812%0.11725%0.245CC..Hα-helixtrans-64.9-37.5175.5-75.6179.366.1-12816111.9I59 G60 W66 R67 L99 E140I59-R63 HydrophobicContact CG1-CG 4.18Å; I59-R63 WeakPolarHBondContact O-CB 3.15Å; I59-R63 VanDerWaalsContact O-CG 3.31Å; I59-R63 WeakPolarHBondContact O-CG 3.34Å; I59-R63 PolarHBondContact O-N 2.96Å; G60-R63 PolarHBondContact O-N 2.84Å; R63-W66 PolarHBondContact O-N 3.33Å; R63-R67 WeakPolarHBondContact O-CG 3.39Å; R63-R67 PolarHBondContact O-N 3.11Å; R63-L99 HydrophobicContact CB-CD2 4.48Å; R63-L99 HydrophobicContact CG-CD2 3.58Å; R63-E140 IonicContact CZ-OE1 3.83Å; R63-E140 IonicContact CZ-OE2 2.64Å; R63-E140 IonicContact NE-OE1 3.34Å; R63-E140 IonicContact NE-OE2 3.59Å; R63-E140 PolarHBondContact NE-OE2 2.93Å; R63-E140 IonicContact NH2-OE1 2.87Å; R63-E140 PolarHBondContact NH2-OE1 3.41Å; R63-E140 IonicContact NH2-OE2 3.66Å; R63-E140 PolarHBondContact NH2-OE2 3.05Å
64A98.5Very high98.2Very high46 Ų4648.9 Ų48.938%0.3826%0.261SS..Hα-helixtrans-63.6-46.2174.200000111.2G60 A61 R62 W66 R67 I68G60-A64 WeakPolarHBondContact O-CB 3.24Å; G60-A64 PolarHBondContact O-N 2.78Å; A61-A64 PolarHBondContact O-N 2.82Å; R62-A64 VanDerWaalsContact C-N 3.34Å; R62-A64 PolarHBondContact O-N 3.24Å; A64-W66 VanDerWaalsContact C-N 3.35Å; A64-W66 PolarHBondContact O-N 3.42Å; A64-R67 PolarHBondContact O-N 2.8Å; A64-I68 WeakPolarHBondContact O-CG1 3.39Å; A64-I68 PolarHBondContact O-N 2.94Å; A64-I68 VanDerWaalsContact O-N 3.1Å
65S98.5Very high98.1Very high56 Ų5655 Ų5539%0.39229%0.288SS..Hα-helixtrans-57.2-47.9173.8-56.50000111.6A61 R62 R67 I68 I69A61-S65 PolarHBondContact O-N 3.34Å; A61-S65 PolarHBondContact O-OG 3.29Å; R62-S65 PolarHBondContact O-N 2.71Å; S65-R67 PolarHBondContact O-N 3.46Å; S65-I68 PolarHBondContact O-N 2.9Å; S65-I69 WeakPolarHBondContact O-CG1 3.43Å; S65-I69 PolarHBondContact O-N 3.21Å
66W98.7Very high98.1Very high34 Ų3455.7 Ų55.713%0.12929%0.291CS..Hα-helixtrans-59.1-45.2179.1176.179.2000112.8R62 R63 A64 I68 I69 S70 I95 E96 L99 E140 F141R62-W66 PolarHBondContact O-N 2.99Å; R63-W66 PolarHBondContact O-N 3.33Å; A64-W66 VanDerWaalsContact C-N 3.35Å; A64-W66 PolarHBondContact O-N 3.42Å; W66-I68 PolarHBondContact O-N 3.46Å; W66-I69 PolarHBondContact O-N 3.32Å; W66-S70 VanDerWaalsContact O-CB 3.31Å; W66-S70 WeakPolarHBondContact O-CB 3.44Å; W66-S70 PolarHBondContact O-N 3.13Å; W66-S70 PolarHBondContact O-OG 3.38Å; W66-I95 HydrophobicContact CB-CG2 3.78Å; W66-E96 PolarHBondContact NE1-OE1 3.23Å; W66-L99 HydrophobicContact CB-CD1 3.76Å; W66-L99 HydrophobicContact CG-CD1 3.91Å; W66-E140 HydrophobicContact CH2-CB 4.4Å; W66-E140 HydrophobicContact CZ3-CB 4.41Å; W66-F141 HydrophobicContact CD2-CB 4.24Å; W66-F141 VanDerWaalsContact CE2-CB 3.41Å; W66-F141 HydrophobicContact CH2-CB 3.95Å; W66-F141 HydrophobicContact CZ2-CB 3.26Å
67R98.2Very high98Very high106 Ų10652.8 Ų52.840%0.428%0.279SS..Hα-helixtrans-60.5-44.7176.9-75.7-174.4178.191.15112.6R63 A64 S65 S70 S71 E140R63-R67 WeakPolarHBondContact O-CG 3.39Å; R63-R67 PolarHBondContact O-N 3.11Å; A64-R67 PolarHBondContact O-N 2.8Å; S65-R67 PolarHBondContact O-N 3.46Å; R67-S70 PolarHBondContact O-N 3.41Å; R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 3.18Å; R67-E140 IonicContact NH2-OE2 3.41Å; R67-E140 PolarHBondContact NH2-OE2 3.23Å
68I98.5Very high97.9Very high104 Ų10453.4 Ų53.453%0.53330%0.3SS..Hα-helixtrans-62.6-49179.9-68.2166.3000110.1A64 S65 W66 S70 S71 I72A64-I68 WeakPolarHBondContact O-CG1 3.39Å; A64-I68 PolarHBondContact O-N 2.94Å; A64-I68 VanDerWaalsContact O-N 3.1Å; S65-I68 PolarHBondContact O-N 2.9Å; W66-I68 PolarHBondContact O-N 3.46Å; I68-S70 PolarHBondContact O-N 3.49Å; I68-S71 PolarHBondContact O-N 3.28Å; I68-I72 HydrophobicContact CG2-CD1 3.87Å; I68-I72 WeakPolarHBondContact O-CG1 3.36Å; I68-I72 PolarHBondContact O-N 3.42Å
69I98.6Very high97.8Very high28 Ų2861.5 Ų61.514%0.14433%0.33CS..Hα-helixtrans-64.5-41.6-179.5-63-51.9000111.1S65 W66 S71 I72 E73 I88 Y91 R92 I95S65-I69 WeakPolarHBondContact O-CG1 3.43Å; S65-I69 PolarHBondContact O-N 3.21Å; W66-I69 PolarHBondContact O-N 3.32Å; I69-S71 VanDerWaalsContact C-N 3.31Å; I69-S71 PolarHBondContact O-N 2.82Å; I69-I72 HydrophobicContact CD1-CD1 4.31Å; I69-I72 PolarHBondContact O-N 3.41Å; I69-I72 VanDerWaalsContact O-N 3.14Å; I69-E73 PolarHBondContact O-N 3.44Å; I69-I88 HydrophobicContact CG2-CG2 3.81Å; I69-Y91 HydrophobicContact CD1-CD1 3.91Å; I69-Y91 HydrophobicContact CD1-CE1 3.86Å; I69-Y91 HydrophobicContact CG1-CD1 3.99Å; I69-Y91 HydrophobicContact CG1-CE1 3.99Å; I69-Y91 HydrophobicContact CG2-CD1 4.27Å; I69-R92 HydrophobicContact CG2-CB 3.84Å; I69-I95 HydrophobicContact CB-CD1 4.25Å; I69-I95 HydrophobicContact CG1-CD1 3.68Å
70S98Very high97.6Very high18 Ų1864.2 Ų64.213%0.12636%0.358CS..Hα-helixtrans-61.4-38.3175.6-56.70000112.3W66 R67 I68 E73 Q74 R92W66-S70 VanDerWaalsContact O-CB 3.31Å; W66-S70 WeakPolarHBondContact O-CB 3.44Å; W66-S70 PolarHBondContact O-N 3.13Å; W66-S70 PolarHBondContact O-OG 3.38Å; R67-S70 PolarHBondContact O-N 3.41Å; I68-S70 PolarHBondContact O-N 3.49Å; S70-E73 WeakPolarHBondContact O-CB 3.35Å; S70-E73 PolarHBondContact O-N 3.34Å; S70-Q74 WeakPolarHBondContact O-CG 3.36Å; S70-Q74 PolarHBondContact O-N 2.97Å; S70-Q74 VanDerWaalsContact O-N 3.16Å; S70-R92 VanDerWaalsContact OG-CD 3.3Å; S70-R92 WeakPolarHBondContact OG-CD 3.34Å
71S98.1Very high97.4Very high45 Ų4565 Ų6532%0.31536%0.355SS..Hα-helixtrans-68.1-36.8174.4-175.50000112.7R67 I68 I69 K75R67-S71 WeakPolarHBondContact O-CB 3.49Å; R67-S71 PolarHBondContact O-N 3.18Å; I68-S71 PolarHBondContact O-N 3.28Å; I69-S71 VanDerWaalsContact C-N 3.31Å; I69-S71 PolarHBondContact O-N 2.82Å; S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 3.23Å
72I98.1Very high97.2Very high70 Ų7070.2 Ų70.236%0.35937%0.371SS..Hα-helixtrans-67.5-40.5175.8-67.3167.2000110.5I68 I69 K75 E76 I88I68-I72 HydrophobicContact CG2-CD1 3.87Å; I68-I72 WeakPolarHBondContact O-CG1 3.36Å; I68-I72 PolarHBondContact O-N 3.42Å; I69-I72 HydrophobicContact CD1-CD1 4.31Å; I69-I72 PolarHBondContact O-N 3.41Å; I69-I72 VanDerWaalsContact O-N 3.14Å; I72-K75 PolarHBondContact O-N 3Å; I72-E76 PolarHBondContact O-N 2.89Å; I72-I88 HydrophobicContact CG2-CD1 3.92Å
73E97.7Very high97.1Very high13 Ų1374.3 Ų74.36%0.06140%0.396CS..Hα-helixtrans-55-54.6174.3-172.3175.8150.900111.1I69 S70 K75 E76 E77 I88 K89 R92I69-E73 PolarHBondContact O-N 3.44Å; S70-E73 WeakPolarHBondContact O-CB 3.35Å; S70-E73 PolarHBondContact O-N 3.34Å; E73-K75 VanDerWaalsContact C-N 3.25Å; E73-K75 PolarHBondContact O-N 3.44Å; E73-E76 PolarHBondContact O-N 2.92Å; E73-E76 VanDerWaalsContact O-N 3.12Å; E73-E77 WeakPolarHBondContact O-CG 3.36Å; E73-E77 PolarHBondContact O-N 3.17Å; E73-I88 HydrophobicContact CB-CG2 3.62Å; E73-I88 HydrophobicContact CG-CG2 4.16Å; E73-K89 VanDerWaalsContact CD-CG 3.49Å; E73-K89 HydrophobicContact CG-CG 4.25Å; E73-K89 WeakPolarHBondContact OE1-CE 3.43Å; E73-K89 WeakPolarHBondContact OE1-CG 3.35Å; E73-R92 IonicContact OE1-CZ 3.34Å; E73-R92 IonicContact OE1-NE 2.68Å; E73-R92 IonicContact OE1-NH2 2.93Å; E73-R92 PolarHBondContact OE1-NH2 2.99Å; E73-R92 WeakPolarHBondContact OE2-CD 3.43Å; E73-R92 IonicContact OE2-CZ 3.32Å; E73-R92 IonicContact OE2-NE 2.89Å; E73-R92 PolarHBondContact OE2-NE 3.12Å; E73-R92 IonicContact OE2-NH2 3.66Å; E73-R92 PolarHBondContact OE2-NH2 3.17Å
74Q96.8Very high97Very high132 Ų13279.3 Ų79.362%0.61742%0.415SS*.Hα-helixtrans-57.1-38.6179.2-70.9173-4.700112.4S70 G78S70-Q74 WeakPolarHBondContact O-CG 3.36Å; S70-Q74 PolarHBondContact O-N 2.97Å; S70-Q74 VanDerWaalsContact O-N 3.16Å; Q74-G78 PolarHBondContact O-N 2.9Å
75K97Very high97Very high130 Ų13077.7 Ų77.757%0.56540%0.401SS*.Hα-helixtrans-69.1-39.8177.9-73.7170.6-176.41690112.7S71 I72 E73 R79S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 3.23Å; I72-K75 PolarHBondContact O-N 3Å; E73-K75 VanDerWaalsContact C-N 3.25Å; E73-K75 PolarHBondContact O-N 3.44Å; K75-R79 WeakPolarHBondContact O-CG 3.47Å; K75-R79 PolarHBondContact O-N 3.38Å
76E97.4Very high97Very high16 Ų1678.7 Ų78.78%0.07541%0.405CS..Hα-helixtrans-75.3-31.4176.8-71.2-64.5121.900112I72 E73 R79 G80 N81 R84 V85 I88I72-E76 PolarHBondContact O-N 2.89Å; E73-E76 PolarHBondContact O-N 2.92Å; E73-E76 VanDerWaalsContact O-N 3.12Å; E76-R79 WeakPolarHBondContact O-CB 3.27Å; E76-R79 PolarHBondContact O-N 2.53Å; E76-R79 VanDerWaalsContact O-N 3.12Å; E76-R79 WeakPolarHBondContact OE1-CD 3.25Å; E76-R79 IonicContact OE1-CZ 3.6Å; E76-R79 IonicContact OE1-NE 3.85Å; E76-R79 IonicContact OE1-NH1 3.05Å; E76-R79 PolarHBondContact OE1-NH1 2.88Å; E76-G80 PolarHBondContact O-N 2.91Å; E76-N81 PolarHBondContact O-N 3.38Å; E76-N81 PolarHBondContact OE2-ND2 3.49Å; E76-R84 WeakPolarHBondContact OE2-CD 3.43Å; E76-R84 IonicContact OE2-NH1 2.67Å; E76-R84 PolarHBondContact OE2-NH1 2.8Å; E76-V85 HydrophobicContact CB-CG2 3.95Å; E76-I88 HydrophobicContact CB-CD1 3.95Å; E76-I88 HydrophobicContact CG-CD1 3.72Å
77E95.8Very high96.9Very high86 Ų8682.9 Ų82.940%0.40243%0.429SS..Hα-helixtrans-60-46.3169.3-76.2-175.5153.300111E73 R79 G80 V85 K89E73-E77 WeakPolarHBondContact O-CG 3.36Å; E73-E77 PolarHBondContact O-N 3.17Å; E77-R79 PolarHBondContact O-N 3.14Å; E77-R79 VanDerWaalsContact O-N 3.12Å; E77-G80 PolarHBondContact O-N 2.8Å; E77-V85 HydrophobicContact CB-CG2 4.27Å; E77-V85 HydrophobicContact CG-CB 4.27Å; E77-V85 HydrophobicContact CG-CG1 3.59Å; E77-V85 HydrophobicContact CG-CG2 3.59Å; E77-K89 WeakPolarHBondContact OE1-CE 3.43Å; E77-K89 IonicContact OE1-NZ 3.4Å; E77-K89 PolarHBondContact OE1-NZ 3.19Å
78G96.1Very high96.9Very high72 Ų7279.1 Ų79.174%0.74242%0.417SS*.THydrogen-bonded Turntrans-62.6-16.8174.800000114.7Q74Q74-G78 PolarHBondContact O-N 2.9Å
79R96Very high96.9Very high179 Ų17978.1 Ų78.168%0.67541%0.408SS*.THydrogen-bonded Turntrans-93.5-5.3174.8-68.5169.4178.5-175.3-4.2113.3K75 E76 E77 N81K75-R79 WeakPolarHBondContact O-CG 3.47Å; K75-R79 PolarHBondContact O-N 3.38Å; E76-R79 WeakPolarHBondContact O-CB 3.27Å; E76-R79 PolarHBondContact O-N 2.53Å; E76-R79 VanDerWaalsContact O-N 3.12Å; E76-R79 WeakPolarHBondContact OE1-CD 3.25Å; E76-R79 IonicContact OE1-CZ 3.6Å; E76-R79 IonicContact OE1-NE 3.85Å; E76-R79 IonicContact OE1-NH1 3.05Å; E76-R79 PolarHBondContact OE1-NH1 2.88Å; E77-R79 PolarHBondContact O-N 3.14Å; E77-R79 VanDerWaalsContact O-N 3.12Å; R79-N81 VanDerWaalsContact C-N 3.31Å; R79-N81 PolarHBondContact O-N 3.29Å
80G94.3Very high96.9Very high59 Ų5982.1 Ų82.161%0.60843%0.43SS*.THydrogen-bonded Turntrans6925-17800000114.2E76 E77 E82E76-G80 PolarHBondContact O-N 2.91Å; E77-G80 PolarHBondContact O-N 2.8Å; G80-E82 PolarHBondContact O-N 3.24Å
81N94Very high96.9Very high46 Ų4687.3 Ų87.325%0.24645%0.448CS..  trans-93.373.2-176.6-166.4-9.8000112E76 R79 D83 R84 V85E76-N81 PolarHBondContact O-N 3.38Å; E76-N81 PolarHBondContact OE2-ND2 3.49Å; R79-N81 VanDerWaalsContact C-N 3.31Å; R79-N81 PolarHBondContact O-N 3.29Å; N81-D83 VanDerWaalsContact C-N 3.31Å; N81-D83 PolarHBondContact O-N 3.09Å; N81-R84 HydrophobicContact CB-CB 4.39Å; N81-R84 WeakPolarHBondContact ND2-CD 3.34Å; N81-R84 VanDerWaalsContact ND2-CG 3.33Å; N81-R84 WeakPolarHBondContact ND2-CG 3.22Å; N81-R84 VanDerWaalsContact ND2-CZ 3.33Å; N81-R84 PolarHBondContact ND2-NE 3.38Å; N81-R84 VanDerWaalsContact ND2-NE 3.15Å; N81-R84 PolarHBondContact ND2-NH1 3.07Å; N81-R84 PolarHBondContact O-N 2.85Å; N81-R84 VanDerWaalsContact O-N 3.11Å; N81-V85 WeakPolarHBondContact O-CG2 3.35Å; N81-V85 PolarHBondContact O-N 3.47Å
82E94.7Very high96.9Very high157 Ų15787.9 Ų87.973%0.73444%0.443SS*.Hα-helixtrans-55.7-40.1-170.2-63.5-176.1175.500113.9G80 R84 V85 T86G80-E82 PolarHBondContact O-N 3.24Å; E82-R84 PolarHBondContact O-N 3.09Å; E82-V85 PolarHBondContact O-N 3.39Å; E82-T86 PolarHBondContact O-N 3.02Å; E82-T86 PolarHBondContact O-OG1 2.98Å
83D95.8Very high97Very high132 Ų13285.7 Ų85.771%0.70644%0.438SS*.Hα-helixtrans-62.4-44.6178.5-70.6-20.9000111.6N81 T86 L87N81-D83 VanDerWaalsContact C-N 3.31Å; N81-D83 PolarHBondContact O-N 3.09Å; D83-T86 PolarHBondContact O-N 3.16Å; D83-L87 PolarHBondContact O-N 3.31Å
84R96.9Very high97Very high136 Ų13690.8 Ų90.851%0.51346%0.46SS..Hα-helixtrans-70.5-39.5177.4-69.8-165.1-163.9154.1-4.4111.9E76 N81 E82 T86 L87 I88E76-R84 WeakPolarHBondContact OE2-CD 3.43Å; E76-R84 IonicContact OE2-NH1 2.67Å; E76-R84 PolarHBondContact OE2-NH1 2.8Å; N81-R84 HydrophobicContact CB-CB 4.39Å; N81-R84 WeakPolarHBondContact ND2-CD 3.34Å; N81-R84 VanDerWaalsContact ND2-CG 3.33Å; N81-R84 WeakPolarHBondContact ND2-CG 3.22Å; N81-R84 VanDerWaalsContact ND2-CZ 3.33Å; N81-R84 PolarHBondContact ND2-NE 3.38Å; N81-R84 VanDerWaalsContact ND2-NE 3.15Å; N81-R84 PolarHBondContact ND2-NH1 3.07Å; N81-R84 PolarHBondContact O-N 2.85Å; N81-R84 VanDerWaalsContact O-N 3.11Å; E82-R84 PolarHBondContact O-N 3.09Å; R84-T86 PolarHBondContact O-N 3.25Å; R84-L87 PolarHBondContact O-N 3.13Å; R84-I88 WeakPolarHBondContact O-CD1 3.32Å; R84-I88 WeakPolarHBondContact O-CG1 3.2Å; R84-I88 PolarHBondContact O-N 2.92Å
85V98Very high97.1Very high12 Ų1284.8 Ų84.87%0.07343%0.432CS..Hα-helixtrans-57-42.1175.7169.60000110.3E76 E77 N81 E82 I88 K89E76-V85 HydrophobicContact CB-CG2 3.95Å; E77-V85 HydrophobicContact CB-CG2 4.27Å; E77-V85 HydrophobicContact CG-CB 4.27Å; E77-V85 HydrophobicContact CG-CG1 3.59Å; E77-V85 HydrophobicContact CG-CG2 3.59Å; N81-V85 WeakPolarHBondContact O-CG2 3.35Å; N81-V85 PolarHBondContact O-N 3.47Å; E82-V85 PolarHBondContact O-N 3.39Å; V85-I88 PolarHBondContact O-N 3.1Å; V85-K89 HydrophobicContact CG1-CD 3.95Å; V85-K89 HydrophobicContact CG1-CG 4.44Å; V85-K89 WeakPolarHBondContact O-CB 3.42Å; V85-K89 WeakPolarHBondContact O-CG 3.29Å; V85-K89 PolarHBondContact O-N 3.16Å
86T97.9Very high97.2Very high78 Ų7880.2 Ų80.248%0.47941%0.412SS..Hα-helixtrans-61.4-48.5177-55.40000111.6E82 D83 R84 I88 K89 D90E82-T86 PolarHBondContact O-N 3.02Å; E82-T86 PolarHBondContact O-OG1 2.98Å; D83-T86 PolarHBondContact O-N 3.16Å; R84-T86 PolarHBondContact O-N 3.25Å; T86-I88 VanDerWaalsContact C-N 3.29Å; T86-I88 PolarHBondContact O-N 2.83Å; T86-K89 PolarHBondContact O-N 2.86Å; T86-D90 PolarHBondContact O-N 2.92Å
87L98Very high97.2Very high122 Ų12284 Ų8464%0.63944%0.437SS*.Hα-helixtrans-60.2-38.5176.4-67.3173.1000112.8D83 R84 Y91D83-L87 PolarHBondContact O-N 3.31Å; R84-L87 PolarHBondContact O-N 3.13Å; L87-Y91 PolarHBondContact O-N 3.3Å
88I98.4Very high97.4Very high27 Ų2783.4 Ų83.414%0.13843%0.434CS..Hα-helixtrans-69.3-42178.7-65.5159.6000110.5I69 I72 E73 E76 R84 V85 T86 D90 Y91 R92I69-I88 HydrophobicContact CG2-CG2 3.81Å; I72-I88 HydrophobicContact CG2-CD1 3.92Å; E73-I88 HydrophobicContact CB-CG2 3.62Å; E73-I88 HydrophobicContact CG-CG2 4.16Å; E76-I88 HydrophobicContact CB-CD1 3.95Å; E76-I88 HydrophobicContact CG-CD1 3.72Å; R84-I88 WeakPolarHBondContact O-CD1 3.32Å; R84-I88 WeakPolarHBondContact O-CG1 3.2Å; R84-I88 PolarHBondContact O-N 2.92Å; V85-I88 PolarHBondContact O-N 3.1Å; T86-I88 VanDerWaalsContact C-N 3.29Å; T86-I88 PolarHBondContact O-N 2.83Å; I88-D90 PolarHBondContact O-N 3.4Å; I88-Y91 PolarHBondContact O-N 2.94Å; I88-R92 WeakPolarHBondContact O-CB 3.39Å; I88-R92 PolarHBondContact O-N 2.88Å
89K98Very high97.5Very high82 Ų8280 Ų8036%0.35740%0.399SS..Hα-helixtrans-58.6-45.5176.2-81.8174.6179.7169.70112E73 E77 V85 T86 Y91 R92 G93E73-K89 VanDerWaalsContact CD-CG 3.49Å; E73-K89 HydrophobicContact CG-CG 4.25Å; E73-K89 WeakPolarHBondContact OE1-CE 3.43Å; E73-K89 WeakPolarHBondContact OE1-CG 3.35Å; E77-K89 WeakPolarHBondContact OE1-CE 3.43Å; E77-K89 IonicContact OE1-NZ 3.4Å; E77-K89 PolarHBondContact OE1-NZ 3.19Å; V85-K89 HydrophobicContact CG1-CD 3.95Å; V85-K89 HydrophobicContact CG1-CG 4.44Å; V85-K89 WeakPolarHBondContact O-CB 3.42Å; V85-K89 WeakPolarHBondContact O-CG 3.29Å; V85-K89 PolarHBondContact O-N 3.16Å; T86-K89 PolarHBondContact O-N 2.86Å; K89-Y91 VanDerWaalsContact C-N 3.31Å; K89-Y91 PolarHBondContact O-N 3.4Å; K89-R92 PolarHBondContact O-N 3.2Å; K89-G93 PolarHBondContact O-N 2.69Å
90D98.3Very high97.6Very high113 Ų11372.7 Ų72.760%0.60437%0.374SS*.Hα-helixtrans-60.9-42.9176.8-70.6-16.5000111.4T86 I88 G93 K94T86-D90 PolarHBondContact O-N 2.92Å; I88-D90 PolarHBondContact O-N 3.4Å; D90-G93 PolarHBondContact O-N 2.86Å; D90-K94 PolarHBondContact O-N 3.31Å; D90-K94 VanDerWaalsContact O-N 3.12Å
91Y98.4Very high97.8Very high127 Ų12777.7 Ų77.750%0.49838%0.379SS..Hα-helixtrans-68.9-40.2178.3-170.3-124000112.6I69 L87 I88 K89 G93 K94 I95I69-Y91 HydrophobicContact CD1-CD1 3.91Å; I69-Y91 HydrophobicContact CD1-CE1 3.86Å; I69-Y91 HydrophobicContact CG1-CD1 3.99Å; I69-Y91 HydrophobicContact CG1-CE1 3.99Å; I69-Y91 HydrophobicContact CG2-CD1 4.27Å; L87-Y91 PolarHBondContact O-N 3.3Å; I88-Y91 PolarHBondContact O-N 2.94Å; K89-Y91 VanDerWaalsContact C-N 3.31Å; K89-Y91 PolarHBondContact O-N 3.4Å; Y91-G93 VanDerWaalsContact C-N 3.34Å; Y91-G93 PolarHBondContact O-N 3.14Å; Y91-K94 WeakPolarHBondContact O-CB 3.42Å; Y91-K94 PolarHBondContact O-N 3.39Å; Y91-I95 HydrophobicContact CD1-CD1 4.3Å; Y91-I95 HydrophobicContact CE1-CD1 4.04Å; Y91-I95 PolarHBondContact O-N 2.96Å
92R98.5Very high98Very high57 Ų5776.7 Ų76.722%0.21537%0.373CS..Hα-helixtrans-58.6-46.3171.9-178.3176.353.4108-15.4110.8I69 S70 E73 I88 K89 K94 I95 E96I69-R92 HydrophobicContact CG2-CB 3.84Å; S70-R92 VanDerWaalsContact OG-CD 3.3Å; S70-R92 WeakPolarHBondContact OG-CD 3.34Å; E73-R92 IonicContact OE1-CZ 3.34Å; E73-R92 IonicContact OE1-NE 2.68Å; E73-R92 IonicContact OE1-NH2 2.93Å; E73-R92 PolarHBondContact OE1-NH2 2.99Å; E73-R92 WeakPolarHBondContact OE2-CD 3.43Å; E73-R92 IonicContact OE2-CZ 3.32Å; E73-R92 IonicContact OE2-NE 2.89Å; E73-R92 PolarHBondContact OE2-NE 3.12Å; E73-R92 IonicContact OE2-NH2 3.66Å; E73-R92 PolarHBondContact OE2-NH2 3.17Å; I88-R92 WeakPolarHBondContact O-CB 3.39Å; I88-R92 PolarHBondContact O-N 2.88Å; K89-R92 PolarHBondContact O-N 3.2Å; R92-K94 VanDerWaalsContact C-N 3.26Å; R92-K94 PolarHBondContact O-N 3.46Å; R92-I95 WeakPolarHBondContact O-CA 2.87Å; R92-I95 WeakPolarHBondContact O-CB 3.43Å; R92-I95 PolarHBondContact O-N 3.17Å; R92-E96 WeakPolarHBondContact CD-OE1 3.4Å; R92-E96 HydrophobicContact CG-CG 4.3Å; R92-E96 WeakPolarHBondContact CG-OE1 3.41Å; R92-E96 IonicContact CZ-OE1 3.53Å; R92-E96 IonicContact NE-OE1 2.73Å; R92-E96 IonicContact NH1-OE1 3.49Å; R92-E96 PolarHBondContact NH1-OE1 2.93Å; R92-E96 IonicContact NH1-OE2 3.24Å; R92-E96 WeakPolarHBondContact O-CG 3.39Å; R92-E96 PolarHBondContact O-N 3.44Å
93G98.4Very high98.2Very high24 Ų2469.2 Ų69.225%0.24734%0.338CS..Hα-helixtrans-59.9-34.1178.700000113.4K89 D90 Y91 E96 T97K89-G93 PolarHBondContact O-N 2.69Å; D90-G93 PolarHBondContact O-N 2.86Å; Y91-G93 VanDerWaalsContact C-N 3.34Å; Y91-G93 PolarHBondContact O-N 3.14Å; G93-E96 PolarHBondContact O-N 3.07Å; G93-T97 PolarHBondContact O-N 2.67Å; G93-T97 PolarHBondContact O-OG1 2.9Å
94K98.6Very high98.3Very high120 Ų12066.9 Ų66.952%0.52233%0.326SS..Hα-helixtrans-61.5-47.5170.4-175.9-174.2174.3-1700111.6D90 Y91 R92 E96 T97 E98D90-K94 PolarHBondContact O-N 3.31Å; D90-K94 VanDerWaalsContact O-N 3.12Å; Y91-K94 WeakPolarHBondContact O-CB 3.42Å; Y91-K94 PolarHBondContact O-N 3.39Å; R92-K94 VanDerWaalsContact C-N 3.26Å; R92-K94 PolarHBondContact O-N 3.46Å; K94-E96 VanDerWaalsContact C-N 3.32Å; K94-E96 PolarHBondContact O-N 3.17Å; K94-T97 WeakPolarHBondContact O-CB 3.13Å; K94-T97 PolarHBondContact O-N 2.97Å; K94-E98 VanDerWaalsContact CE-OE1 3.24Å; K94-E98 WeakPolarHBondContact CE-OE1 3.32Å; K94-E98 WeakPolarHBondContact O-CG 3.46Å; K94-E98 PolarHBondContact O-N 3.46Å
95I98.6Very high98.4Very high5 Ų561.6 Ų61.63%0.02631%0.313CS..Hα-helixtrans-64.1-39.4178.6-59.4167.7000110.7W66 I69 Y91 R92 T97 E98 L99W66-I95 HydrophobicContact CB-CG2 3.78Å; I69-I95 HydrophobicContact CB-CD1 4.25Å; I69-I95 HydrophobicContact CG1-CD1 3.68Å; Y91-I95 HydrophobicContact CD1-CD1 4.3Å; Y91-I95 HydrophobicContact CE1-CD1 4.04Å; Y91-I95 PolarHBondContact O-N 2.96Å; R92-I95 WeakPolarHBondContact O-CA 2.87Å; R92-I95 WeakPolarHBondContact O-CB 3.43Å; R92-I95 PolarHBondContact O-N 3.17Å; I95-T97 VanDerWaalsContact C-N 3.29Å; I95-T97 PolarHBondContact O-N 2.69Å; I95-E98 WeakPolarHBondContact O-CB 3.39Å; I95-E98 PolarHBondContact O-N 2.84Å; I95-L99 HydrophobicContact CG2-CD1 4.27Å; I95-L99 HydrophobicContact CG2-CG 4.45Å; I95-L99 WeakPolarHBondContact O-CB 3.46Å; I95-L99 WeakPolarHBondContact O-CG 3.25Å; I95-L99 PolarHBondContact O-N 3.14Å
96E98.7Very high98.4Very high34 Ų3461 Ų6116%0.15931%0.31CS..Hα-helixtrans-63-35.8175.5-70.3175.4177.900112.2W66 R92 G93 K94 T100 F141W66-E96 PolarHBondContact NE1-OE1 3.23Å; R92-E96 WeakPolarHBondContact CD-OE1 3.4Å; R92-E96 HydrophobicContact CG-CG 4.3Å; R92-E96 WeakPolarHBondContact CG-OE1 3.41Å; R92-E96 IonicContact CZ-OE1 3.53Å; R92-E96 IonicContact NE-OE1 2.73Å; R92-E96 IonicContact NH1-OE1 3.49Å; R92-E96 PolarHBondContact NH1-OE1 2.93Å; R92-E96 IonicContact NH1-OE2 3.24Å; R92-E96 WeakPolarHBondContact O-CG 3.39Å; R92-E96 PolarHBondContact O-N 3.44Å; G93-E96 PolarHBondContact O-N 3.07Å; K94-E96 VanDerWaalsContact C-N 3.32Å; K94-E96 PolarHBondContact O-N 3.17Å; E96-T100 WeakPolarHBondContact O-CB 3.25Å; E96-T100 PolarHBondContact O-N 3.44Å; E96-T100 PolarHBondContact O-OG1 3.48Å; E96-F141 HydrophobicContact CB-CD2 3.75Å; E96-F141 HydrophobicContact CB-CE2 3.86Å; E96-F141 HydrophobicContact CG-CB 4.28Å; E96-F141 HydrophobicContact CG-CD2 3.59Å; E96-F141 HydrophobicContact CG-CE2 4.21Å; E96-F141 HydrophobicContact CG-CG 4.13Å
97T98.7Very high98.4Very high97 Ų9757.5 Ų57.560%0.59529%0.288SS*.Hα-helixtrans-65.4-42.7173-57.60000111.3G93 K94 I95 T100 K101G93-T97 PolarHBondContact O-N 2.67Å; G93-T97 PolarHBondContact O-OG1 2.9Å; K94-T97 WeakPolarHBondContact O-CB 3.13Å; K94-T97 PolarHBondContact O-N 2.97Å; I95-T97 VanDerWaalsContact C-N 3.29Å; I95-T97 PolarHBondContact O-N 2.69Å; T97-T100 PolarHBondContact O-N 3.29Å; T97-K101 PolarHBondContact O-N 2.89Å
98E98.6Very high98.4Very high73 Ų7359 Ų5934%0.34129%0.29SS..Hα-helixtrans-64-45.4175.8-68.1169.2-17200111.7R62 K94 I95 T100 K101 I102R62-E98 HydrophobicContact CG-CB 4.4Å; K94-E98 VanDerWaalsContact CE-OE1 3.24Å; K94-E98 WeakPolarHBondContact CE-OE1 3.32Å; K94-E98 WeakPolarHBondContact O-CG 3.46Å; K94-E98 PolarHBondContact O-N 3.46Å; I95-E98 WeakPolarHBondContact O-CB 3.39Å; I95-E98 PolarHBondContact O-N 2.84Å; E98-T100 PolarHBondContact O-N 3.3Å; E98-K101 PolarHBondContact O-N 3.18Å; E98-I102 WeakPolarHBondContact O-CD1 3.22Å; E98-I102 VanDerWaalsContact O-CG1 3.3Å; E98-I102 WeakPolarHBondContact O-CG1 3.24Å; E98-I102 PolarHBondContact O-N 2.93Å
99L98.6Very high98.4Very high1 Ų157.9 Ų57.91%0.00528%0.284CS..Hα-helixtrans-57.6-48.2174.1-79.4170.7000111.7I59 R62 R63 W66 I95 K101 I102 C103 F141I59-L99 HydrophobicContact CD1-CD2 3.55Å; I59-L99 HydrophobicContact CG1-CD2 4.27Å; R62-L99 HydrophobicContact CB-CD2 3.6Å; R62-L99 HydrophobicContact CB-CG 4.09Å; R63-L99 HydrophobicContact CB-CD2 4.48Å; R63-L99 HydrophobicContact CG-CD2 3.58Å; W66-L99 HydrophobicContact CB-CD1 3.76Å; W66-L99 HydrophobicContact CG-CD1 3.91Å; I95-L99 HydrophobicContact CG2-CD1 4.27Å; I95-L99 HydrophobicContact CG2-CG 4.45Å; I95-L99 WeakPolarHBondContact O-CB 3.46Å; I95-L99 WeakPolarHBondContact O-CG 3.25Å; I95-L99 PolarHBondContact O-N 3.14Å; L99-K101 VanDerWaalsContact C-N 3.32Å; L99-K101 PolarHBondContact O-N 3.34Å; L99-I102 PolarHBondContact O-N 3.22Å; L99-C103 PolarHBondContact O-N 3.43Å; L99-C103 PolarHBondContact O-SG 3.44Å; L99-C103 VanDerWaalsContact O-SG 3.4Å; L99-F141 HydrophobicContact CB-CE1 3.73Å; L99-F141 HydrophobicContact CB-CZ 3.7Å; L99-F141 HydrophobicContact CD1-CD1 4.01Å; L99-F141 HydrophobicContact CD1-CE1 3.98Å; L99-F141 HydrophobicContact CG-CE1 4.43Å
100T98.7Very high98.4Very high24 Ų2454 Ų5415%0.14727%0.267CS..Hα-helixtrans-57.9-47.3178.4-57.50000110.4E96 T97 E98 I102 C103 D104 L138 F141 K142E96-T100 WeakPolarHBondContact O-CB 3.25Å; E96-T100 PolarHBondContact O-N 3.44Å; E96-T100 PolarHBondContact O-OG1 3.48Å; T97-T100 PolarHBondContact O-N 3.29Å; E98-T100 PolarHBondContact O-N 3.3Å; T100-I102 VanDerWaalsContact C-N 3.33Å; T100-I102 PolarHBondContact O-N 3.22Å; T100-C103 PolarHBondContact O-N 2.9Å; T100-D104 WeakPolarHBondContact O-CB 3.37Å; T100-D104 VanDerWaalsContact O-CG 3.22Å; T100-D104 PolarHBondContact O-N 3.19Å; T100-L138 HydrophobicContact CG2-CD2 4.34Å; T100-F141 WeakPolarHBondContact OG1-CE2 3.39Å; T100-F141 WeakPolarHBondContact OG1-CZ 3.42Å; T100-K142 WeakPolarHBondContact OG1-CE 3.39Å
101K98.6Very high98.4Very high164 Ų16452.9 Ų52.971%0.71326%0.258SS*.Hα-helixtrans-59.4-41.5178.1-176.2-178176.1-172.90112.7T97 E98 L99 G105T97-K101 PolarHBondContact O-N 2.89Å; E98-K101 PolarHBondContact O-N 3.18Å; L99-K101 VanDerWaalsContact C-N 3.32Å; L99-K101 PolarHBondContact O-N 3.34Å; K101-G105 PolarHBondContact O-N 3.17Å; K101-G105 VanDerWaalsContact O-N 3.1Å
102I98.5Very high98.2Very high25 Ų2549.6 Ų49.613%0.12825%0.254CS..Hα-helixtrans-65.1-47.9178.1-64.2156.5000110.1Y55 V58 I59 R62 E98 L99 T100 G105 I106Y55-I102 HydrophobicContact CD1-CG2 4.04Å; Y55-I102 HydrophobicContact CE1-CG2 4.45Å; V58-I102 HydrophobicContact CG1-CD1 3.71Å; V58-I102 HydrophobicContact CG1-CG1 3.86Å; V58-I102 HydrophobicContact CG1-CG2 3.92Å; I59-I102 HydrophobicContact CB-CG2 4.17Å; I59-I102 HydrophobicContact CD1-CB 3.89Å; I59-I102 HydrophobicContact CD1-CD1 4.37Å; I59-I102 HydrophobicContact CD1-CG2 3.64Å; I59-I102 HydrophobicContact CG1-CG2 4.46Å; R62-I102 HydrophobicContact CB-CD1 4.18Å; R62-I102 HydrophobicContact CG-CD1 3.91Å; E98-I102 WeakPolarHBondContact O-CD1 3.22Å; E98-I102 VanDerWaalsContact O-CG1 3.3Å; E98-I102 WeakPolarHBondContact O-CG1 3.24Å; E98-I102 PolarHBondContact O-N 2.93Å; L99-I102 PolarHBondContact O-N 3.22Å; T100-I102 VanDerWaalsContact C-N 3.33Å; T100-I102 PolarHBondContact O-N 3.22Å; I102-G105 PolarHBondContact O-N 3.44Å; I102-I106 PolarHBondContact O-N 2.64Å
103C98.7Very high98.1Very high0 Ų049 Ų490%025%0.253CS..Hα-helixtrans-59.8-48.9177.6-68.70000111.5L99 T100 G105 I106 L107 Y134 L138L99-C103 PolarHBondContact O-N 3.43Å; L99-C103 PolarHBondContact O-SG 3.44Å; L99-C103 VanDerWaalsContact O-SG 3.4Å; T100-C103 PolarHBondContact O-N 2.9Å; C103-G105 VanDerWaalsContact C-N 3.26Å; C103-G105 PolarHBondContact O-N 2.87Å; C103-I106 VanDerWaalsContact O-CG2 3.26Å; C103-I106 WeakPolarHBondContact O-CG2 3.49Å; C103-I106 PolarHBondContact O-N 3.38Å; C103-L107 HydrophobicContact CB-CD1 4.39Å; C103-L107 VanDerWaalsContact O-CB 3.27Å; C103-L107 WeakPolarHBondContact O-CB 3.43Å; C103-L107 WeakPolarHBondContact O-CG 3.28Å; C103-L107 PolarHBondContact O-N 2.97Å; C103-Y134 HydrophobicContact CB-CD1 4.36Å; C103-L138 HydrophobicContact CB-CD1 4.08Å; C103-L138 HydrophobicContact CB-CD2 3.73Å; C103-L138 HydrophobicContact CB-CG 3.8Å
104D98.4Very high98Very high84 Ų8447.8 Ų47.845%0.44924%0.241SC..Hα-helixtrans-61.2-36.5-179-69.4-13.2000112T100 K108T100-D104 WeakPolarHBondContact O-CB 3.37Å; T100-D104 VanDerWaalsContact O-CG 3.22Å; T100-D104 PolarHBondContact O-N 3.19Å; D104-K108 WeakPolarHBondContact O-CB 3.34Å; D104-K108 PolarHBondContact O-N 2.88Å
105G97.6Very high97.9Very high24 Ų2444 Ų4425%0.24723%0.228CC..Hα-helixtrans-58.4-55176.500000112.6K101 I102 C103 L109K101-G105 PolarHBondContact O-N 3.17Å; K101-G105 VanDerWaalsContact O-N 3.1Å; I102-G105 PolarHBondContact O-N 3.44Å; C103-G105 VanDerWaalsContact C-N 3.26Å; C103-G105 PolarHBondContact O-N 2.87Å; G105-L109 PolarHBondContact O-N 3.35Å
106I98.4Very high97.8Very high0 Ų048.1 Ų48.10%026%0.255CS..Hα-helixtrans-72-37.3179.9-174.556.5000112.3L51 Y55 I102 C103 K108 L109 L110 M130 Y134L51-I106 HydrophobicContact CD2-CD1 4.36Å; Y55-I106 HydrophobicContact CD1-CB 3.88Å; Y55-I106 HydrophobicContact CD1-CG2 4.28Å; Y55-I106 HydrophobicContact CD2-CB 4.47Å; Y55-I106 HydrophobicContact CD2-CD1 3.97Å; Y55-I106 HydrophobicContact CD2-CG1 4.38Å; Y55-I106 HydrophobicContact CE1-CB 3.63Å; Y55-I106 HydrophobicContact CE1-CG2 4.3Å; Y55-I106 HydrophobicContact CE2-CB 4.23Å; Y55-I106 HydrophobicContact CE2-CD1 3.77Å; Y55-I106 HydrophobicContact CE2-CG1 4.38Å; Y55-I106 HydrophobicContact CG-CB 4.28Å; Y55-I106 HydrophobicContact CG-CD1 4.5Å; Y55-I106 HydrophobicContact CG-CG1 4.42Å; I102-I106 PolarHBondContact O-N 2.64Å; C103-I106 VanDerWaalsContact O-CG2 3.26Å; C103-I106 WeakPolarHBondContact O-CG2 3.49Å; C103-I106 PolarHBondContact O-N 3.38Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 3.35Å; I106-L109 HydrophobicContact CD1-CB 4.45Å; I106-L109 HydrophobicContact CD1-CD2 4.01Å; I106-L109 WeakPolarHBondContact O-CB 3.35Å; I106-L109 PolarHBondContact O-N 3.09Å; I106-L109 VanDerWaalsContact O-N 3.17Å; I106-L110 HydrophobicContact CD1-CD1 4.38Å; I106-L110 HydrophobicContact CD1-CG 4.14Å; I106-L110 HydrophobicContact CG1-CD1 3.87Å; I106-L110 HydrophobicContact CG1-CG 4.16Å; I106-L110 WeakPolarHBondContact O-CB 3.23Å; I106-L110 VanDerWaalsContact O-CG 3.22Å; I106-L110 WeakPolarHBondContact O-CG 3.46Å; I106-L110 PolarHBondContact O-N 3.45Å; I106-M130 HydrophobicContact CD1-SD 3.97Å; I106-M130 HydrophobicContact CG1-SD 4Å; I106-Y134 HydrophobicContact CG1-CD2 4.18Å; I106-Y134 HydrophobicContact CG1-CE2 4.08Å; I106-Y134 HydrophobicContact CG2-CD1 3.38Å; I106-Y134 HydrophobicContact CG2-CD2 3.55Å; I106-Y134 HydrophobicContact CG2-CE1 3.68Å; I106-Y134 HydrophobicContact CG2-CE2 3.86Å; I106-Y134 HydrophobicContact CG2-CG 3.35Å
107L98.7Very high97.4Very high5 Ų547.8 Ų47.83%0.02626%0.257CS..Hα-helixtrans-60.9-44.2177.4-72.7173.9000111C103 L109 L110 E111 K131 Y135 L138C103-L107 HydrophobicContact CB-CD1 4.39Å; C103-L107 VanDerWaalsContact O-CB 3.27Å; C103-L107 WeakPolarHBondContact O-CB 3.43Å; C103-L107 WeakPolarHBondContact O-CG 3.28Å; C103-L107 PolarHBondContact O-N 2.97Å; L107-L109 VanDerWaalsContact C-N 3.34Å; L107-L109 PolarHBondContact O-N 3.36Å; L107-L110 PolarHBondContact O-N 3.15Å; L107-E111 WeakPolarHBondContact O-CB 3.4Å; L107-E111 VanDerWaalsContact O-CG 3.32Å; L107-E111 WeakPolarHBondContact O-CG 3.45Å; L107-E111 PolarHBondContact O-N 3.5Å; L107-K131 HydrophobicContact CD2-CG 3.9Å; L107-Y135 HydrophobicContact CD1-CD1 3.95Å; L107-Y135 HydrophobicContact CD1-CD2 4.34Å; L107-Y135 HydrophobicContact CD1-CE1 3.72Å; L107-Y135 HydrophobicContact CD1-CE2 4.12Å; L107-Y135 HydrophobicContact CD1-CG 4.25Å; L107-Y135 HydrophobicContact CD2-CD2 3.62Å; L107-Y135 HydrophobicContact CD2-CE2 3.47Å; L107-Y135 VanDerWaalsContact CD2-CE2 3.47Å; L107-Y135 HydrophobicContact CD2-CG 4.23Å; L107-Y135 HydrophobicContact CG-CE2 4.37Å; L107-L138 HydrophobicContact CD1-CD1 3.82Å
108K98.1Very high97.1Very high152 Ų15243.4 Ų43.466%0.66123%0.23SC*.Hα-helixtrans-60.3-43.6174.3-177.6178.4179.6179.70111.9D104 I106 E111 S112D104-K108 WeakPolarHBondContact O-CB 3.34Å; D104-K108 PolarHBondContact O-N 2.88Å; I106-K108 VanDerWaalsContact C-N 3.33Å; I106-K108 PolarHBondContact O-N 3.35Å; K108-E111 PolarHBondContact O-N 2.95Å; K108-S112 WeakPolarHBondContact O-CB 3.33Å; K108-S112 PolarHBondContact O-N 3.48Å; K108-S112 PolarHBondContact O-OG 3.32Å
109L97.4Very high96.8Very high5 Ų544.9 Ų44.93%0.02624%0.244CC..Hα-helixtrans-64.6-41.4179.3-169.571.8000111.9E32 A35 K36 L51 G105 I106 L107 H113 L114E32-L109 HydrophobicContact CG-CD2 4.41Å; A35-L109 HydrophobicContact CB-CD1 3.67Å; A35-L109 HydrophobicContact CB-CD2 3.53Å; A35-L109 HydrophobicContact CB-CG 3.83Å; K36-L109 HydrophobicContact CG-CD1 4.09Å; L51-L109 HydrophobicContact CD1-CD2 4.05Å; L51-L109 HydrophobicContact CD2-CD2 4.27Å; G105-L109 PolarHBondContact O-N 3.35Å; I106-L109 HydrophobicContact CD1-CB 4.45Å; I106-L109 HydrophobicContact CD1-CD2 4.01Å; I106-L109 WeakPolarHBondContact O-CB 3.35Å; I106-L109 PolarHBondContact O-N 3.09Å; I106-L109 VanDerWaalsContact O-N 3.17Å; L107-L109 VanDerWaalsContact C-N 3.34Å; L107-L109 PolarHBondContact O-N 3.36Å; L109-H113 WeakPolarHBondContact O-CB 3.38Å; L109-H113 PolarHBondContact O-N 3.43Å; L109-L114 HydrophobicContact CD2-CD1 3.97Å; L109-L114 HydrophobicContact CG-CD1 3.91Å; L109-L114 HydrophobicContact CG-CG 4.28Å; L109-L114 PolarHBondContact O-N 3.18Å; L109-L114 VanDerWaalsContact O-N 3.11Å
110L98.2Very high96.6Very high0 Ų046.8 Ų46.80%026%0.26CS..Iπ-helixtrans-62-45.9175.6-71.7165.1000111.5I106 L107 L114 V115 Y127 M130 K131I106-L110 HydrophobicContact CD1-CD1 4.38Å; I106-L110 HydrophobicContact CD1-CG 4.14Å; I106-L110 HydrophobicContact CG1-CD1 3.87Å; I106-L110 HydrophobicContact CG1-CG 4.16Å; I106-L110 WeakPolarHBondContact O-CB 3.23Å; I106-L110 VanDerWaalsContact O-CG 3.22Å; I106-L110 WeakPolarHBondContact O-CG 3.46Å; I106-L110 PolarHBondContact O-N 3.45Å; L107-L110 PolarHBondContact O-N 3.15Å; L110-L114 HydrophobicContact CD2-CB 4.25Å; L110-L114 HydrophobicContact CD2-CD1 3.88Å; L110-L114 HydrophobicContact CG-CD1 4.38Å; L110-V115 HydrophobicContact CB-CG2 4.35Å; L110-V115 VanDerWaalsContact O-CB 3.27Å; L110-V115 WeakPolarHBondContact O-CB 3.34Å; L110-V115 WeakPolarHBondContact O-CG2 3.43Å; L110-V115 PolarHBondContact O-N 3.17Å; L110-Y127 HydrophobicContact CD2-CD1 3.69Å; L110-Y127 HydrophobicContact CD2-CG 4.05Å; L110-M130 HydrophobicContact CD1-CB 4.33Å; L110-M130 HydrophobicContact CD1-CG 4.08Å; L110-M130 HydrophobicContact CD1-SD 4.41Å; L110-M130 HydrophobicContact CD2-CB 4.43Å; L110-M130 HydrophobicContact CD2-SD 4.19Å; L110-K131 HydrophobicContact CD1-CB 3.98Å
111E97.4Very high96.5Very high90 Ų9047.8 Ų47.842%0.42127%0.267SS..Iπ-helixtrans-72.1-40.1-177.2-72.4-176.5161.500113.8L107 K108 P116 K131 Y135L107-E111 WeakPolarHBondContact O-CB 3.4Å; L107-E111 VanDerWaalsContact O-CG 3.32Å; L107-E111 WeakPolarHBondContact O-CG 3.45Å; L107-E111 PolarHBondContact O-N 3.5Å; K108-E111 PolarHBondContact O-N 2.95Å; E111-P116 WeakPolarHBondContact O-CD 3.47Å; E111-P116 VanDerWaalsContact O-CG 3.25Å; E111-P116 WeakPolarHBondContact O-CG 3.34Å; E111-K131 WeakPolarHBondContact OE1-CE 3.45Å; E111-K131 IonicContact OE1-NZ 3.33Å; E111-K131 PolarHBondContact OE1-NZ 3.33Å; E111-Y135 PolarHBondContact OE1-OH 2.76Å
112S95.8Very high96.4Very high58 Ų5842.9 Ų42.941%0.40625%0.246SC..Iπ-helixtrans-88.3-26.2-173.457.20000114K108K108-S112 WeakPolarHBondContact O-CB 3.33Å; K108-S112 PolarHBondContact O-N 3.48Å; K108-S112 PolarHBondContact O-OG 3.32Å
113H95.7Very high96.3Very high43 Ų4342.2 Ų42.220%0.19924%0.244CC..Iπ-helixtrans-129.3-62.5-169.5-61.4-26.4000111.6V38 L109 P116 S117V38-H113 HydrophobicContact CG2-CB 3.67Å; L109-H113 WeakPolarHBondContact O-CB 3.38Å; L109-H113 PolarHBondContact O-N 3.43Å; H113-P116 WeakPolarHBondContact O-CD 3.34Å; H113-S117 WeakPolarHBondContact O-CB 3.5Å; H113-S117 PolarHBondContact O-N 3.31Å; H113-S117 PolarHBondContact O-OG 3.08Å
114L97.1Very high96.3Very high0 Ų045.9 Ų45.90%026%0.26CS..Iπ-helixtrans-73.8-46.6-163.3-57.4168.4000114A35 V38 L43 L51 L109 L110 S117 S118 Y127A35-L114 HydrophobicContact CB-CD2 3.97Å; V38-L114 HydrophobicContact CG1-CD2 4.11Å; L43-L114 HydrophobicContact CD1-CD2 3.6Å; L43-L114 HydrophobicContact CG-CD2 4.02Å; L51-L114 HydrophobicContact CD2-CD1 3.53Å; L109-L114 HydrophobicContact CD2-CD1 3.97Å; L109-L114 HydrophobicContact CG-CD1 3.91Å; L109-L114 HydrophobicContact CG-CG 4.28Å; L109-L114 PolarHBondContact O-N 3.18Å; L109-L114 VanDerWaalsContact O-N 3.11Å; L110-L114 HydrophobicContact CD2-CB 4.25Å; L110-L114 HydrophobicContact CD2-CD1 3.88Å; L110-L114 HydrophobicContact CG-CD1 4.38Å; L114-S117 PolarHBondContact O-OG 3.44Å; L114-S118 WeakPolarHBondContact O-CB 3.29Å; L114-S118 PolarHBondContact O-N 3.41Å; L114-S118 PolarHBondContact O-OG 2.88Å; L114-Y127 HydrophobicContact CB-CD1 3.93Å; L114-Y127 HydrophobicContact CB-CD2 4.15Å; L114-Y127 HydrophobicContact CB-CE1 4Å; L114-Y127 HydrophobicContact CB-CE2 4.21Å; L114-Y127 HydrophobicContact CB-CG 4.02Å; L114-Y127 HydrophobicContact CD1-CD1 4.1Å; L114-Y127 HydrophobicContact CD1-CE1 3.96Å; L114-Y127 HydrophobicContact CD2-CE1 4.2Å; L114-Y127 HydrophobicContact CG-CE1 4.28Å
115V96.5Very high96.3Very high40 Ų4041.9 Ų41.924%0.24224%0.239CC..Hα-helixtrans-66.7-46.3179.1175.40000110.9L110 S117 S118 L128L110-V115 HydrophobicContact CB-CG2 4.35Å; L110-V115 VanDerWaalsContact O-CB 3.27Å; L110-V115 WeakPolarHBondContact O-CB 3.34Å; L110-V115 WeakPolarHBondContact O-CG2 3.43Å; L110-V115 PolarHBondContact O-N 3.17Å; V115-S117 PolarHBondContact O-N 2.87Å; V115-S118 PolarHBondContact O-N 2.98Å; V115-L128 HydrophobicContact CG1-CD2 4.17Å; V115-L128 HydrophobicContact CG2-CD2 4.45Å
116P94.7Very high96.3Very high91 Ų9142 Ų4259%0.59123%0.233SC*.Hα-helixtrans-63.3-35.6176.8-24.535.1000114.6E111 H113 S118E111-P116 WeakPolarHBondContact O-CD 3.47Å; E111-P116 VanDerWaalsContact O-CG 3.25Å; E111-P116 WeakPolarHBondContact O-CG 3.34Å; H113-P116 WeakPolarHBondContact O-CD 3.34Å; P116-S118 VanDerWaalsContact C-N 3.33Å
117S92Very high96.3Very high27 Ų2742 Ų4219%0.18923%0.233CC..Hα-helixtrans-79.6-14.1-178.272.50000113.7H113 L114 V115 T119H113-S117 WeakPolarHBondContact O-CB 3.5Å; H113-S117 PolarHBondContact O-N 3.31Å; H113-S117 PolarHBondContact O-OG 3.08Å; L114-S117 PolarHBondContact O-OG 3.44Å; V115-S117 PolarHBondContact O-N 2.87Å; S117-T119 PolarHBondContact O-N 3.13Å
118S92.6Very high96.3Very high6 Ų642.9 Ų42.94%0.04224%0.237CC..  trans-74.8121.9-173.4-69.10000112.3L114 V115 P116 K124 Y127L114-S118 WeakPolarHBondContact O-CB 3.29Å; L114-S118 PolarHBondContact O-N 3.41Å; L114-S118 PolarHBondContact O-OG 2.88Å; V115-S118 PolarHBondContact O-N 2.98Å; P116-S118 VanDerWaalsContact C-N 3.33Å; S118-K124 WeakPolarHBondContact O-CE 3.39Å; S118-Y127 WeakPolarHBondContact OG-CD2 3.21Å; S118-Y127 WeakPolarHBondContact OG-CE2 3.31Å
119T91.9Very high96.3Very high104 Ų10437.5 Ų37.564%0.63821%0.214SC*.  trans-98.7-46.5178.557.40000112.1E42 S117 K124E42-T119 PolarHBondContact OE2-N 3.45Å; E42-T119 VanDerWaalsContact OE2-N 3.09Å; E42-T119 PolarHBondContact OE2-OG1 3.35Å; S117-T119 PolarHBondContact O-N 3.13Å; T119-K124 WeakPolarHBondContact O-CE 3.2Å; T119-K124 PolarHBondContact O-NZ 3.13Å
120A94.3Very high96.4Very high40 Ų4037.7 Ų37.733%0.33122%0.215SC..SBendtrans-68.1139.2-178.500000112.2E122 S123 K124A120-E122 PolarHBondContact O-N 3.08Å; A120-S123 PolarHBondContact O-N 3.42Å; A120-K124 WeakPolarHBondContact O-CG 3.33Å; A120-K124 PolarHBondContact O-N 3.1Å; A120-K124 VanDerWaalsContact O-N 3.08Å
121P96.7Very high96.4Very high46 Ų4639.7 Ų39.730%0.29922%0.223SC..Hα-helixtrans-54.2-41.1175.2-27.135000112.9S123 K124 V125 I164 E168P121-S123 PolarHBondContact O-N 2.84Å; P121-K124 PolarHBondContact O-N 3.01Å; P121-V125 VanDerWaalsContact O-CG2 3.32Å; P121-V125 WeakPolarHBondContact O-CG2 3.39Å; P121-V125 PolarHBondContact O-N 3.44Å; P121-I164 HydrophobicContact CB-CG2 4.06Å; P121-E168 HydrophobicContact CB-CB 3.55Å; P121-E168 HydrophobicContact CB-CG 3.88Å; P121-E168 HydrophobicContact CG-CB 4.02Å; P121-E168 HydrophobicContact CG-CG 4.03Å
122E96.1Very high96.5Very high60 Ų6035.4 Ų35.428%0.2820%0.203SC..Hα-helixtrans-59.2-49.1178.4-167.3-164.1131.400112.3R48 A120 K124 V125 F126 L169 H173 I175R48-E122 IonicContact CZ-OE1 2.76Å; R48-E122 VanDerWaalsContact CZ-OE1 3.29Å; R48-E122 IonicContact NH1-OE1 3.29Å; R48-E122 PolarHBondContact NH1-OE1 2.98Å; R48-E122 IonicContact NH2-OE1 3.16Å; R48-E122 PolarHBondContact NH2-OE1 3.28Å; A120-E122 PolarHBondContact O-N 3.08Å; E122-K124 VanDerWaalsContact C-N 3.34Å; E122-K124 PolarHBondContact O-N 3.41Å; E122-V125 PolarHBondContact O-N 3.06Å; E122-F126 WeakPolarHBondContact O-CB 3.43Å; E122-F126 PolarHBondContact O-N 2.88Å; E122-L169 HydrophobicContact CB-CD2 4.38Å; E122-H173 IonicContact OE2-NE2 2.69Å; E122-I175 HydrophobicContact CG-CD1 3.43Å; E122-I175 VanDerWaalsContact CG-CD1 3.43Å; E122-I175 WeakPolarHBondContact OE1-CD1 3.43Å
123S96.5Very high96.6Very high12 Ų1233.2 Ų33.28%0.08419%0.187CC..Hα-helixtrans-58.4-45.2175.6-65.50000111.5E42 A120 P121 F126 Y127E42-S123 VanDerWaalsContact OE1-CB 3.31Å; E42-S123 WeakPolarHBondContact OE1-CB 2.97Å; E42-S123 PolarHBondContact OE1-OG 2.98Å; A120-S123 PolarHBondContact O-N 3.42Å; P121-S123 PolarHBondContact O-N 2.84Å; S123-F126 WeakPolarHBondContact O-CB 3.3Å; S123-F126 PolarHBondContact O-N 2.95Å; S123-Y127 WeakPolarHBondContact O-CD2 3.47Å; S123-Y127 PolarHBondContact O-N 2.71Å
124K97.4Very high96.8Very high77 Ų7731.5 Ų31.534%0.33518%0.179SC..Hα-helixtrans-60.4-49.2178.9-70.2176.5-178.2171.40111.9S118 T119 A120 P121 E122 F126 Y127 L128 I164S118-K124 WeakPolarHBondContact O-CE 3.39Å; T119-K124 WeakPolarHBondContact O-CE 3.2Å; T119-K124 PolarHBondContact O-NZ 3.13Å; A120-K124 WeakPolarHBondContact O-CG 3.33Å; A120-K124 PolarHBondContact O-N 3.1Å; A120-K124 VanDerWaalsContact O-N 3.08Å; P121-K124 PolarHBondContact O-N 3.01Å; E122-K124 VanDerWaalsContact C-N 3.34Å; E122-K124 PolarHBondContact O-N 3.41Å; K124-F126 VanDerWaalsContact C-N 3.3Å; K124-F126 PolarHBondContact O-N 3.34Å; K124-Y127 PolarHBondContact O-N 3.16Å; K124-L128 VanDerWaalsContact O-CB 3.32Å; K124-L128 WeakPolarHBondContact O-CB 3.14Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.25Å; K124-L128 PolarHBondContact O-N 3.44Å; K124-I164 HydrophobicContact CB-CD1 4.09Å; K124-I164 HydrophobicContact CD-CD1 4.45Å
125V98.6Very high96.8Very high0 Ų033 Ų330%019%0.185CC..Hα-helixtrans-61.7-42.5177.9179.30000110.1P121 E122 K129 A161 I164 A165 L169 I175 L179P121-V125 VanDerWaalsContact O-CG2 3.32Å; P121-V125 WeakPolarHBondContact O-CG2 3.39Å; P121-V125 PolarHBondContact O-N 3.44Å; E122-V125 PolarHBondContact O-N 3.06Å; V125-K129 WeakPolarHBondContact O-CB 3.21Å; V125-K129 PolarHBondContact O-N 2.95Å; V125-A161 HydrophobicContact CG1-CB 4.33Å; V125-I164 HydrophobicContact CG2-CB 3.76Å; V125-I164 HydrophobicContact CG2-CG2 3.57Å; V125-A165 HydrophobicContact CG1-CB 3.89Å; V125-A165 HydrophobicContact CG2-CB 3.99Å; V125-L169 HydrophobicContact CB-CD1 4.12Å; V125-L169 HydrophobicContact CG1-CD1 4.14Å; V125-L169 HydrophobicContact CG2-CD1 3.96Å; V125-I175 HydrophobicContact CB-CG2 4.01Å; V125-I175 HydrophobicContact CG1-CG2 3.52Å; V125-L179 HydrophobicContact CG1-CD2 4.18Å
126F98.1Very high96.9Very high26 Ų2631.7 Ų31.711%0.11418%0.175CC..Hα-helixtrans-57.1-52.6177.8-175.2-84.1000112.2R48 E122 S123 K124 K129 M130 I175R48-F126 VanDerWaalsContact CD-CD1 3.48Å; R48-F126 HydrophobicContact CG-CD1 3.54Å; R48-F126 HydrophobicContact CG-CD2 4.45Å; R48-F126 HydrophobicContact CG-CE1 3.3Å; R48-F126 HydrophobicContact CG-CE2 4.23Å; R48-F126 HydrophobicContact CG-CG 4.12Å; R48-F126 HydrophobicContact CG-CZ 3.66Å; E122-F126 WeakPolarHBondContact O-CB 3.43Å; E122-F126 PolarHBondContact O-N 2.88Å; S123-F126 WeakPolarHBondContact O-CB 3.3Å; S123-F126 PolarHBondContact O-N 2.95Å; K124-F126 VanDerWaalsContact C-N 3.3Å; K124-F126 PolarHBondContact O-N 3.34Å; F126-K129 PolarHBondContact O-N 2.74Å; F126-M130 HydrophobicContact CE1-CE 4.11Å; F126-M130 HydrophobicContact CZ-CE 4.46Å; F126-M130 WeakPolarHBondContact O-CB 3.26Å; F126-M130 PolarHBondContact O-N 3.15Å; F126-I175 HydrophobicContact CB-CD1 4.23Å; F126-I175 HydrophobicContact CD2-CD1 3.87Å; F126-I175 HydrophobicContact CD2-CG1 4.27Å
127Y98.5Very high97.1Very high0 Ų028.7 Ų28.70%015%0.153CC..Hα-helixtrans-72.8-35.8-177-64.2-53.2000112.9R48 L110 L114 S118 S123 K124 M130 K131R48-Y127 HydrophobicContact CG-CE1 3.91Å; L110-Y127 HydrophobicContact CD2-CD1 3.69Å; L110-Y127 HydrophobicContact CD2-CG 4.05Å; L114-Y127 HydrophobicContact CB-CD1 3.93Å; L114-Y127 HydrophobicContact CB-CD2 4.15Å; L114-Y127 HydrophobicContact CB-CE1 4Å; L114-Y127 HydrophobicContact CB-CE2 4.21Å; L114-Y127 HydrophobicContact CB-CG 4.02Å; L114-Y127 HydrophobicContact CD1-CD1 4.1Å; L114-Y127 HydrophobicContact CD1-CE1 3.96Å; L114-Y127 HydrophobicContact CD2-CE1 4.2Å; L114-Y127 HydrophobicContact CG-CE1 4.28Å; S118-Y127 WeakPolarHBondContact OG-CD2 3.21Å; S118-Y127 WeakPolarHBondContact OG-CE2 3.31Å; S123-Y127 WeakPolarHBondContact O-CD2 3.47Å; S123-Y127 PolarHBondContact O-N 2.71Å; K124-Y127 PolarHBondContact O-N 3.16Å; Y127-M130 PolarHBondContact O-N 3.06Å; Y127-K131 WeakPolarHBondContact O-CB 3.39Å; Y127-K131 PolarHBondContact O-N 3.31Å
128L98.7Very high97.5Very high24 Ų2428 Ų2813%0.12615%0.147CC..Hα-helixtrans-67.6-40.8174.5-71169.2000111.6V115 K124 M130 K131 G132 A160 A161 I164V115-L128 HydrophobicContact CG1-CD2 4.17Å; V115-L128 HydrophobicContact CG2-CD2 4.45Å; K124-L128 VanDerWaalsContact O-CB 3.32Å; K124-L128 WeakPolarHBondContact O-CB 3.14Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.25Å; K124-L128 PolarHBondContact O-N 3.44Å; L128-M130 VanDerWaalsContact C-N 3.33Å; L128-K131 WeakPolarHBondContact O-CB 3.3Å; L128-K131 PolarHBondContact O-N 2.81Å; L128-G132 PolarHBondContact O-N 3.41Å; L128-A160 HydrophobicContact CD1-CB 4.07Å; L128-A160 HydrophobicContact CD2-CB 4.42Å; L128-A161 HydrophobicContact CB-CB 3.69Å; L128-I164 HydrophobicContact CD1-CD1 3.81Å
129K98.6Very high97.7Very high38 Ų3827.8 Ų27.817%0.16515%0.145CC..Hα-helixtrans-58.3-48170.8177.6-170169.2-680110.4V125 F126 K131 G132 D133 Y158 G178 L179 N182V125-K129 WeakPolarHBondContact O-CB 3.21Å; V125-K129 PolarHBondContact O-N 2.95Å; F126-K129 PolarHBondContact O-N 2.74Å; K129-K131 VanDerWaalsContact C-N 3.33Å; K129-K131 PolarHBondContact O-N 3.13Å; K129-G132 PolarHBondContact O-N 3.29Å; K129-D133 IonicContact NZ-OD2 2.78Å; K129-D133 PolarHBondContact NZ-OD2 2.99Å; K129-D133 VanDerWaalsContact O-CG 3.24Å; K129-D133 PolarHBondContact O-N 3.06Å; K129-Y158 HydrophobicContact CG-CE1 4.37Å; K129-Y158 WeakPolarHBondContact O-CE1 3.39Å; K129-G178 WeakPolarHBondContact CE-O 3.15Å; K129-L179 HydrophobicContact CB-CD1 4.1Å; K129-L179 HydrophobicContact CD-CB 4.07Å; K129-L179 HydrophobicContact CG-CB 4.32Å; K129-L179 HydrophobicContact CG-CD1 4.01Å; K129-N182 WeakPolarHBondContact CE-ND2 3.27Å; K129-N182 PolarHBondContact NZ-ND2 3.38Å
130M98.6Very high98Very high9 Ų924.5 Ų24.54%0.04412%0.123CC..Hα-helixtrans-59.5-43.8177.4-172.5179.1-101.700111.2I106 L110 F126 Y127 L128 G132 D133 Y134I106-M130 HydrophobicContact CD1-SD 3.97Å; I106-M130 HydrophobicContact CG1-SD 4Å; L110-M130 HydrophobicContact CD1-CB 4.33Å; L110-M130 HydrophobicContact CD1-CG 4.08Å; L110-M130 HydrophobicContact CD1-SD 4.41Å; L110-M130 HydrophobicContact CD2-CB 4.43Å; L110-M130 HydrophobicContact CD2-SD 4.19Å; F126-M130 HydrophobicContact CE1-CE 4.11Å; F126-M130 HydrophobicContact CZ-CE 4.46Å; F126-M130 WeakPolarHBondContact O-CB 3.26Å; F126-M130 PolarHBondContact O-N 3.15Å; Y127-M130 PolarHBondContact O-N 3.06Å; L128-M130 VanDerWaalsContact C-N 3.33Å; M130-G132 VanDerWaalsContact C-N 3.32Å; M130-G132 PolarHBondContact O-N 3.05Å; M130-D133 WeakPolarHBondContact O-CB 3.5Å; M130-D133 PolarHBondContact O-N 3.33Å; M130-D133 VanDerWaalsContact O-N 3.1Å; M130-Y134 HydrophobicContact CG-CD2 3.81Å; M130-Y134 HydrophobicContact CG-CE2 3.6Å; M130-Y134 VanDerWaalsContact O-CD2 3.25Å; M130-Y134 WeakPolarHBondContact O-CD2 3.47Å; M130-Y134 PolarHBondContact O-N 3Å; M130-Y134 VanDerWaalsContact O-N 3.08Å; M130-Y134 HydrophobicContact SD-CE2 4.33Å
131K98.8Very high98.2Very high42 Ų4223.2 Ų23.218%0.18311%0.11CC..Hα-helixtrans-55.2-47.6174.2-173.1174.8-177.8171.30111.2L107 L110 E111 Y127 L128 K129 D133 Y134 Y135 A157L107-K131 HydrophobicContact CD2-CG 3.9Å; L110-K131 HydrophobicContact CD1-CB 3.98Å; E111-K131 WeakPolarHBondContact OE1-CE 3.45Å; E111-K131 IonicContact OE1-NZ 3.33Å; E111-K131 PolarHBondContact OE1-NZ 3.33Å; Y127-K131 WeakPolarHBondContact O-CB 3.39Å; Y127-K131 PolarHBondContact O-N 3.31Å; L128-K131 WeakPolarHBondContact O-CB 3.3Å; L128-K131 PolarHBondContact O-N 2.81Å; K129-K131 VanDerWaalsContact C-N 3.33Å; K129-K131 PolarHBondContact O-N 3.13Å; K131-D133 PolarHBondContact O-N 3.35Å; K131-Y134 PolarHBondContact O-N 2.68Å; K131-Y135 HydrophobicContact CD-CE2 4.32Å; K131-Y135 VanDerWaalsContact CE-CE2 3.5Å; K131-Y135 HydrophobicContact CG-CD2 3.92Å; K131-Y135 HydrophobicContact CG-CE2 3.78Å; K131-Y135 VanDerWaalsContact O-CD2 3.29Å; K131-Y135 WeakPolarHBondContact O-CD2 3.45Å; K131-Y135 PolarHBondContact O-N 2.89Å; K131-Y135 VanDerWaalsContact O-N 3.13Å; K131-A157 HydrophobicContact CB-CB 4.14Å; K131-A157 HydrophobicContact CD-CB 4.37Å; K131-A157 HydrophobicContact CG-CB 4.09Å
132G98.8Very high98.2Very high0 Ų023 Ų230%010%0.104CC..Hα-helixtrans-60-42.8174.900000112.8L128 K129 M130 Y134 Y135 R136L128-G132 PolarHBondContact O-N 3.41Å; K129-G132 PolarHBondContact O-N 3.29Å; M130-G132 VanDerWaalsContact C-N 3.32Å; M130-G132 PolarHBondContact O-N 3.05Å; G132-Y134 PolarHBondContact O-N 2.86Å; G132-Y135 PolarHBondContact O-N 3.31Å; G132-R136 VanDerWaalsContact O-CB 3.28Å; G132-R136 WeakPolarHBondContact O-CB 3.45Å; G132-R136 PolarHBondContact O-N 3.42Å
133D98.7Very high98.3Very high12 Ų1225.1 Ų25.16%0.06412%0.121CC..Hα-helixtrans-58.4-45.3178.1-66.9-27.9000112.1K129 M130 K131 R136 Y137 Y158 N182K129-D133 IonicContact NZ-OD2 2.78Å; K129-D133 PolarHBondContact NZ-OD2 2.99Å; K129-D133 VanDerWaalsContact O-CG 3.24Å; K129-D133 PolarHBondContact O-N 3.06Å; M130-D133 WeakPolarHBondContact O-CB 3.5Å; M130-D133 PolarHBondContact O-N 3.33Å; M130-D133 VanDerWaalsContact O-N 3.1Å; K131-D133 PolarHBondContact O-N 3.35Å; D133-R136 WeakPolarHBondContact O-CB 3.4Å; D133-R136 PolarHBondContact O-N 3.29Å; D133-Y137 HydrophobicContact CB-CE2 4.36Å; D133-Y137 VanDerWaalsContact O-CD1 3.27Å; D133-Y137 WeakPolarHBondContact O-CD1 3.24Å; D133-Y137 VanDerWaalsContact O-CD2 3.26Å; D133-Y137 WeakPolarHBondContact O-CD2 3.25Å; D133-Y137 PolarHBondContact O-N 3.49Å; D133-Y158 WeakPolarHBondContact CA-OH 3.43Å; D133-Y158 PolarHBondContact N-OH 3.25Å; D133-Y158 PolarHBondContact OD1-OH 2.97Å; D133-N182 WeakPolarHBondContact OD1-CB 3.41Å; D133-N182 PolarHBondContact OD1-ND2 3.28Å; D133-N182 PolarHBondContact OD2-ND2 3.13Å
134Y98.8Very high98.3Very high8 Ų827.5 Ų27.53%0.03115%0.147CC..Hα-helixtrans-75.2-35.4-178.7-76.1-83000113.8Y55 I59 C103 I106 M130 K131 G132 R136 Y137 L138Y55-Y134 WeakPolarHBondContact CB-OH 3.45Å; I59-Y134 HydrophobicContact CB-CE1 3.98Å; I59-Y134 HydrophobicContact CD1-CE1 4.34Å; I59-Y134 HydrophobicContact CG1-CD1 4.49Å; I59-Y134 HydrophobicContact CG1-CE1 3.99Å; I59-Y134 HydrophobicContact CG2-CE1 3.99Å; C103-Y134 HydrophobicContact CB-CD1 4.36Å; I106-Y134 HydrophobicContact CG1-CD2 4.18Å; I106-Y134 HydrophobicContact CG1-CE2 4.08Å; I106-Y134 HydrophobicContact CG2-CD1 3.38Å; I106-Y134 HydrophobicContact CG2-CD2 3.55Å; I106-Y134 HydrophobicContact CG2-CE1 3.68Å; I106-Y134 HydrophobicContact CG2-CE2 3.86Å; I106-Y134 HydrophobicContact CG2-CG 3.35Å; M130-Y134 HydrophobicContact CG-CD2 3.81Å; M130-Y134 HydrophobicContact CG-CE2 3.6Å; M130-Y134 VanDerWaalsContact O-CD2 3.25Å; M130-Y134 WeakPolarHBondContact O-CD2 3.47Å; M130-Y134 PolarHBondContact O-N 3Å; M130-Y134 VanDerWaalsContact O-N 3.08Å; M130-Y134 HydrophobicContact SD-CE2 4.33Å; K131-Y134 PolarHBondContact O-N 2.68Å; G132-Y134 PolarHBondContact O-N 2.86Å; Y134-R136 VanDerWaalsContact C-N 3.29Å; Y134-Y137 AromaticContact CD1-CD2 3.86Å; Y134-Y137 HydrophobicContact CD1-CD2 3.86Å; Y134-Y137 HydrophobicContact CD1-CE2 4.24Å; Y134-Y137 HydrophobicContact CE1-CD2 4.13Å; Y134-Y137 HydrophobicContact CE1-CE2 4.17Å; Y134-Y137 HydrophobicContact CG-CD2 4.3Å; Y134-Y137 PolarHBondContact O-N 2.77Å; Y134-L138 PolarHBondContact O-N 3.22Å; Y134-L138 VanDerWaalsContact O-N 3.13Å
135Y98.9Very high98.4Very high31 Ų3127.1 Ų27.112%0.12216%0.159CC..Hα-helixtrans-64.8-36.4169-81.9-63.9000112.1L107 E111 K131 G132 Y137 L138 A139 N153 T154L107-Y135 HydrophobicContact CD1-CD1 3.95Å; L107-Y135 HydrophobicContact CD1-CD2 4.34Å; L107-Y135 HydrophobicContact CD1-CE1 3.72Å; L107-Y135 HydrophobicContact CD1-CE2 4.12Å; L107-Y135 HydrophobicContact CD1-CG 4.25Å; L107-Y135 HydrophobicContact CD2-CD2 3.62Å; L107-Y135 HydrophobicContact CD2-CE2 3.47Å; L107-Y135 VanDerWaalsContact CD2-CE2 3.47Å; L107-Y135 HydrophobicContact CD2-CG 4.23Å; L107-Y135 HydrophobicContact CG-CE2 4.37Å; E111-Y135 PolarHBondContact OE1-OH 2.76Å; K131-Y135 HydrophobicContact CD-CE2 4.32Å; K131-Y135 VanDerWaalsContact CE-CE2 3.5Å; K131-Y135 HydrophobicContact CG-CD2 3.92Å; K131-Y135 HydrophobicContact CG-CE2 3.78Å; K131-Y135 VanDerWaalsContact O-CD2 3.29Å; K131-Y135 WeakPolarHBondContact O-CD2 3.45Å; K131-Y135 PolarHBondContact O-N 2.89Å; K131-Y135 VanDerWaalsContact O-N 3.13Å; G132-Y135 PolarHBondContact O-N 3.31Å; Y135-Y137 VanDerWaalsContact C-N 3.3Å; Y135-Y137 PolarHBondContact O-N 3.17Å; Y135-L138 HydrophobicContact CD1-CD1 4.04Å; Y135-L138 HydrophobicContact CE1-CD1 4.44Å; Y135-L138 WeakPolarHBondContact O-CB 3.39Å; Y135-L138 PolarHBondContact O-N 3.47Å; Y135-L138 VanDerWaalsContact O-N 3.16Å; Y135-A139 PolarHBondContact O-N 2.99Å; Y135-N153 HydrophobicContact CD1-CB 3.58Å; Y135-N153 HydrophobicContact CD2-CB 3.62Å; Y135-N153 HydrophobicContact CE1-CB 3.69Å; Y135-N153 HydrophobicContact CE2-CB 3.72Å; Y135-N153 HydrophobicContact CG-CB 3.55Å; Y135-T154 VanDerWaalsContact CB-OG1 3.24Å; Y135-T154 WeakPolarHBondContact CB-OG1 3.34Å
136R98.7Very high98.4Very high12 Ų1232.1 Ų32.15%0.04518%0.182CC..Hα-helixtrans-61.2-43.6175.5-175.9168.862.289.4-10.5111G132 D133 Y134 L138 A139 E140 T154 Y158 F186 E189 I190G132-R136 VanDerWaalsContact O-CB 3.28Å; G132-R136 WeakPolarHBondContact O-CB 3.45Å; G132-R136 PolarHBondContact O-N 3.42Å; D133-R136 WeakPolarHBondContact O-CB 3.4Å; D133-R136 PolarHBondContact O-N 3.29Å; Y134-R136 VanDerWaalsContact C-N 3.29Å; R136-L138 VanDerWaalsContact C-N 3.3Å; R136-L138 PolarHBondContact O-N 3.23Å; R136-A139 WeakPolarHBondContact O-CB 3.26Å; R136-A139 PolarHBondContact O-N 2.9Å; R136-E140 IonicContact NH1-OE1 2.8Å; R136-E140 PolarHBondContact O-N 2.93Å; R136-E140 VanDerWaalsContact O-N 3.13Å; R136-T154 WeakPolarHBondContact CA-OG1 3.17Å; R136-T154 HydrophobicContact CB-CG2 3.82Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.27Å; R136-Y158 PolarHBondContact NE-OH 3.36Å; R136-Y158 VanDerWaalsContact NE-OH 3.14Å; R136-F186 HydrophobicContact CG-CD2 4.16Å; R136-E189 IonicContact NH1-OE2 3.82Å; R136-I190 HydrophobicContact CG-CG1 3.98Å
137Y98.6Very high98.4Very high29 Ų2936.4 Ų36.411%0.11420%0.198CC..Hα-helixtrans-61.5-38175.9-56.2-25.4000112.2I59 D133 Y134 Y135 A139 E140 F141I59-Y137 HydrophobicContact CG1-CD2 3.77Å; I59-Y137 HydrophobicContact CG1-CE2 4.2Å; I59-Y137 HydrophobicContact CG2-CD2 4.38Å; I59-Y137 HydrophobicContact CG2-CE2 3.97Å; D133-Y137 HydrophobicContact CB-CE2 4.36Å; D133-Y137 VanDerWaalsContact O-CD1 3.27Å; D133-Y137 WeakPolarHBondContact O-CD1 3.24Å; D133-Y137 VanDerWaalsContact O-CD2 3.26Å; D133-Y137 WeakPolarHBondContact O-CD2 3.25Å; D133-Y137 PolarHBondContact O-N 3.49Å; Y134-Y137 AromaticContact CD1-CD2 3.86Å; Y134-Y137 HydrophobicContact CD1-CD2 3.86Å; Y134-Y137 HydrophobicContact CD1-CE2 4.24Å; Y134-Y137 HydrophobicContact CE1-CD2 4.13Å; Y134-Y137 HydrophobicContact CE1-CE2 4.17Å; Y134-Y137 HydrophobicContact CG-CD2 4.3Å; Y134-Y137 PolarHBondContact O-N 2.77Å; Y135-Y137 VanDerWaalsContact C-N 3.3Å; Y135-Y137 PolarHBondContact O-N 3.17Å; Y137-A139 VanDerWaalsContact C-N 3.35Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.39Å; Y137-E140 WeakPolarHBondContact O-CB 3.27Å; Y137-E140 PolarHBondContact O-N 3.05Å; Y137-F141 WeakPolarHBondContact O-CD1 3.28Å; Y137-F141 WeakPolarHBondContact O-CE1 3.46Å
138L98.7Very high98.4Very high13 Ų1342.4 Ų42.47%0.06822%0.224CC..Hα-helixtrans-61.7-43.6171.4-68.6173000111.3T100 C103 L107 Y134 Y135 R136 E140 F141 K142 A150T100-L138 HydrophobicContact CG2-CD2 4.34Å; C103-L138 HydrophobicContact CB-CD1 4.08Å; C103-L138 HydrophobicContact CB-CD2 3.73Å; C103-L138 HydrophobicContact CB-CG 3.8Å; L107-L138 HydrophobicContact CD1-CD1 3.82Å; Y134-L138 PolarHBondContact O-N 3.22Å; Y134-L138 VanDerWaalsContact O-N 3.13Å; Y135-L138 HydrophobicContact CD1-CD1 4.04Å; Y135-L138 HydrophobicContact CE1-CD1 4.44Å; Y135-L138 WeakPolarHBondContact O-CB 3.39Å; Y135-L138 PolarHBondContact O-N 3.47Å; Y135-L138 VanDerWaalsContact O-N 3.16Å; R136-L138 VanDerWaalsContact C-N 3.3Å; R136-L138 PolarHBondContact O-N 3.23Å; L138-E140 PolarHBondContact O-N 2.77Å; L138-F141 HydrophobicContact CD2-CE1 4.23Å; L138-F141 HydrophobicContact CD2-CZ 3.78Å; L138-F141 PolarHBondContact O-N 3.17Å; L138-K142 HydrophobicContact CB-CG 4.35Å; L138-K142 WeakPolarHBondContact O-CB 3.29Å; L138-K142 WeakPolarHBondContact O-CG 3.5Å; L138-K142 PolarHBondContact O-N 3.21Å; L138-A150 HydrophobicContact CB-CB 3.84Å
139A98.6Very high98.4Very high1 Ų145.3 Ų45.31%0.00824%0.239CC..Hα-helixtrans-65.7-18179.900000114.3Y135 R136 Y137 R147 A150 A151 I190Y135-A139 PolarHBondContact O-N 2.99Å; R136-A139 WeakPolarHBondContact O-CB 3.26Å; R136-A139 PolarHBondContact O-N 2.9Å; Y137-A139 VanDerWaalsContact C-N 3.35Å; A139-R147 PolarHBondContact O-NE 2.74Å; A139-A150 HydrophobicContact CB-CB 3.88Å; A139-A151 HydrophobicContact CB-CB 4.42Å; A139-I190 HydrophobicContact CB-CD1 4.37Å; A139-I190 HydrophobicContact CB-CG2 3.88Å
140E97.8Very high98.4Very high35 Ų3543.7 Ų43.716%0.16423%0.233CC..Hα-helixtrans-67.7-38.4176.6-72.6170.3-156.700112.6R63 W66 R67 R136 Y137 L138 I190R63-E140 IonicContact CZ-OE1 3.83Å; R63-E140 IonicContact CZ-OE2 2.64Å; R63-E140 IonicContact NE-OE1 3.34Å; R63-E140 IonicContact NE-OE2 3.59Å; R63-E140 PolarHBondContact NE-OE2 2.93Å; R63-E140 IonicContact NH2-OE1 2.87Å; R63-E140 PolarHBondContact NH2-OE1 3.41Å; R63-E140 IonicContact NH2-OE2 3.66Å; R63-E140 PolarHBondContact NH2-OE2 3.05Å; W66-E140 HydrophobicContact CH2-CB 4.4Å; W66-E140 HydrophobicContact CZ3-CB 4.41Å; R67-E140 IonicContact NH2-OE2 3.41Å; R67-E140 PolarHBondContact NH2-OE2 3.23Å; R136-E140 IonicContact NH1-OE1 2.8Å; R136-E140 PolarHBondContact O-N 2.93Å; R136-E140 VanDerWaalsContact O-N 3.13Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.39Å; Y137-E140 WeakPolarHBondContact O-CB 3.27Å; Y137-E140 PolarHBondContact O-N 3.05Å; L138-E140 PolarHBondContact O-N 2.77Å; E140-I190 HydrophobicContact CG-CD1 3.87Å
141F97.4Very high98.4Very high13 Ų1344.1 Ų44.16%0.05724%0.238CC..Hα-helixtrans-121.2-21.8-170.969-95.4000114.4W66 E96 L99 T100 Y137 L138W66-F141 HydrophobicContact CD2-CB 4.24Å; W66-F141 VanDerWaalsContact CE2-CB 3.41Å; W66-F141 HydrophobicContact CH2-CB 3.95Å; W66-F141 HydrophobicContact CZ2-CB 3.26Å; E96-F141 HydrophobicContact CB-CD2 3.75Å; E96-F141 HydrophobicContact CB-CE2 3.86Å; E96-F141 HydrophobicContact CG-CB 4.28Å; E96-F141 HydrophobicContact CG-CD2 3.59Å; E96-F141 HydrophobicContact CG-CE2 4.21Å; E96-F141 HydrophobicContact CG-CG 4.13Å; L99-F141 HydrophobicContact CB-CE1 3.73Å; L99-F141 HydrophobicContact CB-CZ 3.7Å; L99-F141 HydrophobicContact CD1-CD1 4.01Å; L99-F141 HydrophobicContact CD1-CE1 3.98Å; L99-F141 HydrophobicContact CG-CE1 4.43Å; T100-F141 WeakPolarHBondContact OG1-CE2 3.39Å; T100-F141 WeakPolarHBondContact OG1-CZ 3.42Å; Y137-F141 WeakPolarHBondContact O-CD1 3.28Å; Y137-F141 WeakPolarHBondContact O-CE1 3.46Å; L138-F141 HydrophobicContact CD2-CE1 4.23Å; L138-F141 HydrophobicContact CD2-CZ 3.78Å; L138-F141 PolarHBondContact O-N 3.17Å
142K98.3Very high98.4Very high40 Ų4046.8 Ų46.817%0.17425%0.251CS..  trans-65.6159.9174.2-69-65.9-164.9160.30110.8T100 L138 E146 R147T100-K142 WeakPolarHBondContact OG1-CE 3.39Å; L138-K142 HydrophobicContact CB-CG 4.35Å; L138-K142 WeakPolarHBondContact O-CB 3.29Å; L138-K142 WeakPolarHBondContact O-CG 3.5Å; L138-K142 PolarHBondContact O-N 3.21Å; K142-E146 HydrophobicContact CB-CB 4.04Å; K142-E146 HydrophobicContact CD-CB 4.17Å; K142-E146 WeakPolarHBondContact CD-OE2 3.23Å; K142-E146 HydrophobicContact CG-CB 4.3Å; K142-E146 IonicContact NZ-OE1 3.83Å; K142-E146 PolarHBondContact NZ-OE1 2.77Å; K142-E146 IonicContact NZ-OE2 3.69Å; K142-E146 PolarHBondContact NZ-OE2 3.34Å; K142-R147 HydrophobicContact CB-CB 4.31Å; K142-R147 WeakPolarHBondContact O-CB 3.46Å; K142-R147 WeakPolarHBondContact O-CD 3.42Å
143T97.2Very high98.4Very high105 Ų10549.5 Ų49.564%0.64427%0.266SS*.  trans-129.8167.1-179.963.70000111.5A145 E146 R147T143-A145 PolarHBondContact O-N 2.89Å; T143-E146 PolarHBondContact O-N 3.31Å; T143-R147 PolarHBondContact O-N 3.46Å
144G97.5Very high98.4Very high62 Ų6249 Ų4964%0.63926%0.263SS*.Hα-helixtrans56.4-132.6175.200000114R147 K148G144-R147 PolarHBondContact O-N 3.21Å; G144-K148 PolarHBondContact O-N 2.96Å
145A98.3Very high98.4Very high69 Ų6950.3 Ų50.357%0.5727%0.27SS*.Hα-helixtrans-63.2-42.1-17900000112.4T143 R147 K148 D149T143-A145 PolarHBondContact O-N 2.89Å; A145-R147 VanDerWaalsContact C-N 3.29Å; A145-R147 PolarHBondContact O-N 2.97Å; A145-K148 WeakPolarHBondContact O-CB 3.45Å; A145-K148 PolarHBondContact O-N 3.11Å; A145-K148 VanDerWaalsContact O-N 3.08Å; A145-D149 VanDerWaalsContact O-CG 3.26Å; A145-D149 PolarHBondContact O-N 3.46Å
146E98.1Very high98.4Very high105 Ų10553.5 Ų53.549%0.49129%0.292SS..Hα-helixtrans-60.4-39.6179.9-63.4-175.8114.900111.9K142 T143 A150K142-E146 HydrophobicContact CB-CB 4.04Å; K142-E146 HydrophobicContact CD-CB 4.17Å; K142-E146 WeakPolarHBondContact CD-OE2 3.23Å; K142-E146 HydrophobicContact CG-CB 4.3Å; K142-E146 IonicContact NZ-OE1 3.83Å; K142-E146 PolarHBondContact NZ-OE1 2.77Å; K142-E146 IonicContact NZ-OE2 3.69Å; K142-E146 PolarHBondContact NZ-OE2 3.34Å; T143-E146 PolarHBondContact O-N 3.31Å; E146-A150 VanDerWaalsContact O-CB 3.3Å; E146-A150 WeakPolarHBondContact O-CB 3.5Å; E146-A150 PolarHBondContact O-N 2.89Å
147R98.3Very high98.4Very high117 Ų11753.1 Ų53.144%0.44229%0.291SS..Hα-helixtrans-63.3-44.3175.4-171.4179.2171.6-164.9-6.5111.6A139 K142 T143 G144 A145 A150 A151A139-R147 PolarHBondContact O-NE 2.74Å; K142-R147 HydrophobicContact CB-CB 4.31Å; K142-R147 WeakPolarHBondContact O-CB 3.46Å; K142-R147 WeakPolarHBondContact O-CD 3.42Å; T143-R147 PolarHBondContact O-N 3.46Å; G144-R147 PolarHBondContact O-N 3.21Å; A145-R147 VanDerWaalsContact C-N 3.29Å; A145-R147 PolarHBondContact O-N 2.97Å; R147-A150 PolarHBondContact O-N 3.33Å; R147-A151 WeakPolarHBondContact O-CB 3.2Å; R147-A151 PolarHBondContact O-N 3.14Å
148K98.4Very high98.4Very high126 Ų12651.7 Ų51.755%0.54829%0.286SS..Hα-helixtrans-62.9-48.3-180-178.3-178.6168.9-175.20110.4G144 A145 A150 A151 E152G144-K148 PolarHBondContact O-N 2.96Å; A145-K148 WeakPolarHBondContact O-CB 3.45Å; A145-K148 PolarHBondContact O-N 3.11Å; A145-K148 VanDerWaalsContact O-N 3.08Å; K148-A150 VanDerWaalsContact C-N 3.32Å; K148-A150 PolarHBondContact O-N 2.86Å; K148-A151 PolarHBondContact O-N 3.45Å; K148-E152 WeakPolarHBondContact CE-OE1 3.43Å; K148-E152 IonicContact NZ-OE1 3.77Å; K148-E152 WeakPolarHBondContact O-CG 3.41Å; K148-E152 PolarHBondContact O-N 2.98Å
149D98.6Very high98.4Very high84 Ų8455.9 Ų55.945%0.44930%0.304SS..Hα-helixtrans-61.1-42.2178.8-64.7-13.1000111A145 E152 N153A145-D149 VanDerWaalsContact O-CG 3.26Å; A145-D149 PolarHBondContact O-N 3.46Å; D149-E152 PolarHBondContact O-N 3.35Å; D149-N153 WeakPolarHBondContact O-CB 3.24Å; D149-N153 PolarHBondContact O-N 3.49Å; D149-N153 PolarHBondContact O-ND2 3.3Å
150A98.7Very high98.4Very high5 Ų557.6 Ų57.64%0.04132%0.318CS..Hα-helixtrans-62.7-43.4175.300000112.2L138 A139 E146 R147 K148 N153 T154L138-A150 HydrophobicContact CB-CB 3.84Å; A139-A150 HydrophobicContact CB-CB 3.88Å; E146-A150 VanDerWaalsContact O-CB 3.3Å; E146-A150 WeakPolarHBondContact O-CB 3.5Å; E146-A150 PolarHBondContact O-N 2.89Å; R147-A150 PolarHBondContact O-N 3.33Å; K148-A150 VanDerWaalsContact C-N 3.32Å; K148-A150 PolarHBondContact O-N 2.86Å; A150-N153 PolarHBondContact O-N 3.35Å; A150-T154 WeakPolarHBondContact O-CB 3.43Å; A150-T154 PolarHBondContact O-N 3.36Å; A150-T154 PolarHBondContact O-OG1 2.84Å
151A98.7Very high98.4Very high17 Ų1755.9 Ų55.914%0.1431%0.31CS..Hα-helixtrans-65.7-40.2177.200000112.3A139 R147 K148 T154 M155 F186 I190A139-A151 HydrophobicContact CB-CB 4.42Å; R147-A151 WeakPolarHBondContact O-CB 3.2Å; R147-A151 PolarHBondContact O-N 3.14Å; K148-A151 PolarHBondContact O-N 3.45Å; A151-T154 WeakPolarHBondContact O-CB 3.41Å; A151-T154 PolarHBondContact O-N 2.67Å; A151-M155 PolarHBondContact O-N 2.96Å; A151-F186 HydrophobicContact CB-CE2 4.35Å; A151-F186 HydrophobicContact CB-CZ 4.43Å; A151-F186 WeakPolarHBondContact O-CZ 3.5Å; A151-I190 HydrophobicContact CB-CG2 4.12Å
152E98.7Very high98.5Very high99 Ų9957.2 Ų57.246%0.46332%0.316SS..Hα-helixtrans-64.4-45.8175.9-73178.6-179.300111.4K148 D149 T154 M155 V156K148-E152 WeakPolarHBondContact CE-OE1 3.43Å; K148-E152 IonicContact NZ-OE1 3.77Å; K148-E152 WeakPolarHBondContact O-CG 3.41Å; K148-E152 PolarHBondContact O-N 2.98Å; D149-E152 PolarHBondContact O-N 3.35Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.83Å; E152-M155 WeakPolarHBondContact O-CB 3.4Å; E152-M155 PolarHBondContact O-N 3.04Å; E152-V156 WeakPolarHBondContact O-CG2 3.4Å; E152-V156 PolarHBondContact O-N 3.2Å
153N98.8Very high98.5Very high57 Ų5760.5 Ų60.531%0.30534%0.336SS..Hα-helixtrans-64.4-36.8175.8-79.9-73.5000112.5Y135 D149 A150 V156 A157Y135-N153 HydrophobicContact CD1-CB 3.58Å; Y135-N153 HydrophobicContact CD2-CB 3.62Å; Y135-N153 HydrophobicContact CE1-CB 3.69Å; Y135-N153 HydrophobicContact CE2-CB 3.72Å; Y135-N153 HydrophobicContact CG-CB 3.55Å; D149-N153 WeakPolarHBondContact O-CB 3.24Å; D149-N153 PolarHBondContact O-N 3.49Å; D149-N153 PolarHBondContact O-ND2 3.3Å; A150-N153 PolarHBondContact O-N 3.35Å; N153-V156 PolarHBondContact O-N 3.1Å; N153-A157 WeakPolarHBondContact O-CB 3.47Å; N153-A157 PolarHBondContact O-N 3.01Å
154T98.8Very high98.6Very high0 Ų057.7 Ų57.70%032%0.316CS..Hα-helixtrans-57.9-49.8172.4-57.20000110.8Y135 R136 A150 A151 E152 V156 A157 Y158 F186Y135-T154 VanDerWaalsContact CB-OG1 3.24Å; Y135-T154 WeakPolarHBondContact CB-OG1 3.34Å; R136-T154 WeakPolarHBondContact CA-OG1 3.17Å; R136-T154 HydrophobicContact CB-CG2 3.82Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.27Å; A150-T154 WeakPolarHBondContact O-CB 3.43Å; A150-T154 PolarHBondContact O-N 3.36Å; A150-T154 PolarHBondContact O-OG1 2.84Å; A151-T154 WeakPolarHBondContact O-CB 3.41Å; A151-T154 PolarHBondContact O-N 2.67Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.83Å; T154-V156 PolarHBondContact O-N 3.29Å; T154-A157 PolarHBondContact O-N 2.9Å; T154-Y158 HydrophobicContact CG2-CD2 3.59Å; T154-Y158 HydrophobicContact CG2-CE2 3.37Å; T154-Y158 PolarHBondContact O-N 2.85Å; T154-F186 HydrophobicContact CG2-CB 4.44Å; T154-F186 HydrophobicContact CG2-CD1 4.04Å; T154-F186 HydrophobicContact CG2-CD2 3.4Å; T154-F186 VanDerWaalsContact CG2-CD2 3.4Å; T154-F186 HydrophobicContact CG2-CE1 4.07Å; T154-F186 HydrophobicContact CG2-CE2 3.48Å; T154-F186 VanDerWaalsContact CG2-CE2 3.48Å; T154-F186 HydrophobicContact CG2-CG 3.7Å; T154-F186 HydrophobicContact CG2-CZ 3.82Å
155M98.7Very high98.6Very high36 Ų3654.8 Ų54.818%0.17729%0.286CS..Hα-helixtrans-60.3-46.1179.1-179.363.379.400111.8A151 E152 K159 F183 F186 Y187 L191A151-M155 PolarHBondContact O-N 2.96Å; E152-M155 WeakPolarHBondContact O-CB 3.4Å; E152-M155 PolarHBondContact O-N 3.04Å; M155-K159 HydrophobicContact CG-CD 4.2Å; M155-K159 WeakPolarHBondContact O-CB 3.42Å; M155-K159 WeakPolarHBondContact O-CG 3.14Å; M155-K159 PolarHBondContact O-N 3.14Å; M155-K159 HydrophobicContact SD-CD 3.98Å; M155-K159 VanDerWaalsContact SD-CE 3.53Å; M155-K159 HydrophobicContact SD-CG 4.04Å; M155-F183 HydrophobicContact SD-CE2 3.83Å; M155-F183 HydrophobicContact SD-CZ 3.74Å; M155-F186 HydrophobicContact CB-CE1 4.08Å; M155-F186 HydrophobicContact CB-CZ 4.33Å; M155-F186 HydrophobicContact CE-CE1 3.74Å; M155-F186 HydrophobicContact SD-CE1 4.31Å; M155-Y187 HydrophobicContact CE-CE1 3.75Å; M155-L191 HydrophobicContact CE-CD1 3.39Å
156V98.8Very high98.6Very high98 Ų9855.4 Ų55.459%0.59428%0.279SS*.Hα-helixtrans-60.8-47.7179169.80000110.8E152 N153 T154 A160E152-V156 WeakPolarHBondContact O-CG2 3.4Å; E152-V156 PolarHBondContact O-N 3.2Å; N153-V156 PolarHBondContact O-N 3.1Å; T154-V156 PolarHBondContact O-N 3.29Å; V156-A160 WeakPolarHBondContact O-CB 3.38Å; V156-A160 PolarHBondContact O-N 3.44Å
157A98.8Very high98.6Very high4 Ų454 Ų543%0.03329%0.285CS..Hα-helixtrans-65.1-46.1-178.100000112.3K131 N153 T154 A160 A161K131-A157 HydrophobicContact CB-CB 4.14Å; K131-A157 HydrophobicContact CD-CB 4.37Å; K131-A157 HydrophobicContact CG-CB 4.09Å; N153-A157 WeakPolarHBondContact O-CB 3.47Å; N153-A157 PolarHBondContact O-N 3.01Å; T154-A157 PolarHBondContact O-N 2.9Å; A157-A160 PolarHBondContact O-N 3.5Å; A157-A161 WeakPolarHBondContact O-CB 3.45Å; A157-A161 PolarHBondContact O-N 3.34Å
158Y98.8Very high98.6Very high0 Ų054.2 Ų54.20%029%0.292CS..Hα-helixtrans-68.2-37.6178.6-72.9-33.6000113.3K129 D133 R136 T154 A161 Q162 L179 N182 F183 F186K129-Y158 HydrophobicContact CG-CE1 4.37Å; K129-Y158 WeakPolarHBondContact O-CE1 3.39Å; D133-Y158 WeakPolarHBondContact CA-OH 3.43Å; D133-Y158 PolarHBondContact N-OH 3.25Å; D133-Y158 PolarHBondContact OD1-OH 2.97Å; R136-Y158 PolarHBondContact NE-OH 3.36Å; R136-Y158 VanDerWaalsContact NE-OH 3.14Å; T154-Y158 HydrophobicContact CG2-CD2 3.59Å; T154-Y158 HydrophobicContact CG2-CE2 3.37Å; T154-Y158 PolarHBondContact O-N 2.85Å; Y158-A161 PolarHBondContact O-N 3.34Å; Y158-Q162 VanDerWaalsContact O-CB 3.22Å; Y158-Q162 WeakPolarHBondContact O-CB 3.32Å; Y158-Q162 PolarHBondContact O-N 3.4Å; Y158-L179 HydrophobicContact CD1-CD1 3.55Å; Y158-L179 HydrophobicContact CE1-CD1 4.22Å; Y158-L179 HydrophobicContact CG-CD1 4.23Å; Y158-N182 HydrophobicContact CE1-CB 4.36Å; Y158-F183 HydrophobicContact CD2-CB 4.11Å; Y158-F183 AromaticContact CD2-CD2 3.46Å; Y158-F183 HydrophobicContact CD2-CD2 3.46Å; Y158-F183 VanDerWaalsContact CD2-CD2 3.46Å; Y158-F183 AromaticContact CD2-CE2 3.99Å; Y158-F183 HydrophobicContact CD2-CE2 3.99Å; Y158-F183 AromaticContact CD2-CG 3.9Å; Y158-F183 HydrophobicContact CD2-CG 3.9Å; Y158-F183 HydrophobicContact CE2-CD2 4.35Å; Y158-F183 HydrophobicContact CG-CB 4.2Å; Y158-F183 HydrophobicContact CG-CD1 4.44Å; Y158-F183 AromaticContact CG-CD2 3.93Å; Y158-F183 HydrophobicContact CG-CD2 3.93Å; Y158-F183 HydrophobicContact CG-CE2 4.36Å; Y158-F183 AromaticContact CG-CG 3.97Å; Y158-F183 HydrophobicContact CG-CG 3.97Å; Y158-F186 HydrophobicContact CD2-CB 4.29Å; Y158-F186 HydrophobicContact CD2-CD1 4.27Å; Y158-F186 HydrophobicContact CD2-CG 4.38Å; Y158-F186 HydrophobicContact CE2-CB 3.85Å; Y158-F186 HydrophobicContact CE2-CG 4.21Å
159K98.7Very high98.5Very high101 Ų10149.1 Ų49.144%0.43927%0.27SS..Hα-helixtrans-63-46.6173.9-77.9-172.9168.7-175.20111.8M155 A161 Q162 D163 F183M155-K159 HydrophobicContact CG-CD 4.2Å; M155-K159 WeakPolarHBondContact O-CB 3.42Å; M155-K159 WeakPolarHBondContact O-CG 3.14Å; M155-K159 PolarHBondContact O-N 3.14Å; M155-K159 HydrophobicContact SD-CD 3.98Å; M155-K159 VanDerWaalsContact SD-CE 3.53Å; M155-K159 HydrophobicContact SD-CG 4.04Å; K159-A161 VanDerWaalsContact C-N 3.29Å; K159-A161 PolarHBondContact O-N 3.43Å; K159-Q162 PolarHBondContact O-N 3.47Å; K159-D163 VanDerWaalsContact O-CG 3.28Å; K159-D163 PolarHBondContact O-N 2.91Å; K159-F183 HydrophobicContact CG-CE1 4.25Å; K159-F183 HydrophobicContact CG-CZ 3.92Å
160A98.6Very high98.3Very high36 Ų3647.3 Ų47.330%0.29827%0.267SS..Hα-helixtrans-60.1-40.3176.500000112.1L128 V156 A157 I164L128-A160 HydrophobicContact CD1-CB 4.07Å; L128-A160 HydrophobicContact CD2-CB 4.42Å; V156-A160 WeakPolarHBondContact O-CB 3.38Å; V156-A160 PolarHBondContact O-N 3.44Å; A157-A160 PolarHBondContact O-N 3.5Å; A160-I164 WeakPolarHBondContact O-CG1 3.41Å; A160-I164 PolarHBondContact O-N 3.26Å
161A98.8Very high98.2Very high0 Ų047.9 Ų47.90%027%0.27CS..Hα-helixtrans-64.6-40.9173.600000111.8V125 L128 A157 Y158 K159 A165 L179V125-A161 HydrophobicContact CG1-CB 4.33Å; L128-A161 HydrophobicContact CB-CB 3.69Å; A157-A161 WeakPolarHBondContact O-CB 3.45Å; A157-A161 PolarHBondContact O-N 3.34Å; Y158-A161 PolarHBondContact O-N 3.34Å; K159-A161 VanDerWaalsContact C-N 3.29Å; K159-A161 PolarHBondContact O-N 3.43Å; A161-A165 VanDerWaalsContact O-CB 3.24Å; A161-A165 WeakPolarHBondContact O-CB 3.4Å; A161-A165 PolarHBondContact O-N 3.4Å; A161-L179 VanDerWaalsContact C-CD2 3.46Å; A161-L179 HydrophobicContact CB-CD1 3.86Å; A161-L179 HydrophobicContact CB-CD2 3.61Å; A161-L179 HydrophobicContact CB-CG 4.4Å
162Q98.6Very high98.1Very high41 Ų4147.5 Ų47.519%0.19227%0.266CS..Hα-helixtrans-68.3-43.2-176.6-179.817255.600111.3Y158 K159 I164 A165 L166 L179Y158-Q162 VanDerWaalsContact O-CB 3.22Å; Y158-Q162 WeakPolarHBondContact O-CB 3.32Å; Y158-Q162 PolarHBondContact O-N 3.4Å; K159-Q162 PolarHBondContact O-N 3.47Å; Q162-I164 VanDerWaalsContact C-N 3.3Å; Q162-I164 PolarHBondContact O-N 2.88Å; Q162-A165 PolarHBondContact O-N 3.12Å; Q162-L166 HydrophobicContact CG-CD1 3.79Å; Q162-L166 HydrophobicContact CG-CG 4.05Å; Q162-L166 WeakPolarHBondContact O-CB 3.27Å; Q162-L166 VanDerWaalsContact O-CG 3.27Å; Q162-L166 WeakPolarHBondContact O-CG 3.4Å; Q162-L166 PolarHBondContact O-N 2.92Å; Q162-L179 HydrophobicContact CB-CD2 4.05Å
163D98.5Very high97.9Very high109 Ų10944.9 Ų44.958%0.58325%0.254SS*.Hα-helixtrans-58.3-44.1178.6-67.4-20.8000111.2K159 A167K159-D163 VanDerWaalsContact O-CG 3.28Å; K159-D163 PolarHBondContact O-N 2.91Å; D163-A167 PolarHBondContact O-N 3.48Å
164I98.6Very high97.8Very high46 Ų4643.3 Ų43.324%0.23625%0.247CC..Hα-helixtrans-69.6-44.1176.3-58.1169000110.6P121 K124 V125 L128 A160 Q162 L166 A167 E168P121-I164 HydrophobicContact CB-CG2 4.06Å; K124-I164 HydrophobicContact CB-CD1 4.09Å; K124-I164 HydrophobicContact CD-CD1 4.45Å; V125-I164 HydrophobicContact CG2-CB 3.76Å; V125-I164 HydrophobicContact CG2-CG2 3.57Å; L128-I164 HydrophobicContact CD1-CD1 3.81Å; A160-I164 WeakPolarHBondContact O-CG1 3.41Å; A160-I164 PolarHBondContact O-N 3.26Å; Q162-I164 VanDerWaalsContact C-N 3.3Å; Q162-I164 PolarHBondContact O-N 2.88Å; I164-L166 PolarHBondContact O-N 2.83Å; I164-A167 PolarHBondContact O-N 3.29Å; I164-E168 HydrophobicContact CG2-CB 4.45Å; I164-E168 HydrophobicContact CG2-CG 4.17Å; I164-E168 WeakPolarHBondContact O-CB 3.45Å; I164-E168 PolarHBondContact O-N 3.41Å
165A98.6Very high97.7Very high1 Ų144.3 Ų44.31%0.00825%0.252CS..Hα-helixtrans-63.9-40.1-177.100000112.8V125 A161 Q162 A167 L169 R176 L179V125-A165 HydrophobicContact CG1-CB 3.89Å; V125-A165 HydrophobicContact CG2-CB 3.99Å; A161-A165 VanDerWaalsContact O-CB 3.24Å; A161-A165 WeakPolarHBondContact O-CB 3.4Å; A161-A165 PolarHBondContact O-N 3.4Å; Q162-A165 PolarHBondContact O-N 3.12Å; A165-A167 VanDerWaalsContact C-N 3.29Å; A165-A167 PolarHBondContact O-N 2.86Å; A165-L169 HydrophobicContact CB-CD1 4.19Å; A165-L169 WeakPolarHBondContact O-CB 3.15Å; A165-L169 PolarHBondContact O-N 3.29Å; A165-L169 VanDerWaalsContact O-O 3.09Å; A165-R176 HydrophobicContact CB-CB 4.29Å; A165-R176 HydrophobicContact CB-CG 4.13Å; A165-L179 HydrophobicContact CB-CD2 4.08Å
166L97.9Very high97.7Very high82 Ų8244.1 Ų44.143%0.42925%0.249SC..Hα-helixtrans-67.2-32.2177.8-69.7177.8000112.2Q162 I164 R176Q162-L166 HydrophobicContact CG-CD1 3.79Å; Q162-L166 HydrophobicContact CG-CG 4.05Å; Q162-L166 WeakPolarHBondContact O-CB 3.27Å; Q162-L166 VanDerWaalsContact O-CG 3.27Å; Q162-L166 WeakPolarHBondContact O-CG 3.4Å; Q162-L166 PolarHBondContact O-N 2.92Å; I164-L166 PolarHBondContact O-N 2.83Å; L166-R176 VanDerWaalsContact CD2-NH2 3.31Å
167A97.9Very high97.7Very high74 Ų7439.5 Ų39.561%0.61222%0.221SC*.Hα-helixtrans-83-37.9-179.700000113.4D163 I164 A165D163-A167 PolarHBondContact O-N 3.48Å; I164-A167 PolarHBondContact O-N 3.29Å; A165-A167 VanDerWaalsContact C-N 3.29Å; A165-A167 PolarHBondContact O-N 2.86Å
168E97.9Very high97.6Very high123 Ų12339.8 Ų39.858%0.57523%0.225SC*.Hα-helixtrans-117.5-14.5-163.3-58-67.9151.300114.2P121 I164P121-E168 HydrophobicContact CB-CB 3.55Å; P121-E168 HydrophobicContact CB-CG 3.88Å; P121-E168 HydrophobicContact CG-CB 4.02Å; P121-E168 HydrophobicContact CG-CG 4.03Å; I164-E168 HydrophobicContact CG2-CB 4.45Å; I164-E168 HydrophobicContact CG2-CG 4.17Å; I164-E168 WeakPolarHBondContact O-CB 3.45Å; I164-E168 PolarHBondContact O-N 3.41Å
169L96.5Very high97.6Very high18 Ų1840 Ų409%0.09423%0.225CC..SBendtrans-118.3137.1-177-54.3-178.6000111.2E122 V125 A165 H173 I175 R176E122-L169 HydrophobicContact CB-CD2 4.38Å; V125-L169 HydrophobicContact CB-CD1 4.12Å; V125-L169 HydrophobicContact CG1-CD1 4.14Å; V125-L169 HydrophobicContact CG2-CD1 3.96Å; A165-L169 HydrophobicContact CB-CD1 4.19Å; A165-L169 WeakPolarHBondContact O-CB 3.15Å; A165-L169 PolarHBondContact O-N 3.29Å; A165-L169 VanDerWaalsContact O-O 3.09Å; L169-H173 HydrophobicContact CB-CB 4.1Å; L169-I175 HydrophobicContact CD1-CG2 4.32Å; L169-R176 HydrophobicContact CB-CB 4.22Å; L169-R176 HydrophobicContact CD1-CB 4.35Å; L169-R176 WeakPolarHBondContact O-CD 3.19Å; L169-R176 PolarHBondContact O-NH1 2.68Å
170A95.7Very high97.6Very high47 Ų4735.6 Ų35.639%0.38821%0.208SC..  trans-58.8147.2174.700000111.4T172 H173 R176A170-T172 PolarHBondContact O-N 2.96Å; A170-T172 VanDerWaalsContact O-N 3.11Å; A170-H173 WeakPolarHBondContact O-CB 3.07Å; A170-H173 PolarHBondContact O-N 3.34Å; A170-R176 WeakPolarHBondContact O-CD 3.44Å
171P96.7Very high97.6Very high17 Ų1734.8 Ų34.811%0.1120%0.198CC..THydrogen-bonded Turntrans-51.2-32.2175.5-29.536.1000114.9H173 L177 E207 E211P171-H173 VanDerWaalsContact C-N 3.33Å; P171-L177 WeakPolarHBondContact O-CG 3.41Å; P171-E207 HydrophobicContact CB-CB 3.98Å; P171-E211 WeakPolarHBondContact CD-OE2 3.2Å
172T95.8Very high97.6Very high8 Ų836 Ų365%0.04921%0.205CC..THydrogen-bonded Turntrans-83.4-4.2178.354.90000113.8A170 A208 E211 L215 S223A170-T172 PolarHBondContact O-N 2.96Å; A170-T172 VanDerWaalsContact O-N 3.11Å; T172-A208 HydrophobicContact CG2-CB 4.36Å; T172-A208 WeakPolarHBondContact CG2-O 3.42Å; T172-E211 HydrophobicContact CG2-CB 3.87Å; T172-L215 HydrophobicContact CG2-CD1 4.33Å; T172-L215 HydrophobicContact CG2-CG 4.13Å; T172-S223 WeakPolarHBondContact O-CB 3.43Å; T172-S223 PolarHBondContact O-OG 3.39Å
173H95.4Very high97.6Very high44 Ų4434.1 Ų34.120%0.20420%0.196CC..  trans-66.7127.7-176.4-168.9-68.8000111.4E122 L169 A170 P171 I175 R176 L177E122-H173 IonicContact OE2-NE2 2.69Å; L169-H173 HydrophobicContact CB-CB 4.1Å; A170-H173 WeakPolarHBondContact O-CB 3.07Å; A170-H173 PolarHBondContact O-N 3.34Å; P171-H173 VanDerWaalsContact C-N 3.33Å; H173-I175 VanDerWaalsContact C-N 3.3Å; H173-I175 PolarHBondContact ND1-N 3.35Å; H173-I175 PolarHBondContact O-N 3.21Å; H173-I175 VanDerWaalsContact O-N 3.14Å; H173-R176 HydrophobicContact CB-CB 4.28Å; H173-R176 PolarHBondContact O-N 3.49Å; H173-L177 PolarHBondContact O-N 3.45Å
174P95.9Very high97.6Very high24 Ų2428.9 Ų28.916%0.15617%0.168CC..Hα-helixtrans-54-40.4-174.8-27.431000114.5G178 D222 S223 I226P174-G178 PolarHBondContact O-N 2.97Å; P174-D222 HydrophobicContact CB-CB 4.23Å; P174-D222 HydrophobicContact CG-CB 4.14Å; P174-S223 WeakPolarHBondContact CG-OG 3.49Å; P174-I226 HydrophobicContact CB-CD1 4.11Å; P174-I226 WeakPolarHBondContact O-CD1 3.16Å
175I97Very high97.6Very high21 Ų2127.6 Ų27.611%0.10816%0.162CC..Hα-helixtrans-66.2-39.6177.7-68.6170.8000112.5E122 V125 F126 L169 H173 G178 L179E122-I175 HydrophobicContact CG-CD1 3.43Å; E122-I175 VanDerWaalsContact CG-CD1 3.43Å; E122-I175 WeakPolarHBondContact OE1-CD1 3.43Å; V125-I175 HydrophobicContact CB-CG2 4.01Å; V125-I175 HydrophobicContact CG1-CG2 3.52Å; F126-I175 HydrophobicContact CB-CD1 4.23Å; F126-I175 HydrophobicContact CD2-CD1 3.87Å; F126-I175 HydrophobicContact CD2-CG1 4.27Å; L169-I175 HydrophobicContact CD1-CG2 4.32Å; H173-I175 VanDerWaalsContact C-N 3.3Å; H173-I175 PolarHBondContact ND1-N 3.35Å; H173-I175 PolarHBondContact O-N 3.21Å; H173-I175 VanDerWaalsContact O-N 3.14Å; I175-G178 PolarHBondContact O-N 3.5Å; I175-L179 WeakPolarHBondContact O-CB 3.36Å; I175-L179 PolarHBondContact O-N 2.93Å
176R98Very high97.6Very high32 Ų3227.5 Ų27.512%0.12116%0.162CC..Hα-helixtrans-67.1-46177176.4175.4167.9168.9-6.1110.5A165 L166 L169 A170 H173 L179 A180 E207A165-R176 HydrophobicContact CB-CB 4.29Å; A165-R176 HydrophobicContact CB-CG 4.13Å; L166-R176 VanDerWaalsContact CD2-NH2 3.31Å; L169-R176 HydrophobicContact CB-CB 4.22Å; L169-R176 HydrophobicContact CD1-CB 4.35Å; L169-R176 WeakPolarHBondContact O-CD 3.19Å; L169-R176 PolarHBondContact O-NH1 2.68Å; A170-R176 WeakPolarHBondContact O-CD 3.44Å; H173-R176 HydrophobicContact CB-CB 4.28Å; H173-R176 PolarHBondContact O-N 3.49Å; R176-L179 WeakPolarHBondContact O-CB 3.09Å; R176-L179 PolarHBondContact O-N 2.89Å; R176-A180 PolarHBondContact O-N 3.15Å; R176-E207 IonicContact CZ-OE2 3.85Å; R176-E207 IonicContact NH2-OE2 2.63Å; R176-E207 PolarHBondContact NH2-OE2 3.37Å
177L98.3Very high97.7Very high2 Ų224.7 Ų24.71%0.0115%0.146CC..Hα-helixtrans-60-46.3174.5-75.1172.7000111.8P171 H173 L179 A180 L181 A208 I226 M227 L230P171-L177 WeakPolarHBondContact O-CG 3.41Å; H173-L177 PolarHBondContact O-N 3.45Å; L177-L179 VanDerWaalsContact C-N 3.28Å; L177-L179 PolarHBondContact O-N 3.16Å; L177-A180 PolarHBondContact O-N 3.08Å; L177-L181 PolarHBondContact O-N 3.3Å; L177-A208 HydrophobicContact CD1-CB 4.48Å; L177-A208 HydrophobicContact CD2-CB 3.74Å; L177-I226 HydrophobicContact CB-CB 4.21Å; L177-I226 HydrophobicContact CB-CD1 4.42Å; L177-I226 HydrophobicContact CB-CG2 3.65Å; L177-M227 HydrophobicContact CD1-CG 3.98Å; L177-M227 HydrophobicContact CD1-SD 4.44Å; L177-M227 HydrophobicContact CD2-CG 4.24Å; L177-L230 HydrophobicContact CD2-CD1 4.06Å
178G98.2Very high97.7Very high10 Ų1023.7 Ų23.710%0.10313%0.126CC..Hα-helixtrans-64.2-33178.500000112.7K129 P174 I175 N182K129-G178 WeakPolarHBondContact CE-O 3.15Å; P174-G178 PolarHBondContact O-N 2.97Å; I175-G178 PolarHBondContact O-N 3.5Å; G178-N182 WeakPolarHBondContact O-CB 3.29Å; G178-N182 PolarHBondContact O-N 3.35Å; G178-N182 VanDerWaalsContact O-N 3.09Å
179L98.7Very high97.6Very high3 Ų322.6 Ų22.62%0.01612%0.121CC..Hα-helixtrans-65.9-48.8171.2172.163.6000111V125 K129 Y158 A161 Q162 A165 I175 R176 L177 L181 N182 F183V125-L179 HydrophobicContact CG1-CD2 4.18Å; K129-L179 HydrophobicContact CB-CD1 4.1Å; K129-L179 HydrophobicContact CD-CB 4.07Å; K129-L179 HydrophobicContact CG-CB 4.32Å; K129-L179 HydrophobicContact CG-CD1 4.01Å; Y158-L179 HydrophobicContact CD1-CD1 3.55Å; Y158-L179 HydrophobicContact CE1-CD1 4.22Å; Y158-L179 HydrophobicContact CG-CD1 4.23Å; A161-L179 VanDerWaalsContact C-CD2 3.46Å; A161-L179 HydrophobicContact CB-CD1 3.86Å; A161-L179 HydrophobicContact CB-CD2 3.61Å; A161-L179 HydrophobicContact CB-CG 4.4Å; Q162-L179 HydrophobicContact CB-CD2 4.05Å; A165-L179 HydrophobicContact CB-CD2 4.08Å; I175-L179 WeakPolarHBondContact O-CB 3.36Å; I175-L179 PolarHBondContact O-N 2.93Å; R176-L179 WeakPolarHBondContact O-CB 3.09Å; R176-L179 PolarHBondContact O-N 2.89Å; L177-L179 VanDerWaalsContact C-N 3.28Å; L177-L179 PolarHBondContact O-N 3.16Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.29Å; L179-N182 PolarHBondContact O-N 2.93Å; L179-F183 VanDerWaalsContact O-CB 3.22Å; L179-F183 WeakPolarHBondContact O-CB 3.5Å; L179-F183 PolarHBondContact O-N 3.28Å
180A98.7Very high97.7Very high9 Ų922.6 Ų22.67%0.07412%0.121CC..Hα-helixtrans-59-42.4178.700000111.9R176 L177 S184 A204R176-A180 PolarHBondContact O-N 3.15Å; L177-A180 PolarHBondContact O-N 3.08Å; A180-S184 WeakPolarHBondContact O-CB 3.44Å; A180-S184 PolarHBondContact O-N 3.3Å; A180-S184 PolarHBondContact O-OG 3.05Å; A180-A204 HydrophobicContact CB-CB 3.44Å; A180-A204 VanDerWaalsContact CB-CB 3.44Å
181L98.6Very high97.8Very high19 Ų1923 Ų2310%0.09912%0.117CC..Hα-helixtrans-58.8-50.6174.4176.964.8000111.9L177 L179 S184 V185 I226 L229 L230 N233L177-L181 PolarHBondContact O-N 3.3Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.29Å; L181-S184 PolarHBondContact O-OG 3.37Å; L181-V185 VanDerWaalsContact O-CG2 3.28Å; L181-V185 WeakPolarHBondContact O-CG2 3.39Å; L181-V185 PolarHBondContact O-N 3.05Å; L181-V185 VanDerWaalsContact O-N 3.16Å; L181-I226 HydrophobicContact CB-CG2 4.28Å; L181-I226 HydrophobicContact CD2-CG2 4.13Å; L181-L229 HydrophobicContact CD1-CB 4.16Å; L181-L229 HydrophobicContact CD2-CB 3.9Å; L181-L229 HydrophobicContact CD2-CD1 3.98Å; L181-L230 HydrophobicContact CB-CD2 3.9Å; L181-L230 HydrophobicContact CB-CG 4.18Å; L181-L230 HydrophobicContact CD1-CD2 3.92Å; L181-L230 HydrophobicContact CD1-CG 4.12Å; L181-N233 VanDerWaalsContact CD1-ND2 3.29Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.34Å
182N98.5Very high97.8Very high27 Ų2728.9 Ų28.914%0.14415%0.147CC..Hα-helixtrans-71.5-34.2-176.6-74.83.3000112.4K129 D133 Y158 G178 L179 V185 F186K129-N182 WeakPolarHBondContact CE-ND2 3.27Å; K129-N182 PolarHBondContact NZ-ND2 3.38Å; D133-N182 WeakPolarHBondContact OD1-CB 3.41Å; D133-N182 PolarHBondContact OD1-ND2 3.28Å; D133-N182 PolarHBondContact OD2-ND2 3.13Å; Y158-N182 HydrophobicContact CE1-CB 4.36Å; G178-N182 WeakPolarHBondContact O-CB 3.29Å; G178-N182 PolarHBondContact O-N 3.35Å; G178-N182 VanDerWaalsContact O-N 3.09Å; L179-N182 PolarHBondContact O-N 2.93Å; N182-V185 PolarHBondContact O-N 3.32Å; N182-F186 PolarHBondContact O-N 3.02Å; N182-F186 VanDerWaalsContact O-N 3.07Å
183F98.8Very high97.8Very high0 Ų030.2 Ų30.20%016%0.157CC..Hα-helixtrans-73.3-34.9178.9-163.2-177000111.5M155 Y158 K159 L179 F186 Y187 L200M155-F183 HydrophobicContact SD-CE2 3.83Å; M155-F183 HydrophobicContact SD-CZ 3.74Å; Y158-F183 HydrophobicContact CD2-CB 4.11Å; Y158-F183 AromaticContact CD2-CD2 3.46Å; Y158-F183 HydrophobicContact CD2-CD2 3.46Å; Y158-F183 VanDerWaalsContact CD2-CD2 3.46Å; Y158-F183 AromaticContact CD2-CE2 3.99Å; Y158-F183 HydrophobicContact CD2-CE2 3.99Å; Y158-F183 AromaticContact CD2-CG 3.9Å; Y158-F183 HydrophobicContact CD2-CG 3.9Å; Y158-F183 HydrophobicContact CE2-CD2 4.35Å; Y158-F183 HydrophobicContact CG-CB 4.2Å; Y158-F183 HydrophobicContact CG-CD1 4.44Å; Y158-F183 AromaticContact CG-CD2 3.93Å; Y158-F183 HydrophobicContact CG-CD2 3.93Å; Y158-F183 HydrophobicContact CG-CE2 4.36Å; Y158-F183 AromaticContact CG-CG 3.97Å; Y158-F183 HydrophobicContact CG-CG 3.97Å; K159-F183 HydrophobicContact CG-CE1 4.25Å; K159-F183 HydrophobicContact CG-CZ 3.92Å; L179-F183 VanDerWaalsContact O-CB 3.22Å; L179-F183 WeakPolarHBondContact O-CB 3.5Å; L179-F183 PolarHBondContact O-N 3.28Å; F183-F186 HydrophobicContact CD2-CB 4.42Å; F183-F186 AromaticContact CD2-CD1 3.86Å; F183-F186 HydrophobicContact CD2-CD1 3.86Å; F183-F186 AromaticContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CE1 4.27Å; F183-F186 WeakPolarHBondContact O-CB 3.42Å; F183-F186 PolarHBondContact O-N 2.86Å; F183-Y187 HydrophobicContact CD1-CE2 4.47Å; F183-Y187 AromaticContact CD2-CD2 3.94Å; F183-Y187 HydrophobicContact CD2-CD2 3.94Å; F183-Y187 AromaticContact CD2-CE2 3.61Å; F183-Y187 HydrophobicContact CD2-CE2 3.61Å; F183-Y187 HydrophobicContact CE1-CE2 4.31Å; F183-Y187 HydrophobicContact CE2-CD2 4.12Å; F183-Y187 AromaticContact CE2-CE2 3.4Å; F183-Y187 HydrophobicContact CE2-CE2 3.4Å; F183-Y187 VanDerWaalsContact CE2-CE2 3.4Å; F183-Y187 AromaticContact CE2-CZ 3.71Å; F183-Y187 HydrophobicContact CG-CE2 4.16Å; F183-Y187 AromaticContact CZ-CE2 3.79Å; F183-Y187 HydrophobicContact CZ-CE2 3.79Å; F183-Y187 AromaticContact CZ-CZ 3.96Å; F183-Y187 VanDerWaalsContact O-CD2 3.24Å; F183-Y187 WeakPolarHBondContact O-CD2 3.46Å; F183-Y187 PolarHBondContact O-N 2.86Å; F183-Y187 VanDerWaalsContact O-N 3.09Å; F183-L200 HydrophobicContact CB-CD2 3.81Å; F183-L200 HydrophobicContact CD1-CD2 3.88Å; F183-L200 HydrophobicContact CG-CD2 3.83Å
184S98.6Very high97.9Very high0 Ų029.8 Ų29.80%016%0.158CC..Hα-helixtrans-65.6-42.2172.466.70000111.5A180 L181 F186 Y187 Y188 A197 W237A180-S184 WeakPolarHBondContact O-CB 3.44Å; A180-S184 PolarHBondContact O-N 3.3Å; A180-S184 PolarHBondContact O-OG 3.05Å; L181-S184 PolarHBondContact O-OG 3.37Å; S184-F186 VanDerWaalsContact C-N 3.27Å; S184-F186 PolarHBondContact O-N 3.21Å; S184-Y187 PolarHBondContact O-N 3.5Å; S184-Y187 VanDerWaalsContact O-N 3.13Å; S184-Y188 PolarHBondContact O-N 3.27Å; S184-A197 WeakPolarHBondContact CB-O 2.99Å; S184-A197 VanDerWaalsContact O-CB 3.25Å; S184-A197 WeakPolarHBondContact O-CB 3.37Å; S184-W237 WeakPolarHBondContact OG-CH2 3.45Å
185V98.3Very high97.9Very high18 Ų1834.5 Ų34.511%0.10918%0.182CC..Hα-helixtrans-58-39.7173172.70000111.4L181 N182 Y188 E189 W237L181-V185 VanDerWaalsContact O-CG2 3.28Å; L181-V185 WeakPolarHBondContact O-CG2 3.39Å; L181-V185 PolarHBondContact O-N 3.05Å; L181-V185 VanDerWaalsContact O-N 3.16Å; N182-V185 PolarHBondContact O-N 3.32Å; V185-Y188 PolarHBondContact O-N 2.97Å; V185-E189 VanDerWaalsContact CG1-CD 3.44Å; V185-E189 HydrophobicContact CG1-CG 3.98Å; V185-E189 VanDerWaalsContact CG1-OE2 3.29Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.42Å; V185-E189 WeakPolarHBondContact O-CB 3.35Å; V185-E189 PolarHBondContact O-N 2.83Å; V185-W237 HydrophobicContact CG2-CH2 3.99Å; V185-W237 HydrophobicContact CG2-CZ2 4Å
186F98.7Very high97.9Very high0 Ų041 Ų410%021%0.205CC..Hα-helixtrans-61.6-46.5174.1173.1-117.7000113.2R136 A151 T154 M155 Y158 N182 F183 S184 Y188 I190 L191R136-F186 HydrophobicContact CG-CD2 4.16Å; A151-F186 HydrophobicContact CB-CE2 4.35Å; A151-F186 HydrophobicContact CB-CZ 4.43Å; A151-F186 WeakPolarHBondContact O-CZ 3.5Å; T154-F186 HydrophobicContact CG2-CB 4.44Å; T154-F186 HydrophobicContact CG2-CD1 4.04Å; T154-F186 HydrophobicContact CG2-CD2 3.4Å; T154-F186 VanDerWaalsContact CG2-CD2 3.4Å; T154-F186 HydrophobicContact CG2-CE1 4.07Å; T154-F186 HydrophobicContact CG2-CE2 3.48Å; T154-F186 VanDerWaalsContact CG2-CE2 3.48Å; T154-F186 HydrophobicContact CG2-CG 3.7Å; T154-F186 HydrophobicContact CG2-CZ 3.82Å; M155-F186 HydrophobicContact CB-CE1 4.08Å; M155-F186 HydrophobicContact CB-CZ 4.33Å; M155-F186 HydrophobicContact CE-CE1 3.74Å; M155-F186 HydrophobicContact SD-CE1 4.31Å; Y158-F186 HydrophobicContact CD2-CB 4.29Å; Y158-F186 HydrophobicContact CD2-CD1 4.27Å; Y158-F186 HydrophobicContact CD2-CG 4.38Å; Y158-F186 HydrophobicContact CE2-CB 3.85Å; Y158-F186 HydrophobicContact CE2-CG 4.21Å; N182-F186 PolarHBondContact O-N 3.02Å; N182-F186 VanDerWaalsContact O-N 3.07Å; F183-F186 HydrophobicContact CD2-CB 4.42Å; F183-F186 AromaticContact CD2-CD1 3.86Å; F183-F186 HydrophobicContact CD2-CD1 3.86Å; F183-F186 AromaticContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CD1 3.8Å; F183-F186 HydrophobicContact CE2-CE1 4.27Å; F183-F186 WeakPolarHBondContact O-CB 3.42Å; F183-F186 PolarHBondContact O-N 2.86Å; S184-F186 VanDerWaalsContact C-N 3.27Å; S184-F186 PolarHBondContact O-N 3.21Å; F186-Y188 PolarHBondContact O-N 3.31Å; F186-I190 HydrophobicContact CD2-CB 3.57Å; F186-I190 HydrophobicContact CD2-CG1 3.75Å; F186-I190 HydrophobicContact CD2-CG2 4.02Å; F186-I190 HydrophobicContact CE2-CB 3.69Å; F186-I190 HydrophobicContact CE2-CG1 4.2Å; F186-I190 HydrophobicContact CE2-CG2 3.6Å; F186-I190 WeakPolarHBondContact O-CB 3.3Å; F186-I190 PolarHBondContact O-N 3Å; F186-L191 HydrophobicContact CD1-CD1 3.99Å; F186-L191 HydrophobicContact CD1-CG 4.32Å; F186-L191 HydrophobicContact CE1-CD1 3.39Å; F186-L191 HydrophobicContact CE1-CD2 4.35Å; F186-L191 HydrophobicContact CE1-CG 3.81Å; F186-L191 HydrophobicContact CE2-CD2 4.29Å; F186-L191 HydrophobicContact CE2-CG 4.12Å; F186-L191 HydrophobicContact CZ-CD1 3.73Å; F186-L191 HydrophobicContact CZ-CD2 3.8Å; F186-L191 HydrophobicContact CZ-CG 3.68Å; F186-L191 PolarHBondContact O-N 3.43Å; F186-L191 VanDerWaalsContact O-N 3.15Å
187Y98.6Very high97.9Very high23 Ų2339.5 Ų39.59%0.0920%0.199CC..Hα-helixtrans-58.9-39.9176-81.7-64.5000111.5M155 F183 S184 L191 N192 S193 R196 L200M155-Y187 HydrophobicContact CE-CE1 3.75Å; F183-Y187 HydrophobicContact CD1-CE2 4.47Å; F183-Y187 AromaticContact CD2-CD2 3.94Å; F183-Y187 HydrophobicContact CD2-CD2 3.94Å; F183-Y187 AromaticContact CD2-CE2 3.61Å; F183-Y187 HydrophobicContact CD2-CE2 3.61Å; F183-Y187 HydrophobicContact CE1-CE2 4.31Å; F183-Y187 HydrophobicContact CE2-CD2 4.12Å; F183-Y187 AromaticContact CE2-CE2 3.4Å; F183-Y187 HydrophobicContact CE2-CE2 3.4Å; F183-Y187 VanDerWaalsContact CE2-CE2 3.4Å; F183-Y187 AromaticContact CE2-CZ 3.71Å; F183-Y187 HydrophobicContact CG-CE2 4.16Å; F183-Y187 AromaticContact CZ-CE2 3.79Å; F183-Y187 HydrophobicContact CZ-CE2 3.79Å; F183-Y187 AromaticContact CZ-CZ 3.96Å; F183-Y187 VanDerWaalsContact O-CD2 3.24Å; F183-Y187 WeakPolarHBondContact O-CD2 3.46Å; F183-Y187 PolarHBondContact O-N 2.86Å; F183-Y187 VanDerWaalsContact O-N 3.09Å; S184-Y187 PolarHBondContact O-N 3.5Å; S184-Y187 VanDerWaalsContact O-N 3.13Å; Y187-L191 HydrophobicContact CD1-CD1 3.69Å; Y187-L191 HydrophobicContact CE1-CD1 3.86Å; Y187-L191 CarbonylContact O-C 3.5Å; Y187-N192 PolarHBondContact O-N 3.44Å; Y187-S193 PolarHBondContact O-N 3.27Å; Y187-R196 HydrophobicContact CD1-CB 3.86Å; Y187-R196 HydrophobicContact CE1-CB 4.28Å; Y187-R196 HydrophobicContact CG-CB 4.02Å; Y187-L200 HydrophobicContact CD2-CD2 4.09Å; Y187-L200 HydrophobicContact CE2-CD2 4.01Å
188Y98.2Very high97.9Very high52 Ų5240.1 Ų40.120%0.20420%0.204CC..Hα-helixtrans-71.2-64.4179.5-164.3-97000111.9S184 V185 F186 N192 P194 A197 W237 D240S184-Y188 PolarHBondContact O-N 3.27Å; V185-Y188 PolarHBondContact O-N 2.97Å; F186-Y188 PolarHBondContact O-N 3.31Å; Y188-N192 WeakPolarHBondContact O-CA 3.43Å; Y188-N192 PolarHBondContact O-N 3.28Å; Y188-P194 HydrophobicContact CD2-CB 3.92Å; Y188-P194 HydrophobicContact CE2-CB 3.78Å; Y188-A197 HydrophobicContact CD2-CB 4.24Å; Y188-W237 AromaticContact CD1-CD1 3.83Å; Y188-W237 AromaticContact CD1-CE2 3.93Å; Y188-W237 HydrophobicContact CD1-CG 4.48Å; Y188-W237 HydrophobicContact CD1-CZ2 4.46Å; Y188-W237 AromaticContact CD1-NE1 3.44Å; Y188-W237 HydrophobicContact CD2-CB 4.08Å; Y188-W237 AromaticContact CD2-CD1 3.65Å; Y188-W237 AromaticContact CD2-CD2 3.68Å; Y188-W237 HydrophobicContact CD2-CD2 3.68Å; Y188-W237 AromaticContact CD2-CE2 3.87Å; Y188-W237 HydrophobicContact CD2-CE3 4.34Å; Y188-W237 AromaticContact CD2-CG 3.53Å; Y188-W237 HydrophobicContact CD2-CG 3.53Å; Y188-W237 AromaticContact CD2-NE1 3.83Å; Y188-W237 AromaticContact CE1-CD1 3.49Å; Y188-W237 VanDerWaalsContact CE1-CD1 3.49Å; Y188-W237 HydrophobicContact CE1-CG 4.33Å; Y188-W237 AromaticContact CE1-NE1 3.51Å; Y188-W237 HydrophobicContact CE2-CB 3.63Å; Y188-W237 AromaticContact CE2-CD1 3.32Å; Y188-W237 HydrophobicContact CE2-CD2 4.05Å; Y188-W237 AromaticContact CE2-CG 3.38Å; Y188-W237 HydrophobicContact CE2-CG 3.38Å; Y188-W237 AromaticContact CE2-NE1 3.92Å; Y188-W237 AromaticContact CG-CD1 3.9Å; Y188-W237 AromaticContact CG-CD2 3.97Å; Y188-W237 HydrophobicContact CG-CD2 3.97Å; Y188-W237 AromaticContact CG-CE2 3.65Å; Y188-W237 HydrophobicContact CG-CG 4.11Å; Y188-W237 HydrophobicContact CG-CZ2 4.12Å; Y188-W237 AromaticContact CG-NE1 3.6Å; Y188-W237 AromaticContact CZ-CD1 3.23Å; Y188-W237 AromaticContact CZ-CG 3.8Å; Y188-W237 AromaticContact CZ-NE1 3.77Å; Y188-D240 PolarHBondContact OH-OD2 3.23Å
189E96.5Very high97.8Very high100 Ų10043.2 Ų43.247%0.46722%0.224SC..Hα-helixtrans-77.6-33-166.6-63.5-177.2163.500113.5R136 V185R136-E189 IonicContact NH1-OE2 3.82Å; V185-E189 VanDerWaalsContact CG1-CD 3.44Å; V185-E189 HydrophobicContact CG1-CG 3.98Å; V185-E189 VanDerWaalsContact CG1-OE2 3.29Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.42Å; V185-E189 WeakPolarHBondContact O-CB 3.35Å; V185-E189 PolarHBondContact O-N 2.83Å
190I98.1Very high97.8Very high18 Ų1844 Ų449%0.09223%0.228CC..THydrogen-bonded Turntrans-103.8-43.4-172.7-54.1-56.8000112.1R136 A139 E140 A151 F186R136-I190 HydrophobicContact CG-CG1 3.98Å; A139-I190 HydrophobicContact CB-CD1 4.37Å; A139-I190 HydrophobicContact CB-CG2 3.88Å; E140-I190 HydrophobicContact CG-CD1 3.87Å; A151-I190 HydrophobicContact CB-CG2 4.12Å; F186-I190 HydrophobicContact CD2-CB 3.57Å; F186-I190 HydrophobicContact CD2-CG1 3.75Å; F186-I190 HydrophobicContact CD2-CG2 4.02Å; F186-I190 HydrophobicContact CE2-CB 3.69Å; F186-I190 HydrophobicContact CE2-CG1 4.2Å; F186-I190 HydrophobicContact CE2-CG2 3.6Å; F186-I190 WeakPolarHBondContact O-CB 3.3Å; F186-I190 PolarHBondContact O-N 3Å
191L97.7Very high97.8Very high57 Ų5743.6 Ų43.630%0.29823%0.225SC..THydrogen-bonded Turntrans-92.4-3.4-178.2-60.2-175.6000113.8M155 F186 Y187 S193M155-L191 HydrophobicContact CE-CD1 3.39Å; F186-L191 HydrophobicContact CD1-CD1 3.99Å; F186-L191 HydrophobicContact CD1-CG 4.32Å; F186-L191 HydrophobicContact CE1-CD1 3.39Å; F186-L191 HydrophobicContact CE1-CD2 4.35Å; F186-L191 HydrophobicContact CE1-CG 3.81Å; F186-L191 HydrophobicContact CE2-CD2 4.29Å; F186-L191 HydrophobicContact CE2-CG 4.12Å; F186-L191 HydrophobicContact CZ-CD1 3.73Å; F186-L191 HydrophobicContact CZ-CD2 3.8Å; F186-L191 HydrophobicContact CZ-CG 3.68Å; F186-L191 PolarHBondContact O-N 3.43Å; F186-L191 VanDerWaalsContact O-N 3.15Å; Y187-L191 HydrophobicContact CD1-CD1 3.69Å; Y187-L191 HydrophobicContact CE1-CD1 3.86Å; Y187-L191 CarbonylContact O-C 3.5Å; L191-S193 PolarHBondContact O-N 3.07Å; L191-S193 VanDerWaalsContact O-N 3.16Å; L191-S193 PolarHBondContact O-OG 3.13Å
192N96.7Very high97.7Very high140 Ų14048.4 Ų48.475%0.74925%0.245SC*.  trans47.644.9-178.4-164.149.4000112Y187 Y188 P194Y187-N192 PolarHBondContact O-N 3.44Å; Y188-N192 WeakPolarHBondContact O-CA 3.43Å; Y188-N192 PolarHBondContact O-N 3.28Å; N192-P194 WeakPolarHBondContact O-CD 3.39Å
193S97.2Very high97.7Very high35 Ų3551.6 Ų51.625%0.24526%0.259CS..  trans-121.167.2-174.9-65.10000109.8Y187 L191 D195 R196 A197Y187-S193 PolarHBondContact O-N 3.27Å; L191-S193 PolarHBondContact O-N 3.07Å; L191-S193 VanDerWaalsContact O-N 3.16Å; L191-S193 PolarHBondContact O-OG 3.13Å; S193-D195 VanDerWaalsContact C-N 3.32Å; S193-D195 PolarHBondContact O-N 2.9Å; S193-R196 PolarHBondContact O-N 3.49Å; S193-R196 VanDerWaalsContact O-N 3.12Å; S193-A197 PolarHBondContact O-N 3.03Å; S193-A197 VanDerWaalsContact O-N 3.07Å
194P96.6Very high97.6Very high36 Ų3652.2 Ų52.223%0.23426%0.264CS..Hα-helixtrans-60.2-38.2-172.125-35.4000112.8Y188 N192 R196 A197 C198 I241Y188-P194 HydrophobicContact CD2-CB 3.92Å; Y188-P194 HydrophobicContact CE2-CB 3.78Å; N192-P194 WeakPolarHBondContact O-CD 3.39Å; P194-R196 VanDerWaalsContact C-N 3.31Å; P194-R196 PolarHBondContact O-N 2.81Å; P194-A197 WeakPolarHBondContact O-CB 3.45Å; P194-A197 PolarHBondContact O-N 3.35Å; P194-A197 VanDerWaalsContact O-N 3.14Å; P194-C198 WeakPolarHBondContact O-CB 3.4Å; P194-C198 PolarHBondContact O-N 3.43Å; P194-C198 PolarHBondContact O-SG 2.72Å; P194-C198 VanDerWaalsContact O-SG 3.39Å; P194-I241 HydrophobicContact CB-CD1 4.08Å; P194-I241 HydrophobicContact CB-CG1 4.2Å
195D95.7Very high97.6Very high123 Ų12354 Ų5466%0.65827%0.272SS*.Hα-helixtrans-57.8-42.8176.4-63.2-33.6000112.5S193 S199S193-D195 VanDerWaalsContact C-N 3.32Å; S193-D195 PolarHBondContact O-N 2.9Å; D195-S199 VanDerWaalsContact O-CB 3.24Å; D195-S199 WeakPolarHBondContact O-CB 3.2Å; D195-S199 PolarHBondContact O-N 2.83Å
196R97Very high97.6Very high157 Ų15756.9 Ų56.959%0.59229%0.287SS*.Hα-helixtrans-70.6-38.5178-69.5-172.7177.3-179.41.2111.5Y187 S193 P194 L200Y187-R196 HydrophobicContact CD1-CB 3.86Å; Y187-R196 HydrophobicContact CE1-CB 4.28Å; Y187-R196 HydrophobicContact CG-CB 4.02Å; S193-R196 PolarHBondContact O-N 3.49Å; S193-R196 VanDerWaalsContact O-N 3.12Å; P194-R196 VanDerWaalsContact C-N 3.31Å; P194-R196 PolarHBondContact O-N 2.81Å; R196-L200 WeakPolarHBondContact O-CB 3.45Å; R196-L200 PolarHBondContact O-N 3.45Å
197A97.9Very high97.5Very high0 Ų059.4 Ų59.40%030%0.298CS..Hα-helixtrans-60.4-51.4175.500000111S184 Y188 S193 P194 L200 A201 W237S184-A197 WeakPolarHBondContact CB-O 2.99Å; S184-A197 VanDerWaalsContact O-CB 3.25Å; S184-A197 WeakPolarHBondContact O-CB 3.37Å; Y188-A197 HydrophobicContact CD2-CB 4.24Å; S193-A197 PolarHBondContact O-N 3.03Å; S193-A197 VanDerWaalsContact O-N 3.07Å; P194-A197 WeakPolarHBondContact O-CB 3.45Å; P194-A197 PolarHBondContact O-N 3.35Å; P194-A197 VanDerWaalsContact O-N 3.14Å; A197-L200 PolarHBondContact O-N 2.85Å; A197-A201 WeakPolarHBondContact O-CB 3.49Å; A197-A201 PolarHBondContact O-N 3.4Å; A197-W237 HydrophobicContact CB-CE3 4.05Å; A197-W237 HydrophobicContact CB-CZ3 3.91Å
198C97.7Very high97.3Very high15 Ų1558.3 Ų58.310%0.10129%0.294CS..Hα-helixtrans-63.2-44.5178.3-690000111.9P194 L200 A201 K202 L234P194-C198 WeakPolarHBondContact O-CB 3.4Å; P194-C198 PolarHBondContact O-N 3.43Å; P194-C198 PolarHBondContact O-SG 2.72Å; P194-C198 VanDerWaalsContact O-SG 3.39Å; C198-L200 VanDerWaalsContact C-N 3.34Å; C198-L200 PolarHBondContact O-N 3.4Å; C198-A201 PolarHBondContact O-N 2.67Å; C198-K202 WeakPolarHBondContact O-CB 3.38Å; C198-K202 PolarHBondContact O-N 2.63Å; C198-L234 HydrophobicContact CB-CD2 4.16Å; C198-L234 WeakPolarHBondContact O-CD2 3.42Å
199S97.6Very high97.2Very high76 Ų7659.9 Ų59.953%0.53131%0.305SS..Hα-helixtrans-58.4-45.6177.2-175.50000111.9D195 Q203D195-S199 VanDerWaalsContact O-CB 3.24Å; D195-S199 WeakPolarHBondContact O-CB 3.2Å; D195-S199 PolarHBondContact O-N 2.83Å; S199-Q203 VanDerWaalsContact O-CB 3.31Å; S199-Q203 WeakPolarHBondContact O-CB 3.31Å; S199-Q203 PolarHBondContact O-N 3Å
200L98.1Very high97.1Very high19 Ų1959.6 Ų59.610%0.09931%0.314CS..Hα-helixtrans-68.5-46.1-179.1178.360.3000111.9F183 Y187 R196 A197 C198 Q203 A204F183-L200 HydrophobicContact CB-CD2 3.81Å; F183-L200 HydrophobicContact CD1-CD2 3.88Å; F183-L200 HydrophobicContact CG-CD2 3.83Å; Y187-L200 HydrophobicContact CD2-CD2 4.09Å; Y187-L200 HydrophobicContact CE2-CD2 4.01Å; R196-L200 WeakPolarHBondContact O-CB 3.45Å; R196-L200 PolarHBondContact O-N 3.45Å; A197-L200 PolarHBondContact O-N 2.85Å; C198-L200 VanDerWaalsContact C-N 3.34Å; C198-L200 PolarHBondContact O-N 3.4Å; L200-Q203 PolarHBondContact O-N 2.95Å; L200-A204 PolarHBondContact O-N 3.12Å; L200-A204 VanDerWaalsContact O-N 3.08Å
201A98Very high96.9Very high0 Ų062.3 Ų62.30%033%0.327CS..Hα-helixtrans-63.5-42.6179.600000111.5A197 C198 A204 F205 L230 L234 W237A197-A201 WeakPolarHBondContact O-CB 3.49Å; A197-A201 PolarHBondContact O-N 3.4Å; C198-A201 PolarHBondContact O-N 2.67Å; A201-A204 PolarHBondContact O-N 2.69Å; A201-F205 WeakPolarHBondContact O-CB 3.41Å; A201-F205 PolarHBondContact O-N 3.16Å; A201-L230 HydrophobicContact CB-CD2 3.82Å; A201-L234 HydrophobicContact CB-CD1 4.29Å; A201-L234 HydrophobicContact CB-CD2 3.81Å; A201-L234 HydrophobicContact CB-CG 3.9Å; A201-W237 HydrophobicContact CB-CZ3 4.33Å
202K97.4Very high96.5Very high120 Ų12061.8 Ų61.852%0.52232%0.324SS..Hα-helixtrans-64.7-46.8177.9-176.7173.9-178.6178.70111.8C198 A204 F205 D206 L234C198-K202 WeakPolarHBondContact O-CB 3.38Å; C198-K202 PolarHBondContact O-N 2.63Å; K202-A204 VanDerWaalsContact C-N 3.34Å; K202-A204 PolarHBondContact O-N 3.07Å; K202-F205 PolarHBondContact O-N 2.99Å; K202-D206 WeakPolarHBondContact CE-OD2 3.45Å; K202-D206 WeakPolarHBondContact CG-OD2 3.38Å; K202-D206 WeakPolarHBondContact O-CB 3.46Å; K202-D206 VanDerWaalsContact O-CG 3.26Å; K202-D206 PolarHBondContact O-N 2.91Å; K202-L234 HydrophobicContact CB-CD1 4.16Å; K202-L234 HydrophobicContact CB-CD2 4.05Å
203Q98.1Very high96.2Very high95 Ų9563.2 Ų63.244%0.44433%0.331SS..Hα-helixtrans-56.6-49.5177179.7-176.7-10.900111.3S199 L200 F205 D206 E207S199-Q203 VanDerWaalsContact O-CB 3.31Å; S199-Q203 WeakPolarHBondContact O-CB 3.31Å; S199-Q203 PolarHBondContact O-N 3Å; L200-Q203 PolarHBondContact O-N 2.95Å; Q203-F205 VanDerWaalsContact C-N 3.32Å; Q203-F205 PolarHBondContact O-N 3.05Å; Q203-D206 PolarHBondContact O-N 3.19Å; Q203-E207 HydrophobicContact CG-CG 4.37Å; Q203-E207 VanDerWaalsContact CG-OE1 3.25Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.48Å; Q203-E207 PolarHBondContact NE2-OE1 3.2Å; Q203-E207 WeakPolarHBondContact O-CB 3.47Å; Q203-E207 VanDerWaalsContact O-CG 3.27Å; Q203-E207 WeakPolarHBondContact O-CG 3.41Å; Q203-E207 PolarHBondContact O-N 3.47Å
204A98Very high95.6Very high13 Ų1366.3 Ų66.311%0.10735%0.349CS..Hα-helixtrans-63.2-38.9-179.700000112.5A180 L200 A201 K202 A208 L230A180-A204 HydrophobicContact CB-CB 3.44Å; A180-A204 VanDerWaalsContact CB-CB 3.44Å; L200-A204 PolarHBondContact O-N 3.12Å; L200-A204 VanDerWaalsContact O-N 3.08Å; A201-A204 PolarHBondContact O-N 2.69Å; K202-A204 VanDerWaalsContact C-N 3.34Å; K202-A204 PolarHBondContact O-N 3.07Å; A204-A208 VanDerWaalsContact O-CB 3.29Å; A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 2.71Å; A204-A208 VanDerWaalsContact O-N 3.09Å; A204-L230 HydrophobicContact CB-CD1 4.35Å
205F97.4Very high95Very high36 Ų3666 Ų6616%0.15835%0.345CS..Hα-helixtrans-66.3-47.8177.2-175.1-100.6000111.9A201 K202 Q203 A208 I209 M227 L230 H231A201-F205 WeakPolarHBondContact O-CB 3.41Å; A201-F205 PolarHBondContact O-N 3.16Å; K202-F205 PolarHBondContact O-N 2.99Å; Q203-F205 VanDerWaalsContact C-N 3.32Å; Q203-F205 PolarHBondContact O-N 3.05Å; F205-A208 PolarHBondContact O-N 2.88Å; F205-I209 HydrophobicContact CD1-CD1 3.62Å; F205-I209 HydrophobicContact CD1-CG1 4.34Å; F205-I209 HydrophobicContact CE1-CD1 3.09Å; F205-I209 HydrophobicContact CE1-CG1 4.15Å; F205-I209 HydrophobicContact CE2-CD1 4.17Å; F205-I209 HydrophobicContact CG-CD1 4.37Å; F205-I209 HydrophobicContact CZ-CD1 3.42Å; F205-I209 VanDerWaalsContact CZ-CD1 3.42Å; F205-I209 HydrophobicContact CZ-CG1 4.28Å; F205-I209 WeakPolarHBondContact O-CB 3.46Å; F205-I209 WeakPolarHBondContact O-CG1 3.49Å; F205-I209 PolarHBondContact O-N 3.3Å; F205-M227 HydrophobicContact CD2-CB 4.11Å; F205-M227 WeakPolarHBondContact CD2-O 3.34Å; F205-M227 HydrophobicContact CE2-CB 4.08Å; F205-M227 WeakPolarHBondContact CE2-O 3.49Å; F205-L230 HydrophobicContact CD2-CB 4.38Å; F205-H231 HydrophobicContact CD2-CB 4.36Å; F205-H231 HydrophobicContact CE2-CB 3.76Å; F205-H231 HydrophobicContact CZ-CB 4Å; F205-H231 AromaticContact CZ-CD2 3.88Å
206D97.5Very high94.5Very high80 Ų8063 Ų6343%0.42833%0.334SS..Hα-helixtrans-64.5-43.5-179.4-69.3-14.9000111.4K202 Q203 I209 S210K202-D206 WeakPolarHBondContact CE-OD2 3.45Å; K202-D206 WeakPolarHBondContact CG-OD2 3.38Å; K202-D206 WeakPolarHBondContact O-CB 3.46Å; K202-D206 VanDerWaalsContact O-CG 3.26Å; K202-D206 PolarHBondContact O-N 2.91Å; Q203-D206 PolarHBondContact O-N 3.19Å; D206-I209 PolarHBondContact O-N 2.89Å; D206-S210 PolarHBondContact O-N 3.42Å; D206-S210 VanDerWaalsContact O-N 3.12Å
207E96.8Very high93.9Very high52 Ų5264.5 Ų64.524%0.24335%0.347CS..Hα-helixtrans-59.8-47.2174.7-72.7174.8-172.700111.2P171 R176 Q203 S210 E211P171-E207 HydrophobicContact CB-CB 3.98Å; R176-E207 IonicContact CZ-OE2 3.85Å; R176-E207 IonicContact NH2-OE2 2.63Å; R176-E207 PolarHBondContact NH2-OE2 3.37Å; Q203-E207 HydrophobicContact CG-CG 4.37Å; Q203-E207 VanDerWaalsContact CG-OE1 3.25Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.48Å; Q203-E207 PolarHBondContact NE2-OE1 3.2Å; Q203-E207 WeakPolarHBondContact O-CB 3.47Å; Q203-E207 VanDerWaalsContact O-CG 3.27Å; Q203-E207 WeakPolarHBondContact O-CG 3.41Å; Q203-E207 PolarHBondContact O-N 3.47Å; E207-S210 PolarHBondContact O-N 3.44Å; E207-S210 PolarHBondContact O-OG 3.24Å; E207-E211 PolarHBondContact O-N 3.49Å
208A95.8Very high93.2Very high0 Ų072.8 Ų72.80%039%0.386CS..Hα-helixtrans-69.7-35.7-17900000113.4T172 L177 A204 F205 S210 E211 L212 M227T172-A208 HydrophobicContact CG2-CB 4.36Å; T172-A208 WeakPolarHBondContact CG2-O 3.42Å; L177-A208 HydrophobicContact CD1-CB 4.48Å; L177-A208 HydrophobicContact CD2-CB 3.74Å; A204-A208 VanDerWaalsContact O-CB 3.29Å; A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 2.71Å; A204-A208 VanDerWaalsContact O-N 3.09Å; F205-A208 PolarHBondContact O-N 2.88Å; A208-S210 VanDerWaalsContact C-N 3.29Å; A208-S210 PolarHBondContact O-N 3Å; A208-E211 PolarHBondContact O-N 3.37Å; A208-L212 PolarHBondContact O-N 2.65Å; A208-L212 VanDerWaalsContact O-N 3.08Å; A208-M227 HydrophobicContact CB-CE 3.97Å; A208-M227 HydrophobicContact CB-CG 4.32Å; A208-M227 HydrophobicContact CB-SD 3.97Å
209I95Very high92.7Very high85 Ų8573.7 Ų73.744%0.43639%0.393SS..Hα-helixtrans-59.9-42.9172.2-78.6-175.4000110.8F205 D206 E211 L212 M227F205-I209 HydrophobicContact CD1-CD1 3.62Å; F205-I209 HydrophobicContact CD1-CG1 4.34Å; F205-I209 HydrophobicContact CE1-CD1 3.09Å; F205-I209 HydrophobicContact CE1-CG1 4.15Å; F205-I209 HydrophobicContact CE2-CD1 4.17Å; F205-I209 HydrophobicContact CG-CD1 4.37Å; F205-I209 HydrophobicContact CZ-CD1 3.42Å; F205-I209 VanDerWaalsContact CZ-CD1 3.42Å; F205-I209 HydrophobicContact CZ-CG1 4.28Å; F205-I209 WeakPolarHBondContact O-CB 3.46Å; F205-I209 WeakPolarHBondContact O-CG1 3.49Å; F205-I209 PolarHBondContact O-N 3.3Å; D206-I209 PolarHBondContact O-N 2.89Å; I209-E211 PolarHBondContact O-N 2.87Å; I209-E211 VanDerWaalsContact O-N 3.16Å; I209-L212 WeakPolarHBondContact O-CB 3.47Å; I209-L212 PolarHBondContact O-N 3.45Å; I209-M227 HydrophobicContact CB-CE 4.41Å; I209-M227 HydrophobicContact CG1-CE 3.48Å; I209-M227 VanDerWaalsContact CG1-CE 3.48Å
210S94.7Very high92.3Very high94 Ų9475.8 Ų75.866%0.65739%0.39SS*.Hα-helixtrans-64.7-20-176.674.80000113.9D206 E207 A208D206-S210 PolarHBondContact O-N 3.42Å; D206-S210 VanDerWaalsContact O-N 3.12Å; E207-S210 PolarHBondContact O-N 3.44Å; E207-S210 PolarHBondContact O-OG 3.24Å; A208-S210 VanDerWaalsContact C-N 3.29Å; A208-S210 PolarHBondContact O-N 3Å
211E93.7Very high92Very high76 Ų7682.4 Ų82.436%0.35542%0.418SS..THydrogen-bonded Turntrans-116.710.9-179.6-66.4-173.1-158.600113.1P171 T172 E207 A208 I209 D213 T214P171-E211 WeakPolarHBondContact CD-OE2 3.2Å; T172-E211 HydrophobicContact CG2-CB 3.87Å; E207-E211 PolarHBondContact O-N 3.49Å; A208-E211 PolarHBondContact O-N 3.37Å; I209-E211 PolarHBondContact O-N 2.87Å; I209-E211 VanDerWaalsContact O-N 3.16Å; E211-D213 PolarHBondContact O-N 3.34Å; E211-D213 VanDerWaalsContact O-N 3.17Å; E211-T214 WeakPolarHBondContact O-CB 3.4Å; E211-T214 PolarHBondContact O-N 2.74Å; E211-T214 PolarHBondContact O-OG1 2.91Å
212L89.8Confident91.7Very high45 Ų4586.5 Ų86.524%0.23644%0.44CS..G310 helixtrans-58.5-35.1-172.7-168.674000112.8A208 I209 T214 L215 T224 M227A208-L212 PolarHBondContact O-N 2.65Å; A208-L212 VanDerWaalsContact O-N 3.08Å; I209-L212 WeakPolarHBondContact O-CB 3.47Å; I209-L212 PolarHBondContact O-N 3.45Å; L212-T214 PolarHBondContact O-N 2.9Å; L212-T214 VanDerWaalsContact O-N 3.09Å; L212-L215 HydrophobicContact CD1-CD1 3.5Å; L212-L215 HydrophobicContact CG-CD1 4.35Å; L212-L215 WeakPolarHBondContact O-CB 3.43Å; L212-L215 PolarHBondContact O-N 2.99Å; L212-T224 HydrophobicContact CD1-CG2 4.2Å; L212-M227 HydrophobicContact CD1-CE 4Å; L212-M227 HydrophobicContact CD1-SD 3.78Å
213D89.5Confident91.6Very high171 Ų17180.8 Ų80.891%0.91442%0.415SS*.G310 helixtrans-64.8-11.8178.9-66.4-24.9000113.6E211E211-D213 PolarHBondContact O-N 3.34Å; E211-D213 VanDerWaalsContact O-N 3.17Å
214T84.9Confident91.4Very high100 Ų10078.3 Ų78.361%0.61341%0.406SS*.G310 helixtrans-90.5-8.2179.570.80000113.7E211 L212E211-T214 WeakPolarHBondContact O-CB 3.4Å; E211-T214 PolarHBondContact O-N 2.74Å; E211-T214 PolarHBondContact O-OG1 2.91Å; L212-T214 PolarHBondContact O-N 2.9Å; L212-T214 VanDerWaalsContact O-N 3.09Å
215L85.1Confident91.3Very high29 Ų2982.5 Ų82.515%0.15243%0.426CS..  trans-67.1138.7-174.6-85.8168.5000112.8T172 L212 Y220T172-L215 HydrophobicContact CG2-CD1 4.33Å; T172-L215 HydrophobicContact CG2-CG 4.13Å; L212-L215 HydrophobicContact CD1-CD1 3.5Å; L212-L215 HydrophobicContact CG-CD1 4.35Å; L212-L215 WeakPolarHBondContact O-CB 3.43Å; L212-L215 PolarHBondContact O-N 2.99Å; L215-Y220 HydrophobicContact CB-CD2 4.09Å; L215-Y220 HydrophobicContact CD1-CD2 4.17Å
216S84.9Confident91.3Very high60 Ų6082 Ų8242%0.4243%0.425SS..  trans-73.5153.4166.667.30000111E218 S219 Y220S216-E218 PolarHBondContact O-N 3.28Å; S216-S219 PolarHBondContact O-N 3.43Å; S216-S219 VanDerWaalsContact O-N 3.15Å; S216-S219 PolarHBondContact OG-N 3.18Å; S216-Y220 WeakPolarHBondContact O-CB 3.3Å; S216-Y220 PolarHBondContact O-N 3.29Å
217E85Confident91.3Very high188 Ų18878.8 Ų78.888%0.87941%0.408SS*.Hα-helixtrans-56.9-34.6176.8-168.5174.8-177.200112.2
218E82.3Confident91.3Very high175 Ų17581 Ų8182%0.81842%0.418SS*.Hα-helixtrans-65-42.6177.7-174.3176.4-167.200112.6S216S216-E218 PolarHBondContact O-N 3.28Å
219S87.4Confident91.4Very high34 Ų3484.6 Ų84.624%0.23844%0.437CS..Hα-helixtrans-88.7-15.5-179-660000113.6S216 K221 D222 S223S216-S219 PolarHBondContact O-N 3.43Å; S216-S219 VanDerWaalsContact O-N 3.15Å; S216-S219 PolarHBondContact OG-N 3.18Å; S219-K221 PolarHBondContact O-N 3.31Å; S219-D222 PolarHBondContact O-N 3.04Å; S219-S223 VanDerWaalsContact O-CB 3.3Å; S219-S223 WeakPolarHBondContact O-CB 3.35Å; S219-S223 PolarHBondContact O-N 3.48Å; S219-S223 PolarHBondContact O-OG 3.46Å
220Y89.2Confident91.5Very high120 Ų12080.5 Ų80.547%0.47142%0.416SS..Hα-helixtrans-58.5-48.5-172.3-172.4-91.1000112.4L215 S216 T224L215-Y220 HydrophobicContact CB-CD2 4.09Å; L215-Y220 HydrophobicContact CD1-CD2 4.17Å; S216-Y220 WeakPolarHBondContact O-CB 3.3Å; S216-Y220 PolarHBondContact O-N 3.29Å; Y220-T224 HydrophobicContact CD1-CG2 4.14Å; Y220-T224 HydrophobicContact CD2-CG2 4.43Å; Y220-T224 HydrophobicContact CE1-CG2 3.86Å; Y220-T224 HydrophobicContact CE2-CG2 4.18Å; Y220-T224 HydrophobicContact CG-CG2 4.41Å; Y220-T224 WeakPolarHBondContact O-CB 3.34Å; Y220-T224 VanDerWaalsContact O-CG2 3.23Å; Y220-T224 WeakPolarHBondContact O-CG2 3.24Å; Y220-T224 PolarHBondContact O-N 2.88Å; Y220-T224 PolarHBondContact O-OG1 3.47Å
221K91.9Very high91.6Very high158 Ų15879.7 Ų79.769%0.68740%0.402SS*.Hα-helixtrans-62.9-46.4-177.6-176.2-176.5174.6-172.10112.3S219 T224 L225S219-K221 PolarHBondContact O-N 3.31Å; K221-T224 PolarHBondContact O-OG1 2.76Å; K221-L225 WeakPolarHBondContact O-CB 3.31Å; K221-L225 PolarHBondContact O-N 3.1Å; K221-L225 VanDerWaalsContact O-N 3.12Å
222D92.3Very high91.8Very high86 Ų8679.6 Ų79.646%0.4640%0.403SS..Hα-helixtrans-71.1-42-176.8-71.8-8.8000111.2P174 S219 L225 I226P174-D222 HydrophobicContact CB-CB 4.23Å; P174-D222 HydrophobicContact CG-CB 4.14Å; S219-D222 PolarHBondContact O-N 3.04Å; D222-L225 PolarHBondContact O-N 2.98Å; D222-I226 WeakPolarHBondContact O-CD1 3.44Å; D222-I226 VanDerWaalsContact O-CG1 3.25Å; D222-I226 WeakPolarHBondContact O-CG1 3.37Å; D222-I226 PolarHBondContact O-N 3.24Å; D222-I226 VanDerWaalsContact O-N 3.1Å
223S94.2Very high92.1Very high0 Ų079.2 Ų79.20%040%0.401CS..Hα-helixtrans-64.7-47.6179.6-50.80000111.5T172 P174 S219 L225 I226 M227T172-S223 WeakPolarHBondContact O-CB 3.43Å; T172-S223 PolarHBondContact O-OG 3.39Å; P174-S223 WeakPolarHBondContact CG-OG 3.49Å; S219-S223 VanDerWaalsContact O-CB 3.3Å; S219-S223 WeakPolarHBondContact O-CB 3.35Å; S219-S223 PolarHBondContact O-N 3.48Å; S219-S223 PolarHBondContact O-OG 3.46Å; S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 3.35Å; S223-I226 PolarHBondContact O-N 3.07Å; S223-M227 VanDerWaalsContact O-CG 3.25Å; S223-M227 WeakPolarHBondContact O-CG 3.18Å; S223-M227 PolarHBondContact O-N 3.12Å
224T94.7Very high92.4Very high42 Ų4272.1 Ų72.126%0.25836%0.363SS..Hα-helixtrans-65.6-36.3179.9530000112.3L212 Y220 K221 M227 Q228L212-T224 HydrophobicContact CD1-CG2 4.2Å; Y220-T224 HydrophobicContact CD1-CG2 4.14Å; Y220-T224 HydrophobicContact CD2-CG2 4.43Å; Y220-T224 HydrophobicContact CE1-CG2 3.86Å; Y220-T224 HydrophobicContact CE2-CG2 4.18Å; Y220-T224 HydrophobicContact CG-CG2 4.41Å; Y220-T224 WeakPolarHBondContact O-CB 3.34Å; Y220-T224 VanDerWaalsContact O-CG2 3.23Å; Y220-T224 WeakPolarHBondContact O-CG2 3.24Å; Y220-T224 PolarHBondContact O-N 2.88Å; Y220-T224 PolarHBondContact O-OG1 3.47Å; K221-T224 PolarHBondContact O-OG1 2.76Å; T224-M227 PolarHBondContact O-N 3.2Å; T224-Q228 PolarHBondContact O-N 3.49Å
225L95.9Very high92.9Very high101 Ų10170.9 Ų70.953%0.52936%0.356SS..Hα-helixtrans-60.9-45172.2177.361.7000111.5K221 D222 S223 Q228 L229K221-L225 WeakPolarHBondContact O-CB 3.31Å; K221-L225 PolarHBondContact O-N 3.1Å; K221-L225 VanDerWaalsContact O-N 3.12Å; D222-L225 PolarHBondContact O-N 2.98Å; S223-L225 VanDerWaalsContact C-N 3.34Å; S223-L225 PolarHBondContact O-N 3.35Å; L225-Q228 WeakPolarHBondContact O-CB 3.42Å; L225-Q228 PolarHBondContact O-N 3.42Å; L225-L229 WeakPolarHBondContact O-CG 2.92Å; L225-L229 PolarHBondContact O-N 3.43Å; L225-L229 VanDerWaalsContact O-N 3.13Å
226I97Very high93.3Very high27 Ų2774 Ų7414%0.13837%0.372CS..Hα-helixtrans-68.3-39179.3-61.7163.2000111.1P174 L177 L181 D222 S223 Q228 L229 L230P174-I226 HydrophobicContact CB-CD1 4.11Å; P174-I226 WeakPolarHBondContact O-CD1 3.16Å; L177-I226 HydrophobicContact CB-CB 4.21Å; L177-I226 HydrophobicContact CB-CD1 4.42Å; L177-I226 HydrophobicContact CB-CG2 3.65Å; L181-I226 HydrophobicContact CB-CG2 4.28Å; L181-I226 HydrophobicContact CD2-CG2 4.13Å; D222-I226 WeakPolarHBondContact O-CD1 3.44Å; D222-I226 VanDerWaalsContact O-CG1 3.25Å; D222-I226 WeakPolarHBondContact O-CG1 3.37Å; D222-I226 PolarHBondContact O-N 3.24Å; D222-I226 VanDerWaalsContact O-N 3.1Å; S223-I226 PolarHBondContact O-N 3.07Å; I226-Q228 VanDerWaalsContact C-N 3.31Å; I226-Q228 PolarHBondContact O-N 3.48Å; I226-L229 PolarHBondContact O-N 3.28Å; I226-L230 PolarHBondContact O-N 3.21Å
227M97.4Very high93.8Very high12 Ų1271.5 Ų71.56%0.05935%0.354CS..Hα-helixtrans-61-40.1174.4-70170.470.100111.7L177 F205 A208 I209 L212 S223 T224 L230 H231L177-M227 HydrophobicContact CD1-CG 3.98Å; L177-M227 HydrophobicContact CD1-SD 4.44Å; L177-M227 HydrophobicContact CD2-CG 4.24Å; F205-M227 HydrophobicContact CD2-CB 4.11Å; F205-M227 WeakPolarHBondContact CD2-O 3.34Å; F205-M227 HydrophobicContact CE2-CB 4.08Å; F205-M227 WeakPolarHBondContact CE2-O 3.49Å; A208-M227 HydrophobicContact CB-CE 3.97Å; A208-M227 HydrophobicContact CB-CG 4.32Å; A208-M227 HydrophobicContact CB-SD 3.97Å; I209-M227 HydrophobicContact CB-CE 4.41Å; I209-M227 HydrophobicContact CG1-CE 3.48Å; I209-M227 VanDerWaalsContact CG1-CE 3.48Å; L212-M227 HydrophobicContact CD1-CE 4Å; L212-M227 HydrophobicContact CD1-SD 3.78Å; S223-M227 VanDerWaalsContact O-CG 3.25Å; S223-M227 WeakPolarHBondContact O-CG 3.18Å; S223-M227 PolarHBondContact O-N 3.12Å; T224-M227 PolarHBondContact O-N 3.2Å; M227-L230 WeakPolarHBondContact O-CB 3.46Å; M227-L230 PolarHBondContact O-N 3.24Å; M227-H231 PolarHBondContact O-N 2.73Å
228Q97.3Very high94.1Very high99 Ų9966 Ų6646%0.46333%0.333SS..Hα-helixtrans-60.6-45.5173.6-17562.448.200111.3T224 L225 I226 L230 H231 D232T224-Q228 PolarHBondContact O-N 3.49Å; L225-Q228 WeakPolarHBondContact O-CB 3.42Å; L225-Q228 PolarHBondContact O-N 3.42Å; I226-Q228 VanDerWaalsContact C-N 3.31Å; I226-Q228 PolarHBondContact O-N 3.48Å; Q228-L230 VanDerWaalsContact C-N 3.32Å; Q228-L230 PolarHBondContact O-N 2.88Å; Q228-H231 WeakPolarHBondContact O-CB 3.4Å; Q228-H231 PolarHBondContact O-N 3.45Å; Q228-H231 VanDerWaalsContact O-N 3.17Å; Q228-D232 PolarHBondContact NE2-OD1 2.99Å; Q228-D232 PolarHBondContact O-N 2.88Å
229L97.8Very high94.2Very high74 Ų7459.7 Ų59.739%0.38731%0.308SS..Hα-helixtrans-62.6-37.6177.4-66.2172.9000112.6L181 L225 I226 N233L181-L229 HydrophobicContact CD1-CB 4.16Å; L181-L229 HydrophobicContact CD2-CB 3.9Å; L181-L229 HydrophobicContact CD2-CD1 3.98Å; L225-L229 WeakPolarHBondContact O-CG 2.92Å; L225-L229 PolarHBondContact O-N 3.43Å; L225-L229 VanDerWaalsContact O-N 3.13Å; I226-L229 PolarHBondContact O-N 3.28Å; L229-N233 WeakPolarHBondContact O-CB 3.42Å; L229-N233 PolarHBondContact O-N 3.24Å
230L97.5Very high93.8Very high0 Ų061.4 Ų61.40%032%0.315CS..Hα-helixtrans-61.9-45.6172.9-78.8167.7000111.4L177 L181 A201 A204 F205 I226 M227 Q228 N233 L234L177-L230 HydrophobicContact CD2-CD1 4.06Å; L181-L230 HydrophobicContact CB-CD2 3.9Å; L181-L230 HydrophobicContact CB-CG 4.18Å; L181-L230 HydrophobicContact CD1-CD2 3.92Å; L181-L230 HydrophobicContact CD1-CG 4.12Å; A201-L230 HydrophobicContact CB-CD2 3.82Å; A204-L230 HydrophobicContact CB-CD1 4.35Å; F205-L230 HydrophobicContact CD2-CB 4.38Å; I226-L230 PolarHBondContact O-N 3.21Å; M227-L230 WeakPolarHBondContact O-CB 3.46Å; M227-L230 PolarHBondContact O-N 3.24Å; Q228-L230 VanDerWaalsContact C-N 3.32Å; Q228-L230 PolarHBondContact O-N 2.88Å; L230-N233 PolarHBondContact O-N 3.32Å; L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 2.81Å
231H96.8Very high93.2Very high77 Ų7759 Ų5936%0.35631%0.31SS..Hα-helixtrans-63.2-43.4177.7178-82.5000112.4F205 M227 Q228 N233 L234 T235F205-H231 HydrophobicContact CD2-CB 4.36Å; F205-H231 HydrophobicContact CE2-CB 3.76Å; F205-H231 HydrophobicContact CZ-CB 4Å; F205-H231 AromaticContact CZ-CD2 3.88Å; M227-H231 PolarHBondContact O-N 2.73Å; Q228-H231 WeakPolarHBondContact O-CB 3.4Å; Q228-H231 PolarHBondContact O-N 3.45Å; Q228-H231 VanDerWaalsContact O-N 3.17Å; H231-N233 VanDerWaalsContact C-N 3.35Å; H231-N233 PolarHBondContact O-N 3.19Å; H231-L234 PolarHBondContact O-N 2.85Å; H231-T235 PolarHBondContact O-N 2.88Å; H231-T235 PolarHBondContact O-OG1 3.34Å
232D97.4Very high92.1Very high73 Ų7356 Ų5639%0.3931%0.308SS..Hα-helixtrans-62.2-44.2178.2-66.4-14.1000110.9Q228 T235 L236Q228-D232 PolarHBondContact NE2-OD1 2.99Å; Q228-D232 PolarHBondContact O-N 2.88Å; D232-T235 WeakPolarHBondContact O-CB 3.35Å; D232-T235 PolarHBondContact O-N 3.16Å; D232-L236 PolarHBondContact O-N 3.14Å
233N96.2Very high90.5Very high37 Ų3759 Ų5920%0.19832%0.32CS..Hα-helixtrans-61.9-44.3174.7-78.9-3.7000112.2L181 L229 L230 H231 T235 L236 W237L181-N233 VanDerWaalsContact CD1-ND2 3.29Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.34Å; L229-N233 WeakPolarHBondContact O-CB 3.42Å; L229-N233 PolarHBondContact O-N 3.24Å; L230-N233 PolarHBondContact O-N 3.32Å; H231-N233 VanDerWaalsContact C-N 3.35Å; H231-N233 PolarHBondContact O-N 3.19Å; N233-T235 VanDerWaalsContact C-N 3.29Å; N233-T235 PolarHBondContact O-N 3.26Å; N233-L236 PolarHBondContact O-N 3.04Å; N233-W237 HydrophobicContact CB-CD2 4.17Å; N233-W237 HydrophobicContact CB-CE3 4.1Å; N233-W237 HydrophobicContact CB-CH2 3.71Å; N233-W237 HydrophobicContact CB-CZ2 3.76Å; N233-W237 HydrophobicContact CB-CZ3 3.88Å; N233-W237 WeakPolarHBondContact O-CB 3.21Å; N233-W237 VanDerWaalsContact O-CD2 3.24Å; N233-W237 PolarHBondContact O-N 3.12Å
234L95.9Very high88.3Confident22 Ų2264.8 Ų64.812%0.11535%0.35CS..Hα-helixtrans-58.5-44175.7-77.2167.7000111.4C198 A201 K202 L230 H231 T238C198-L234 HydrophobicContact CB-CD2 4.16Å; C198-L234 WeakPolarHBondContact O-CD2 3.42Å; A201-L234 HydrophobicContact CB-CD1 4.29Å; A201-L234 HydrophobicContact CB-CD2 3.81Å; A201-L234 HydrophobicContact CB-CG 3.9Å; K202-L234 HydrophobicContact CB-CD1 4.16Å; K202-L234 HydrophobicContact CB-CD2 4.05Å; L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 2.81Å; H231-L234 PolarHBondContact O-N 2.85Å; L234-T238 WeakPolarHBondContact O-CB 3.33Å; L234-T238 VanDerWaalsContact O-CG2 3.29Å; L234-T238 WeakPolarHBondContact O-CG2 3.5Å; L234-T238 PolarHBondContact O-N 2.96Å; L234-T238 PolarHBondContact O-OG1 2.92Å
235T95Very high86.1Confident75 Ų7567 Ų6746%0.4637%0.366SS..Hα-helixtrans-60.6-49178.7-560000110.8H231 D232 N233 T238 S239H231-T235 PolarHBondContact O-N 2.88Å; H231-T235 PolarHBondContact O-OG1 3.34Å; D232-T235 WeakPolarHBondContact O-CB 3.35Å; D232-T235 PolarHBondContact O-N 3.16Å; N233-T235 VanDerWaalsContact C-N 3.29Å; N233-T235 PolarHBondContact O-N 3.26Å; T235-T238 PolarHBondContact O-OG1 3.48Å; T235-S239 PolarHBondContact O-N 3.21Å; T235-S239 PolarHBondContact O-OG 3.25Å
236L93.9Very high83.9Confident94 Ų9466.5 Ų66.549%0.49238%0.375SS..Hα-helixtrans-62.8-48178.7-178.167000112.7D232 N233 T238 S239 D240D232-L236 PolarHBondContact O-N 3.14Å; N233-L236 PolarHBondContact O-N 3.04Å; L236-T238 PolarHBondContact O-N 3.3Å; L236-S239 PolarHBondContact O-N 3.36Å; L236-S239 PolarHBondContact O-OG 3.44Å; L236-D240 VanDerWaalsContact O-CG 3.3Å; L236-D240 PolarHBondContact O-N 3.35Å
237W95.1Very high81.5Confident7 Ų772.9 Ų72.93%0.02741%0.405CS..Hα-helixtrans-73.4-29.7-174.3-59.8-22.7000112.5S184 V185 Y188 A197 A201 N233 I241S184-W237 WeakPolarHBondContact OG-CH2 3.45Å; V185-W237 HydrophobicContact CG2-CH2 3.99Å; V185-W237 HydrophobicContact CG2-CZ2 4Å; Y188-W237 AromaticContact CD1-CD1 3.83Å; Y188-W237 AromaticContact CD1-CE2 3.93Å; Y188-W237 HydrophobicContact CD1-CG 4.48Å; Y188-W237 HydrophobicContact CD1-CZ2 4.46Å; Y188-W237 AromaticContact CD1-NE1 3.44Å; Y188-W237 HydrophobicContact CD2-CB 4.08Å; Y188-W237 AromaticContact CD2-CD1 3.65Å; Y188-W237 AromaticContact CD2-CD2 3.68Å; Y188-W237 HydrophobicContact CD2-CD2 3.68Å; Y188-W237 AromaticContact CD2-CE2 3.87Å; Y188-W237 HydrophobicContact CD2-CE3 4.34Å; Y188-W237 AromaticContact CD2-CG 3.53Å; Y188-W237 HydrophobicContact CD2-CG 3.53Å; Y188-W237 AromaticContact CD2-NE1 3.83Å; Y188-W237 AromaticContact CE1-CD1 3.49Å; Y188-W237 VanDerWaalsContact CE1-CD1 3.49Å; Y188-W237 HydrophobicContact CE1-CG 4.33Å; Y188-W237 AromaticContact CE1-NE1 3.51Å; Y188-W237 HydrophobicContact CE2-CB 3.63Å; Y188-W237 AromaticContact CE2-CD1 3.32Å; Y188-W237 HydrophobicContact CE2-CD2 4.05Å; Y188-W237 AromaticContact CE2-CG 3.38Å; Y188-W237 HydrophobicContact CE2-CG 3.38Å; Y188-W237 AromaticContact CE2-NE1 3.92Å; Y188-W237 AromaticContact CG-CD1 3.9Å; Y188-W237 AromaticContact CG-CD2 3.97Å; Y188-W237 HydrophobicContact CG-CD2 3.97Å; Y188-W237 AromaticContact CG-CE2 3.65Å; Y188-W237 HydrophobicContact CG-CG 4.11Å; Y188-W237 HydrophobicContact CG-CZ2 4.12Å; Y188-W237 AromaticContact CG-NE1 3.6Å; Y188-W237 AromaticContact CZ-CD1 3.23Å; Y188-W237 AromaticContact CZ-CG 3.8Å; Y188-W237 AromaticContact CZ-NE1 3.77Å; A197-W237 HydrophobicContact CB-CE3 4.05Å; A197-W237 HydrophobicContact CB-CZ3 3.91Å; A201-W237 HydrophobicContact CB-CZ3 4.33Å; N233-W237 HydrophobicContact CB-CD2 4.17Å; N233-W237 HydrophobicContact CB-CE3 4.1Å; N233-W237 HydrophobicContact CB-CH2 3.71Å; N233-W237 HydrophobicContact CB-CZ2 3.76Å; N233-W237 HydrophobicContact CB-CZ3 3.88Å; N233-W237 WeakPolarHBondContact O-CB 3.21Å; N233-W237 VanDerWaalsContact O-CD2 3.24Å; N233-W237 PolarHBondContact O-N 3.12Å; W237-I241 WeakPolarHBondContact O-CD1 3.4Å; W237-I241 VanDerWaalsContact O-CG1 3.23Å; W237-I241 WeakPolarHBondContact O-CG1 3.37Å; W237-I241 PolarHBondContact O-N 2.95Å
238T90.2Very high78.9Confident74 Ų7480.8 Ų80.845%0.45444%0.441SS..Hα-helixtrans-75.1-31.3175.952.10000112.9L234 T235 L236 S242L234-T238 WeakPolarHBondContact O-CB 3.33Å; L234-T238 VanDerWaalsContact O-CG2 3.29Å; L234-T238 WeakPolarHBondContact O-CG2 3.5Å; L234-T238 PolarHBondContact O-N 2.96Å; L234-T238 PolarHBondContact O-OG1 2.92Å; T235-T238 PolarHBondContact O-OG1 3.48Å; L236-T238 PolarHBondContact O-N 3.3Å; T238-S242 PolarHBondContact O-N 3.24Å; T238-S242 PolarHBondContact O-OG 3.3Å
239S85.9Confident76.4Confident42 Ų4283.2 Ų83.229%0.29446%0.456SS..Hα-helixtrans-65.5-43.1169.752.80000111.5T235 L236 I241 S242 E243T235-S239 PolarHBondContact O-N 3.21Å; T235-S239 PolarHBondContact O-OG 3.25Å; L236-S239 PolarHBondContact O-N 3.36Å; L236-S239 PolarHBondContact O-OG 3.44Å; S239-I241 VanDerWaalsContact C-N 3.28Å; S239-I241 PolarHBondContact O-N 3.11Å; S239-S242 WeakPolarHBondContact CA-OG 3.06Å; S239-S242 PolarHBondContact O-N 2.98Å; S239-S242 PolarHBondContact O-OG 3.12Å; S239-E243 PolarHBondContact O-N 3.31Å
240D79.4Confident73.9Confident69 Ų6990 Ų9037%0.36948%0.477SS..Hα-helixtrans-60.8-37.2179.6-69.2-4.3000112Y188 L236Y188-D240 PolarHBondContact OH-OD2 3.23Å; L236-D240 VanDerWaalsContact O-CG 3.3Å; L236-D240 PolarHBondContact O-N 3.35Å
241I76.7Confident71.2Confident71 Ų7199 Ų9936%0.36452%0.519SS..Hα-helixtrans-69.4-35.9176-64.1161.9000111.6P194 W237 S239P194-I241 HydrophobicContact CB-CD1 4.08Å; P194-I241 HydrophobicContact CB-CG1 4.2Å; W237-I241 WeakPolarHBondContact O-CD1 3.4Å; W237-I241 VanDerWaalsContact O-CG1 3.23Å; W237-I241 WeakPolarHBondContact O-CG1 3.37Å; W237-I241 PolarHBondContact O-N 2.95Å; S239-I241 VanDerWaalsContact C-N 3.28Å; S239-I241 PolarHBondContact O-N 3.11Å
242S67.9Low68.4Low93 Ų9399.4 Ų99.465%0.6554%0.535SS*.Hα-helixtrans-76.6-22-179.764.70000114T238 S239T238-S242 PolarHBondContact O-N 3.24Å; T238-S242 PolarHBondContact O-OG 3.3Å; S239-S242 WeakPolarHBondContact CA-OG 3.06Å; S239-S242 PolarHBondContact O-N 2.98Å; S239-S242 PolarHBondContact O-OG 3.12Å
243E59.3Low66Low151 Ų151101.9 Ų101.971%0.70656%0.555SS**THydrogen-bonded Turntrans-86.8-4.3177-70.2-175.1-17500113.4S239 P245S239-E243 PolarHBondContact O-N 3.31Å; E243-P245 WeakPolarHBondContact O-CD 3.33Å
244D47.3Very low63.6Low120 Ų120109.2 Ų109.264%0.64259%0.585SS**SBendtrans-66118.7178.1-150.4-6.4000109.6A246D244-A246 PolarHBondContact O-N 3.12Å
245P47.4Very low61Low90 Ų90116 Ų11658%0.58462%0.616SS**G310 helixtrans-71.922.4-160.44.32.4000116.5E243 E247 E248E243-P245 WeakPolarHBondContact O-CD 3.33Å; P245-E247 PolarHBondContact O-N 3.39Å; P245-E247 VanDerWaalsContact O-N 3.17Å; P245-E248 PolarHBondContact O-N 2.98Å
246A51.2Low58.7Low89 Ų89119.3 Ų119.374%0.73663%0.631SS**G310 helixtrans-67.1-11.3177.500000113.8D244D244-A246 PolarHBondContact O-N 3.12Å
247E45.2Very low56.3Low161 Ų161121.6 Ų121.675%0.75264%0.643SS**G310 helixtrans-97.7-10.2178-69.4-15314500115.9P245 I249P245-E247 PolarHBondContact O-N 3.39Å; P245-E247 VanDerWaalsContact O-N 3.17Å; E247-I249 VanDerWaalsContact C-N 3.25Å; E247-I249 PolarHBondContact O-N 3.26Å
248E43.3Very low54Low178 Ų178126.7 Ų126.783%0.83268%0.68SS**G310 helixtrans-75-5179.6-86.6-166.4161.500114.9P245P245-E248 PolarHBondContact O-N 2.98Å
249I45.6Very low51.5Low151 Ų151132 Ų13277%0.77470%0.7SS**G310 helixtrans-90.85.7-179.1-55.7179000113.3E247E247-I249 VanDerWaalsContact C-N 3.25Å; E247-I249 PolarHBondContact O-N 3.26Å
250R45.1Very low49.2Very low215 Ų215133.5 Ų133.581%0.81172%0.722SS**G310 helixtrans-92.4-1-176.1-76.2-169179.2170.25117.5
251E39.6Very low47.3Very low191 Ų191143.4 Ų143.489%0.89377%0.766SS**  trans-119.560174.7-66.7-165.3167.700112.8P253E251-P253 WeakPolarHBondContact O-CD 3.43Å
252A38.1Very low45.9Very low85 Ų85147.1 Ų147.170%0.70279%0.786SS**  trans-82.9114.6154.100000108K254A252-K254 PolarHBondContact O-N 3.31Å
253P47Very low44.7Very low124 Ų124149.9 Ų149.981%0.80579%0.793SS**  trans-64.2124.6-17824.4-30.6000109.3E251 H255E251-P253 WeakPolarHBondContact O-CD 3.43Å; P253-H255 PolarHBondContact O-N 3.15Å
254K47.2Very low43.9Very low191 Ų191149.8 Ų149.883%0.8380%0.798SS**  trans-53108.9171.5-71.2178.3177.3176.90108.2A252 D256A252-K254 PolarHBondContact O-N 3.31Å; K254-D256 VanDerWaalsContact C-N 3.3Å; K254-D256 PolarHBondContact O-N 3.47Å
255H41.7Very low43.7Very low165 Ų165151.6 Ų151.676%0.76481%0.807SS**  trans-7093.6170.3-161.5-68.2000106.7P253 L257P253-H255 PolarHBondContact O-N 3.15Å; H255-L257 VanDerWaalsContact C-N 3.34Å; H255-L257 PolarHBondContact O-N 3.24Å
256D45.1Very low43.5Very low144 Ų144155.4 Ų155.477%0.7782%0.821SS**  trans-60.597.9170.8-85.6-29.4000108.3K254 S258K254-D256 VanDerWaalsContact C-N 3.3Å; K254-D256 PolarHBondContact O-N 3.47Å; D256-S258 VanDerWaalsContact C-N 3.27Å; D256-S258 PolarHBondContact O-N 3.24Å; D256-S258 VanDerWaalsContact O-N 3.11Å
257L44.9Very low43Very low143 Ų143159.9 Ų159.975%0.74983%0.826SS**  trans-74.787.6161.8-70.2167.6000106.4H255 E259H255-L257 VanDerWaalsContact C-N 3.34Å; H255-L257 PolarHBondContact O-N 3.24Å; L257-E259 VanDerWaalsContact C-N 3.28Å; L257-E259 PolarHBondContact O-N 2.73Å
258S45.5Very low42.8Very low114 Ų114159.8 Ų159.880%0.79783%0.832SS**  trans-70.991.4166.362.20000108.4D256D256-S258 VanDerWaalsContact C-N 3.27Å; D256-S258 PolarHBondContact O-N 3.24Å; D256-S258 VanDerWaalsContact O-N 3.11Å
259E38.9Very low42.8Very low186 Ų186158.4 Ų158.487%0.86983%0.832SS**  trans-64.8137.1162.8-68.2-179.5147.200110.1L257L257-E259 VanDerWaalsContact C-N 3.28Å; L257-E259 PolarHBondContact O-N 2.73Å
260G37.4Very low42.5Very low73 Ų73159 Ų15975%0.75384%0.836SS**  trans98.886.4151.300000116.6
261Q39.7Very low42.3Very low277 Ų277153.9 Ų153.9100%1.29484%0.839SS**  -172.80115.8-99.2173.35.500111.2

Retrieved 261 of 261 residues in 353.8 ms (Link to these results)

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