A0A077ZJU4_TRITR Loading...

DUF218 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJU4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 307 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
1M55Low69.4Low142 Ų14289.2 Ų89.270%0.751%0.514SS*.  0-41.20-72.5-55.3-164.500113.6Y3 A5 L23M1-Y3 PolarHBondContact O-N 2.77Å; M1-A5 WeakPolarHBondContact O-CB 3.38Å; M1-A5 PolarHBondContact O-N 3.32Å; M1-L23 HydrophobicContact CE-CB 3.7Å; M1-L23 HydrophobicContact CE-CD1 4.16Å; M1-L23 HydrophobicContact CE-CG 4.39Å; M1-L23 HydrophobicContact SD-CD1 4.48Å
2G66.7Low69.8Low60 Ų6089.4 Ų89.462%0.61953%0.525SS*.Hα-helixtrans-53.2-54.3-170.300000116.5L6G2-L6 WeakPolarHBondContact O-CB 3.41Å; G2-L6 PolarHBondContact O-N 3.16Å
3Y72.4Confident70.6Confident186 Ų18686.2 Ų86.273%0.72951%0.51SS*.Hα-helixtrans-70.5-45.6-174.2-173.6-105.1000113.6M1 A5 L6 V7M1-Y3 PolarHBondContact O-N 2.77Å; Y3-A5 VanDerWaalsContact C-N 3.34Å; Y3-A5 PolarHBondContact O-N 3.27Å; Y3-L6 WeakPolarHBondContact O-CB 3.48Å; Y3-L6 PolarHBondContact O-N 3.47Å; Y3-V7 HydrophobicContact CD1-CG2 4.29Å; Y3-V7 HydrophobicContact CE1-CG2 3.93Å; Y3-V7 HydrophobicContact CE2-CG2 4.29Å; Y3-V7 WeakPolarHBondContact O-CG2 3.35Å; Y3-V7 PolarHBondContact O-N 3.12Å
4V68.5Low71.4Confident89 Ų8990.6 Ų90.654%0.53953%0.529SS..Hα-helixtrans-64.8-39.7177.7178.70000110.9L6 V7 T8V4-L6 VanDerWaalsContact C-N 3.35Å; V4-L6 PolarHBondContact O-N 2.91Å; V4-V7 PolarHBondContact O-N 3.32Å; V4-T8 VanDerWaalsContact O-CB 3.23Å; V4-T8 WeakPolarHBondContact O-CB 3.46Å; V4-T8 PolarHBondContact O-N 3.05Å; V4-T8 PolarHBondContact O-OG1 3.09Å
5A68.2Low72.3Confident25 Ų2593.7 Ų93.721%0.20754%0.541CS..Hα-helixtrans-60.8-45.3174.800000111.7M1 Y3 T8 L9 L20M1-A5 WeakPolarHBondContact O-CB 3.38Å; M1-A5 PolarHBondContact O-N 3.32Å; Y3-A5 VanDerWaalsContact C-N 3.34Å; Y3-A5 PolarHBondContact O-N 3.27Å; A5-T8 PolarHBondContact O-N 2.94Å; A5-L9 WeakPolarHBondContact O-CB 3.48Å; A5-L9 WeakPolarHBondContact O-CD1 3.46Å; A5-L9 VanDerWaalsContact O-CG 3.29Å; A5-L9 WeakPolarHBondContact O-CG 3.44Å; A5-L9 PolarHBondContact O-N 2.74Å; A5-L20 HydrophobicContact CB-CD1 4.41Å; A5-L20 HydrophobicContact CB-CD2 4.14Å
6L71Confident72.7Confident113 Ų11388.4 Ų88.459%0.59251%0.513SS*.Hα-helixtrans-60.1-50.3177.9-164.481.6000111.7G2 Y3 V4 T8 L9 T10G2-L6 WeakPolarHBondContact O-CB 3.41Å; G2-L6 PolarHBondContact O-N 3.16Å; Y3-L6 WeakPolarHBondContact O-CB 3.48Å; Y3-L6 PolarHBondContact O-N 3.47Å; V4-L6 VanDerWaalsContact C-N 3.35Å; V4-L6 PolarHBondContact O-N 2.91Å; L6-T8 VanDerWaalsContact C-N 3.3Å; L6-T8 PolarHBondContact O-N 3.38Å; L6-L9 PolarHBondContact O-N 2.68Å; L6-T10 WeakPolarHBondContact O-CG2 3.36Å; L6-T10 PolarHBondContact O-N 2.79Å; L6-T10 PolarHBondContact O-OG1 3.02Å; L6-T10 VanDerWaalsContact O-OG1 3.1Å
7V71.4Confident73.3Confident65 Ų6588.1 Ų88.139%0.39451%0.507SS..Hα-helixtrans-63.2-36.6179.91710000112.1Y3 V4 T10 A11Y3-V7 HydrophobicContact CD1-CG2 4.29Å; Y3-V7 HydrophobicContact CE1-CG2 3.93Å; Y3-V7 HydrophobicContact CE2-CG2 4.29Å; Y3-V7 WeakPolarHBondContact O-CG2 3.35Å; Y3-V7 PolarHBondContact O-N 3.12Å; V4-V7 PolarHBondContact O-N 3.32Å; V7-T10 WeakPolarHBondContact CA-OG1 3.26Å; V7-T10 PolarHBondContact O-OG1 3Å; V7-A11 WeakPolarHBondContact O-CB 3.34Å; V7-A11 PolarHBondContact O-N 3.28Å
8T68.3Low73.9Confident17 Ų1785.7 Ų85.710%0.10450%0.504CS..Hα-helixtrans-76-37-177.2-55.20000112.1V4 A5 L6 S12 G16 L20V4-T8 VanDerWaalsContact O-CB 3.23Å; V4-T8 WeakPolarHBondContact O-CB 3.46Å; V4-T8 PolarHBondContact O-N 3.05Å; V4-T8 PolarHBondContact O-OG1 3.09Å; A5-T8 PolarHBondContact O-N 2.94Å; L6-T8 VanDerWaalsContact C-N 3.3Å; L6-T8 PolarHBondContact O-N 3.38Å; T8-S12 PolarHBondContact O-N 3.26Å; T8-G16 WeakPolarHBondContact CG2-O 3.28Å; T8-L20 HydrophobicContact CG2-CD1 3.57Å; T8-L20 HydrophobicContact CG2-CG 4.03Å
9L70.8Confident74.6Confident114 Ų11486.1 Ų86.160%0.59750%0.503SS*.Hα-helixtrans-66.6-39173.8-75.8165.2000111.3A5 L6A5-L9 WeakPolarHBondContact O-CB 3.48Å; A5-L9 WeakPolarHBondContact O-CD1 3.46Å; A5-L9 VanDerWaalsContact O-CG 3.29Å; A5-L9 WeakPolarHBondContact O-CG 3.44Å; A5-L9 PolarHBondContact O-N 2.74Å; L6-L9 PolarHBondContact O-N 2.68Å
10T75Confident75.1Confident107 Ų10783.3 Ų83.366%0.65649%0.485SS*.Hα-helixtrans-72.7-34.1177.153.90000112.7L6 V7 S12L6-T10 WeakPolarHBondContact O-CG2 3.36Å; L6-T10 PolarHBondContact O-N 2.79Å; L6-T10 PolarHBondContact O-OG1 3.02Å; L6-T10 VanDerWaalsContact O-OG1 3.1Å; V7-T10 WeakPolarHBondContact CA-OG1 3.26Å; V7-T10 PolarHBondContact O-OG1 3Å; T10-S12 PolarHBondContact O-N 2.96Å
11A75.9Confident75.7Confident63 Ų6381.3 Ų81.352%0.52148%0.483SS..THydrogen-bonded Turntrans-74-9.1179.100000114.4V7 S13V7-A11 WeakPolarHBondContact O-CB 3.34Å; V7-A11 PolarHBondContact O-N 3.28Å; A11-S13 PolarHBondContact O-N 3.01Å
12S74.7Confident77.2Confident92 Ų9279.5 Ų79.564%0.64348%0.476SS*.THydrogen-bonded Turntrans48.326.2-177.5-56.80000114.2T8 T10 L14T8-S12 PolarHBondContact O-N 3.26Å; T10-S12 PolarHBondContact O-N 2.96Å; S12-L14 PolarHBondContact O-N 3.44Å
13S80Confident78.3Confident48 Ų4879.8 Ų79.834%0.33646%0.463SS..  trans-81.1123.7-175.2850000109.7A11 I15 G16 M17A11-S13 PolarHBondContact O-N 3.01Å; S13-I15 PolarHBondContact O-N 3.49Å; S13-G16 PolarHBondContact O-N 3.42Å; S13-G16 WeakPolarHBondContact OG-CA 3.33Å; S13-G16 PolarHBondContact OG-N 2.97Å; S13-M17 PolarHBondContact O-N 3.39Å
14L82.4Confident78.9Confident148 Ų14873.7 Ų73.778%0.77545%0.451SS*.Hα-helixtrans-58.7-39.1179.5-161.781.1000111.3S12 G18S12-L14 PolarHBondContact O-N 3.44Å; L14-G18 PolarHBondContact O-N 3.4Å
15I84.2Confident79.8Confident137 Ų13773.8 Ų73.870%0.70345%0.448SS*.Hα-helixtrans-63.1-47.3177.3-61.4173.1000110.4S13 G18 I19S13-I15 PolarHBondContact O-N 3.49Å; I15-G18 PolarHBondContact O-N 3.37Å; I15-I19 HydrophobicContact CG2-CD1 4Å; I15-I19 WeakPolarHBondContact O-CG1 3.33Å; I15-I19 PolarHBondContact O-N 2.91Å
16G79.3Confident80.7Confident9 Ų977.2 Ų77.29%0.09346%0.462CS..Hα-helixtrans-66.4-42.1-179.600000112.1T8 S13 G18 I19 L20T8-G16 WeakPolarHBondContact CG2-O 3.28Å; S13-G16 PolarHBondContact O-N 3.42Å; S13-G16 WeakPolarHBondContact OG-CA 3.33Å; S13-G16 PolarHBondContact OG-N 2.97Å; G16-G18 VanDerWaalsContact C-N 3.29Å; G16-G18 PolarHBondContact O-N 2.5Å; G16-I19 PolarHBondContact O-N 3.09Å; G16-L20 PolarHBondContact O-N 2.87Å
17M81.6Confident81.4Confident83 Ų8378 Ų7841%0.40946%0.461SS..Hα-helixtrans-60.4-40172.7-72.8-169.8-75.500111.5S13 L20 G21S13-M17 PolarHBondContact O-N 3.39Å; M17-L20 PolarHBondContact O-N 3Å; M17-G21 PolarHBondContact O-N 3.41Å
18G85.8Confident82Confident45 Ų4579 Ų7946%0.46446%0.463SS..Hα-helixtrans-60-45.4172.900000112.9L14 I15 G16 G21 L22L14-G18 PolarHBondContact O-N 3.4Å; I15-G18 PolarHBondContact O-N 3.37Å; G16-G18 VanDerWaalsContact C-N 3.29Å; G16-G18 PolarHBondContact O-N 2.5Å; G18-G21 PolarHBondContact O-N 3.13Å; G18-L22 WeakPolarHBondContact O-CB 3.42Å; G18-L22 PolarHBondContact O-N 3.06Å
19I86.2Confident82.7Confident93 Ų9381.8 Ų81.848%0.47748%0.476SS..Hα-helixtrans-63.3-45.5176.5-68.6167.4000110.8I15 G16 G21 L22 L23I15-I19 HydrophobicContact CG2-CD1 4Å; I15-I19 WeakPolarHBondContact O-CG1 3.33Å; I15-I19 PolarHBondContact O-N 2.91Å; G16-I19 PolarHBondContact O-N 3.09Å; I19-G21 PolarHBondContact O-N 3.21Å; I19-L22 PolarHBondContact O-N 3.34Å; I19-L23 HydrophobicContact CG2-CD1 3.95Å; I19-L23 HydrophobicContact CG2-CG 4.34Å; I19-L23 WeakPolarHBondContact O-CB 3.46Å; I19-L23 VanDerWaalsContact O-CG 3.29Å; I19-L23 WeakPolarHBondContact O-CG 3.38Å; I19-L23 PolarHBondContact O-N 2.98Å
20L84.8Confident83.4Confident29 Ų2980.8 Ų80.815%0.15248%0.475CS..Hα-helixtrans-61.9-42.8176.6-75.3178000112.1A5 T8 G16 M17 L23 A24A5-L20 HydrophobicContact CB-CD1 4.41Å; A5-L20 HydrophobicContact CB-CD2 4.14Å; T8-L20 HydrophobicContact CG2-CD1 3.57Å; T8-L20 HydrophobicContact CG2-CG 4.03Å; G16-L20 PolarHBondContact O-N 2.87Å; M17-L20 PolarHBondContact O-N 3Å; L20-L23 PolarHBondContact O-N 3.46Å; L20-A24 WeakPolarHBondContact O-CB 3.49Å; L20-A24 PolarHBondContact O-N 3.06Å
21G86.6Confident83.6Confident43 Ų4380.7 Ų80.744%0.44347%0.47SS..Hα-helixtrans-59.9-44.9175.800000111.9M17 G18 I19 A24 L25M17-G21 PolarHBondContact O-N 3.41Å; G18-G21 PolarHBondContact O-N 3.13Å; I19-G21 PolarHBondContact O-N 3.21Å; G21-A24 PolarHBondContact O-N 3.45Å; G21-L25 WeakPolarHBondContact O-CB 3.32Å; G21-L25 PolarHBondContact O-N 3.32Å
22L88.5Confident83.9Confident104 Ų10481.8 Ų81.855%0.54547%0.466SS..Hα-helixtrans-62.5-45.1175.3-178.167.5000111.9G18 I19 A24 L25 L26G18-L22 WeakPolarHBondContact O-CB 3.42Å; G18-L22 PolarHBondContact O-N 3.06Å; I19-L22 PolarHBondContact O-N 3.34Å; L22-A24 PolarHBondContact O-N 3.44Å; L22-L25 PolarHBondContact O-N 3Å; L22-L26 HydrophobicContact CG-CD1 4.29Å; L22-L26 WeakPolarHBondContact O-CG 3.44Å; L22-L26 PolarHBondContact O-N 2.93Å
23L88.1Confident84.6Confident66 Ų6683.1 Ų83.135%0.34646%0.46SS..Hα-helixtrans-63.9-40177.7-73.6174.8000112.1M1 I19 L20 L26 F27M1-L23 HydrophobicContact CE-CB 3.7Å; M1-L23 HydrophobicContact CE-CD1 4.16Å; M1-L23 HydrophobicContact CE-CG 4.39Å; M1-L23 HydrophobicContact SD-CD1 4.48Å; I19-L23 HydrophobicContact CG2-CD1 3.95Å; I19-L23 HydrophobicContact CG2-CG 4.34Å; I19-L23 WeakPolarHBondContact O-CB 3.46Å; I19-L23 VanDerWaalsContact O-CG 3.29Å; I19-L23 WeakPolarHBondContact O-CG 3.38Å; I19-L23 PolarHBondContact O-N 2.98Å; L20-L23 PolarHBondContact O-N 3.46Å; L23-L26 PolarHBondContact O-N 3.23Å; L23-F27 WeakPolarHBondContact O-CB 3.18Å; L23-F27 PolarHBondContact O-N 3.21Å
24A85Confident85Confident57 Ų5782 Ų8247%0.47146%0.456SS..Hα-helixtrans-65.2-41.117500000111.4L20 G21 L22 F27 L28L20-A24 WeakPolarHBondContact O-CB 3.49Å; L20-A24 PolarHBondContact O-N 3.06Å; G21-A24 PolarHBondContact O-N 3.45Å; L22-A24 PolarHBondContact O-N 3.44Å; A24-F27 PolarHBondContact O-N 3.44Å; A24-L28 WeakPolarHBondContact O-CB 3.42Å; A24-L28 PolarHBondContact O-N 3.32Å
25L89.1Confident85.3Confident92 Ų9278.7 Ų78.748%0.48244%0.439SS..Hα-helixtrans-62.1-46.6174.4-177.968.1000111.4G21 L22 F27 L28 M29G21-L25 WeakPolarHBondContact O-CB 3.32Å; G21-L25 PolarHBondContact O-N 3.32Å; L22-L25 PolarHBondContact O-N 3Å; L25-F27 VanDerWaalsContact C-N 3.32Å; L25-F27 PolarHBondContact O-N 2.88Å; L25-L28 PolarHBondContact O-N 2.73Å; L25-M29 HydrophobicContact CD1-CE 4.33Å; L25-M29 WeakPolarHBondContact O-CG 3.45Å; L25-M29 PolarHBondContact O-N 3.05Å
26L87Confident85.7Confident96 Ų9678.4 Ų78.450%0.50343%0.43SS..Hα-helixtrans-62-40.1176.4-73.4170.9000112.1L22 L23 M29 T30L22-L26 HydrophobicContact CG-CD1 4.29Å; L22-L26 WeakPolarHBondContact O-CG 3.44Å; L22-L26 PolarHBondContact O-N 2.93Å; L23-L26 PolarHBondContact O-N 3.23Å; L26-M29 PolarHBondContact O-N 2.85Å; L26-T30 WeakPolarHBondContact O-CB 3.39Å; L26-T30 PolarHBondContact O-N 3.42Å; L26-T30 PolarHBondContact O-OG1 2.78Å
27F85.7Confident86.3Confident131 Ų13180.7 Ų80.758%0.57545%0.448SS*.Hα-helixtrans-63.2-44.9174.6-178.4-107.8000111.6L23 A24 L25 T30 I31L23-F27 WeakPolarHBondContact O-CB 3.18Å; L23-F27 PolarHBondContact O-N 3.21Å; A24-F27 PolarHBondContact O-N 3.44Å; L25-F27 VanDerWaalsContact C-N 3.32Å; L25-F27 PolarHBondContact O-N 2.88Å; F27-T30 WeakPolarHBondContact O-CB 3.46Å; F27-T30 PolarHBondContact O-N 2.92Å; F27-I31 HydrophobicContact CD1-CD1 3.83Å; F27-I31 HydrophobicContact CE1-CD1 3.33Å; F27-I31 HydrophobicContact CE1-CG1 4.39Å; F27-I31 HydrophobicContact CE2-CD1 4.34Å; F27-I31 HydrophobicContact CZ-CD1 3.63Å; F27-I31 HydrophobicContact CZ-CG1 4.38Å; F27-I31 PolarHBondContact O-N 3.09Å
28L83.5Confident86.8Confident84 Ų8478.6 Ų78.644%0.4444%0.443SS..Hα-helixtrans-60.7-46.5175-178.566.7000111.5A24 L25 T30 I31 L32A24-L28 WeakPolarHBondContact O-CB 3.42Å; A24-L28 PolarHBondContact O-N 3.32Å; L25-L28 PolarHBondContact O-N 2.73Å; L28-T30 PolarHBondContact O-N 3.44Å; L28-I31 PolarHBondContact O-N 3.1Å; L28-I31 VanDerWaalsContact O-N 3.16Å; L28-L32 HydrophobicContact CD1-CD1 4.11Å; L28-L32 HydrophobicContact CD1-CG 4.28Å; L28-L32 HydrophobicContact CG-CD1 3.91Å; L28-L32 HydrophobicContact CG-CG 4.43Å; L28-L32 WeakPolarHBondContact O-CG 3.36Å; L28-L32 PolarHBondContact O-N 3.32Å
29M83.3Confident87.3Confident76 Ų7677.2 Ų77.237%0.37443%0.426SS..Hα-helixtrans-59.5-37.3175.5-71.2-60.5108.300111.7L25 L26 L32 F33L25-M29 HydrophobicContact CD1-CE 4.33Å; L25-M29 WeakPolarHBondContact O-CG 3.45Å; L25-M29 PolarHBondContact O-N 3.05Å; L26-M29 PolarHBondContact O-N 2.85Å; M29-L32 HydrophobicContact CE-CD1 4.1Å; M29-L32 PolarHBondContact O-N 2.63Å; M29-F33 HydrophobicContact CE-CE2 4.21Å; M29-F33 WeakPolarHBondContact O-CA 3.21Å; M29-F33 WeakPolarHBondContact O-CB 3.39Å; M29-F33 PolarHBondContact O-N 2.87Å; M29-F33 HydrophobicContact SD-CD2 3.8Å; M29-F33 HydrophobicContact SD-CE2 3.68Å
30T83.7Confident87.7Confident93 Ų9378.7 Ų78.757%0.57143%0.434SS*.Hα-helixtrans-67.4-39.8176.4-550000111.7L26 F27 L28 G34L26-T30 WeakPolarHBondContact O-CB 3.39Å; L26-T30 PolarHBondContact O-N 3.42Å; L26-T30 PolarHBondContact O-OG1 2.78Å; F27-T30 WeakPolarHBondContact O-CB 3.46Å; F27-T30 PolarHBondContact O-N 2.92Å; L28-T30 PolarHBondContact O-N 3.44Å; T30-G34 WeakPolarHBondContact O-CA 3.32Å; T30-G34 PolarHBondContact O-N 3.14Å
31I80.2Confident88.2Confident106 Ų10682.9 Ų82.954%0.54445%0.451SS..Hα-helixtrans-65.7-44.5175.5-70.7170.3000111F27 L28F27-I31 HydrophobicContact CD1-CD1 3.83Å; F27-I31 HydrophobicContact CE1-CD1 3.33Å; F27-I31 HydrophobicContact CE1-CG1 4.39Å; F27-I31 HydrophobicContact CE2-CD1 4.34Å; F27-I31 HydrophobicContact CZ-CD1 3.63Å; F27-I31 HydrophobicContact CZ-CG1 4.38Å; F27-I31 PolarHBondContact O-N 3.09Å; L28-I31 PolarHBondContact O-N 3.1Å; L28-I31 VanDerWaalsContact O-N 3.16Å
32L83.2Confident88.6Confident85 Ų8581.8 Ų81.845%0.44544%0.435SS..Hα-helixtrans-74.1-42.4-175.4-67.1175.5000112.6L28 M29 Y36L28-L32 HydrophobicContact CD1-CD1 4.11Å; L28-L32 HydrophobicContact CD1-CG 4.28Å; L28-L32 HydrophobicContact CG-CD1 3.91Å; L28-L32 HydrophobicContact CG-CG 4.43Å; L28-L32 WeakPolarHBondContact O-CG 3.36Å; L28-L32 PolarHBondContact O-N 3.32Å; M29-L32 HydrophobicContact CE-CD1 4.1Å; M29-L32 PolarHBondContact O-N 2.63Å; L32-Y36 WeakPolarHBondContact O-CE2 3.4Å
33F88.2Confident88.9Confident120 Ų12078.9 Ų78.953%0.52642%0.419SS..Hα-helixtrans-116.2-12.7-169.6-59.3-72.3000114.3M29 I35 Y36 A37M29-F33 HydrophobicContact CE-CE2 4.21Å; M29-F33 WeakPolarHBondContact O-CA 3.21Å; M29-F33 WeakPolarHBondContact O-CB 3.39Å; M29-F33 PolarHBondContact O-N 2.87Å; M29-F33 HydrophobicContact SD-CD2 3.8Å; M29-F33 HydrophobicContact SD-CE2 3.68Å; F33-I35 VanDerWaalsContact C-N 3.33Å; F33-I35 PolarHBondContact O-N 2.99Å; F33-Y36 PolarHBondContact O-N 3.15Å; F33-Y36 VanDerWaalsContact O-N 3.15Å; F33-A37 WeakPolarHBondContact O-CB 3.46Å; F33-A37 PolarHBondContact O-N 2.91Å
34G88.9Confident89.3Confident24 Ų2477.3 Ų77.325%0.24742%0.419CS..Hα-helixtrans-60.9-38.5-171.700000113.5T30 A37 A38T30-G34 WeakPolarHBondContact O-CA 3.32Å; T30-G34 PolarHBondContact O-N 3.14Å; G34-A37 PolarHBondContact O-N 2.86Å; G34-A38 VanDerWaalsContact O-CB 3.31Å; G34-A38 WeakPolarHBondContact O-CB 3.34Å; G34-A38 PolarHBondContact O-N 3.36Å
35I88.9Confident89.8Confident80 Ų8075 Ų7541%0.4140%0.399SS..Hα-helixtrans-66.7-40.5177.6-163.8169.2000112F33 A38 V39 I69 I73F33-I35 VanDerWaalsContact C-N 3.33Å; F33-I35 PolarHBondContact O-N 2.99Å; I35-A38 PolarHBondContact O-N 2.97Å; I35-V39 WeakPolarHBondContact O-CG2 3.47Å; I35-V39 PolarHBondContact O-N 3.22Å; I35-I69 HydrophobicContact CD1-CG2 3.94Å; I35-I69 HydrophobicContact CG1-CG2 3.82Å; I35-I73 HydrophobicContact CD1-CD1 4Å; I35-I73 HydrophobicContact CD1-CG1 4.21Å; I35-I73 HydrophobicContact CG1-CD1 4.23Å
36Y91.6Very high90.1Very high131 Ų13170.7 Ų70.751%0.51438%0.376SS..Hα-helixtrans-69.3-42.2178-56.5-73.2000111L32 F33 A38 V39 I40 I73L32-Y36 WeakPolarHBondContact O-CE2 3.4Å; F33-Y36 PolarHBondContact O-N 3.15Å; F33-Y36 VanDerWaalsContact O-N 3.15Å; Y36-A38 VanDerWaalsContact C-N 3.29Å; Y36-A38 PolarHBondContact O-N 3.11Å; Y36-V39 PolarHBondContact O-N 3.5Å; Y36-I40 WeakPolarHBondContact O-CG1 3.26Å; Y36-I40 PolarHBondContact O-N 3.2Å; Y36-I73 HydrophobicContact CE1-CD1 4.49Å
37A92.7Very high90.4Very high56 Ų5672 Ų7246%0.46338%0.378SS..Hα-helixtrans-59.3-41.9173.200000111.4F33 G34 I40 F41F33-A37 WeakPolarHBondContact O-CB 3.46Å; F33-A37 PolarHBondContact O-N 2.91Å; G34-A37 PolarHBondContact O-N 2.86Å; A37-I40 PolarHBondContact O-N 2.81Å; A37-F41 VanDerWaalsContact O-CB 3.24Å; A37-F41 WeakPolarHBondContact O-CB 3.4Å; A37-F41 PolarHBondContact O-N 3.39Å
38A92.5Very high90.8Very high39 Ų3969.5 Ų69.532%0.32237%0.37SS..Hα-helixtrans-63.1-43.5175.700000112.1G34 I35 Y36 F41 L42G34-A38 VanDerWaalsContact O-CB 3.31Å; G34-A38 WeakPolarHBondContact O-CB 3.34Å; G34-A38 PolarHBondContact O-N 3.36Å; I35-A38 PolarHBondContact O-N 2.97Å; Y36-A38 VanDerWaalsContact C-N 3.29Å; Y36-A38 PolarHBondContact O-N 3.11Å; A38-F41 PolarHBondContact O-N 3.14Å; A38-L42 WeakPolarHBondContact O-CB 3.42Å; A38-L42 WeakPolarHBondContact O-CG 3.38Å; A38-L42 PolarHBondContact O-N 3.2Å
39V94.7Very high91.3Very high16 Ų1665.5 Ų65.510%0.09735%0.349CS..Hα-helixtrans-61.5-49176.2169.10000111.3I35 Y36 F41 L42 I43 I69 V70I35-V39 WeakPolarHBondContact O-CG2 3.47Å; I35-V39 PolarHBondContact O-N 3.22Å; Y36-V39 PolarHBondContact O-N 3.5Å; V39-F41 VanDerWaalsContact C-N 3.28Å; V39-F41 PolarHBondContact O-N 3.19Å; V39-L42 PolarHBondContact O-N 2.85Å; V39-I43 HydrophobicContact CG1-CD1 3.7Å; V39-I43 HydrophobicContact CG1-CG1 4.43Å; V39-I43 WeakPolarHBondContact O-CB 3.45Å; V39-I43 WeakPolarHBondContact O-CG1 3.24Å; V39-I43 PolarHBondContact O-N 2.76Å; V39-I69 HydrophobicContact CG2-CB 3.92Å; V39-I69 HydrophobicContact CG2-CG2 3.45Å; V39-I69 VanDerWaalsContact CG2-CG2 3.45Å; V39-V70 HydrophobicContact CG1-CG2 3.54Å; V39-V70 HydrophobicContact CG2-CG2 4.32Å
40I95.5Very high91.7Very high125 Ų12563.8 Ų63.864%0.64134%0.341SS*.Hα-helixtrans-58.9-44.7178-67.8166.4000110Y36 A37 G44Y36-I40 WeakPolarHBondContact O-CG1 3.26Å; Y36-I40 PolarHBondContact O-N 3.2Å; A37-I40 PolarHBondContact O-N 2.81Å; I40-G44 WeakPolarHBondContact O-CA 3.49Å; I40-G44 PolarHBondContact O-N 3.5Å
41F95.5Very high92.2Very high116 Ų11669.4 Ų69.451%0.50935%0.352SS..Hα-helixtrans-61.9-48.3177.3171.5-99.9000112.4A37 A38 V39 G44 N45 P266A37-F41 VanDerWaalsContact O-CB 3.24Å; A37-F41 WeakPolarHBondContact O-CB 3.4Å; A37-F41 PolarHBondContact O-N 3.39Å; A38-F41 PolarHBondContact O-N 3.14Å; V39-F41 VanDerWaalsContact C-N 3.28Å; V39-F41 PolarHBondContact O-N 3.19Å; F41-G44 PolarHBondContact O-N 2.77Å; F41-N45 WeakPolarHBondContact O-CB 3.02Å; F41-N45 PolarHBondContact O-N 3.04Å; F41-P266 HydrophobicContact CE1-CB 4.06Å; F41-P266 HydrophobicContact CE1-CG 4.09Å; F41-P266 HydrophobicContact CZ-CB 4.07Å; F41-P266 HydrophobicContact CZ-CG 3.58Å
42L95.6Very high92.6Very high21 Ų2170.1 Ų70.111%0.1135%0.352CS..Hα-helixtrans-63.6-46.8-178.1-75169.7000111.6A38 V39 S46 T62 L65 I69A38-L42 WeakPolarHBondContact O-CB 3.42Å; A38-L42 WeakPolarHBondContact O-CG 3.38Å; A38-L42 PolarHBondContact O-N 3.2Å; V39-L42 PolarHBondContact O-N 2.85Å; L42-S46 PolarHBondContact O-N 2.72Å; L42-T62 HydrophobicContact CD2-CG2 4.09Å; L42-L65 HydrophobicContact CD1-CB 4.41Å; L42-L65 HydrophobicContact CD1-CD2 3.95Å; L42-L65 HydrophobicContact CD1-CG 3.89Å; L42-L65 HydrophobicContact CD2-CD2 4.14Å; L42-I69 HydrophobicContact CD1-CD1 3.73Å
43I94.8Very high92.8Very high43 Ų4369.2 Ų69.222%0.22135%0.346CS..Hα-helixtrans-67-47.5178.4-66.6176000110.1V39 N45 S46 F47V39-I43 HydrophobicContact CG1-CD1 3.7Å; V39-I43 HydrophobicContact CG1-CG1 4.43Å; V39-I43 WeakPolarHBondContact O-CB 3.45Å; V39-I43 WeakPolarHBondContact O-CG1 3.24Å; V39-I43 PolarHBondContact O-N 2.76Å; I43-N45 VanDerWaalsContact C-N 3.35Å; I43-N45 PolarHBondContact O-N 2.83Å; I43-S46 WeakPolarHBondContact O-CB 3.46Å; I43-S46 PolarHBondContact O-N 3.42Å; I43-S46 VanDerWaalsContact O-N 3.14Å; I43-S46 PolarHBondContact O-OG 3.27Å; I43-F47 HydrophobicContact CG2-CD2 4.06Å; I43-F47 HydrophobicContact CG2-CE2 3.52Å; I43-F47 HydrophobicContact CG2-CZ 4.48Å; I43-F47 WeakPolarHBondContact O-CD2 3.48Å; I43-F47 PolarHBondContact O-N 2.83Å
44G95.3Very high92.8Very high32 Ų3266.4 Ų66.433%0.3334%0.341SS..Hα-helixtrans-59-44.2176.900000112.6I40 F41 S46 F47 I48I40-G44 WeakPolarHBondContact O-CA 3.49Å; I40-G44 PolarHBondContact O-N 3.5Å; F41-G44 PolarHBondContact O-N 2.77Å; G44-S46 VanDerWaalsContact C-N 3.32Å; G44-S46 PolarHBondContact O-N 3.01Å; G44-F47 PolarHBondContact O-N 3.43Å; G44-I48 PolarHBondContact O-N 2.82Å
45N95.8Very high92.7Very high10 Ų1075.4 Ų75.45%0.05337%0.368CS..Hα-helixtrans-60-42.4174.9177.7-103.2000111.5F41 I43 F47 I48 V49 T62 Y263F41-N45 WeakPolarHBondContact O-CB 3.02Å; F41-N45 PolarHBondContact O-N 3.04Å; I43-N45 VanDerWaalsContact C-N 3.35Å; I43-N45 PolarHBondContact O-N 2.83Å; N45-F47 VanDerWaalsContact C-N 3.3Å; N45-F47 PolarHBondContact O-N 3.12Å; N45-I48 PolarHBondContact O-N 3.23Å; N45-I48 VanDerWaalsContact O-N 3.09Å; N45-V49 WeakPolarHBondContact O-CG2 3.41Å; N45-V49 PolarHBondContact O-N 3.18Å; N45-T62 PolarHBondContact OD1-OG1 2.87Å; N45-Y263 PolarHBondContact ND2-O 3.39Å
46S94.7Very high92.7Very high1 Ų178.3 Ų78.31%0.00738%0.377CS..Hα-helixtrans-60.3-38.7179.679.60000112.9L42 I43 G44 I48 V49 L50 T62L42-S46 PolarHBondContact O-N 2.72Å; I43-S46 WeakPolarHBondContact O-CB 3.46Å; I43-S46 PolarHBondContact O-N 3.42Å; I43-S46 VanDerWaalsContact O-N 3.14Å; I43-S46 PolarHBondContact O-OG 3.27Å; G44-S46 VanDerWaalsContact C-N 3.32Å; G44-S46 PolarHBondContact O-N 3.01Å; S46-I48 VanDerWaalsContact C-N 3.33Å; S46-I48 PolarHBondContact O-N 3.35Å; S46-V49 PolarHBondContact O-N 3.05Å; S46-L50 WeakPolarHBondContact O-CB 3.46Å; S46-L50 VanDerWaalsContact O-CG 3.24Å; S46-L50 WeakPolarHBondContact O-CG 3.45Å; S46-L50 PolarHBondContact O-N 3.12Å; S46-T62 WeakPolarHBondContact CB-OG1 3.35Å
47F94.6Very high92.6Very high124 Ų12477.6 Ų77.654%0.54438%0.382SS..Hα-helixtrans-64.9-37.4175.4-73.4-66.2000112.3I43 G44 N45 R51I43-F47 HydrophobicContact CG2-CD2 4.06Å; I43-F47 HydrophobicContact CG2-CE2 3.52Å; I43-F47 HydrophobicContact CG2-CZ 4.48Å; I43-F47 WeakPolarHBondContact O-CD2 3.48Å; I43-F47 PolarHBondContact O-N 2.83Å; G44-F47 PolarHBondContact O-N 3.43Å; N45-F47 VanDerWaalsContact C-N 3.3Å; N45-F47 PolarHBondContact O-N 3.12Å; F47-R51 WeakPolarHBondContact O-CG 3.34Å; F47-R51 PolarHBondContact O-N 3.08Å
48I94.2Very high92.5Very high78 Ų7877.5 Ų77.540%0.438%0.376SS..Hα-helixtrans-68.6-44.7177.4-62165000110.3G44 N45 S46 R51 H52 Y263G44-I48 PolarHBondContact O-N 2.82Å; N45-I48 PolarHBondContact O-N 3.23Å; N45-I48 VanDerWaalsContact O-N 3.09Å; S46-I48 VanDerWaalsContact C-N 3.33Å; S46-I48 PolarHBondContact O-N 3.35Å; I48-R51 PolarHBondContact O-N 3.2Å; I48-H52 PolarHBondContact O-ND1 3.49Å; I48-Y263 HydrophobicContact CG2-CD2 4.23Å; I48-Y263 HydrophobicContact CG2-CG 4.13Å
49V93.1Very high92.4Very high0 Ų076.2 Ų76.20%036%0.364CS..Hα-helixtrans-60.4-46.7177172.50000110.3N45 S46 R51 H52 E53 N59 Y263 N267N45-V49 WeakPolarHBondContact O-CG2 3.41Å; N45-V49 PolarHBondContact O-N 3.18Å; S46-V49 PolarHBondContact O-N 3.05Å; V49-R51 PolarHBondContact O-N 3.26Å; V49-H52 PolarHBondContact O-N 2.95Å; V49-E53 HydrophobicContact CG1-CB 4.17Å; V49-E53 HydrophobicContact CG1-CG 4.08Å; V49-E53 WeakPolarHBondContact O-CB 3.44Å; V49-E53 PolarHBondContact O-N 2.87Å; V49-N59 HydrophobicContact CG1-CB 4.13Å; V49-Y263 HydrophobicContact CG2-CD2 4.2Å; V49-N267 HydrophobicContact CG2-CB 4.34Å
50L93Very high92.4Very high40 Ų4077.6 Ų77.621%0.20937%0.371CS..Hα-helixtrans-67.9-15.5-179.3-71.1168.3000114.8S46 R55 L60S46-L50 WeakPolarHBondContact O-CB 3.46Å; S46-L50 VanDerWaalsContact O-CG 3.24Å; S46-L50 WeakPolarHBondContact O-CG 3.45Å; S46-L50 PolarHBondContact O-N 3.12Å; L50-R55 HydrophobicContact CD2-CB 4.39Å; L50-R55 HydrophobicContact CD2-CG 3.98Å; L50-L60 HydrophobicContact CD1-CD2 3.87Å; L50-L60 HydrophobicContact CD2-CD2 3.52Å; L50-L60 HydrophobicContact CD2-CG 4.47Å; L50-L60 HydrophobicContact CG-CD2 4.17Å
51R92.7Very high92.4Very high211 Ų21172.8 Ų72.880%0.79635%0.346SS*.Hα-helixtrans-80.4-27.1171.9-76.5177.2-173.6-170.32.7113F47 I48 V49F47-R51 WeakPolarHBondContact O-CG 3.34Å; F47-R51 PolarHBondContact O-N 3.08Å; I48-R51 PolarHBondContact O-N 3.2Å; V49-R51 PolarHBondContact O-N 3.26Å
52H88.8Confident92.4Very high120 Ų12067.3 Ų67.356%0.55632%0.322SS*.Hα-helixtrans-107.9-24-174.4-63.182.9000112.8I48 V49 Y263I48-H52 PolarHBondContact O-ND1 3.49Å; V49-H52 PolarHBondContact O-N 2.95Å; H52-Y263 HydrophobicContact CB-CE2 3.86Å
53E88.2Confident92.4Very high67 Ų6768.4 Ų68.431%0.31333%0.328SS..SBendtrans-121.4162.9-171.7-54.9-60.8158.100112.3V49 N59 Y263 Y264V49-E53 HydrophobicContact CG1-CB 4.17Å; V49-E53 HydrophobicContact CG1-CG 4.08Å; V49-E53 WeakPolarHBondContact O-CB 3.44Å; V49-E53 PolarHBondContact O-N 2.87Å; E53-N59 WeakPolarHBondContact CB-ND2 3.34Å; E53-Y263 HydrophobicContact CG-CE2 4.25Å; E53-Y263 PolarHBondContact OE1-OH 3.4Å; E53-Y264 HydrophobicContact CG-CD2 4.32Å; E53-Y264 HydrophobicContact CG-CE2 4.5Å
54S86.9Confident92.5Very high61 Ų6170.3 Ų70.343%0.42734%0.338SS..  trans-62.8152.7176.871.20000112.9K56 N59S54-K56 PolarHBondContact O-N 2.88Å; S54-K56 WeakPolarHBondContact OG-CG 3.4Å; S54-N59 VanDerWaalsContact O-CB 3.28Å; S54-N59 WeakPolarHBondContact O-CB 3.14Å; S54-N59 PolarHBondContact O-ND2 2.83Å; S54-N59 PolarHBondContact OG-ND2 3.07Å
55R87.8Confident92.5Very high212 Ų21272 Ų7280%0.834%0.339SS*.  trans-80.636.5176.9-57.6-171.1177.2175-0.1113.7L50L50-R55 HydrophobicContact CD2-CB 4.39Å; L50-R55 HydrophobicContact CD2-CG 3.98Å
56K89.2Confident92.5Very high141 Ų14171.5 Ų71.561%0.61334%0.336SS*.SBendtrans-80.4154.7175.6-67-176.6178.9-174.60110.1S54 P58 N59S54-K56 PolarHBondContact O-N 2.88Å; S54-K56 WeakPolarHBondContact OG-CG 3.4Å; K56-P58 VanDerWaalsContact C-N 3.3Å; K56-P58 VanDerWaalsContact O-N 3.15Å; K56-N59 WeakPolarHBondContact O-CB 3.28Å; K56-N59 PolarHBondContact O-N 2.76Å
57L89.8Confident92.7Very high117 Ų11776 Ų7661%0.61336%0.36SS*.G310 helixtrans-48-42.5-179.4-177.863.8000114.3N59 L60 I64L57-N59 PolarHBondContact O-N 2.82Å; L57-N59 VanDerWaalsContact O-N 3.12Å; L57-L60 PolarHBondContact O-N 3.32Å; L57-I64 HydrophobicContact CD1-CD1 3.68Å
58P89.3Confident92.7Very high53 Ų5372.2 Ų72.234%0.34435%0.352SS..G310 helixtrans-62.6-20.4178.9-23.935.9000114.6K56 L61 N267K56-P58 VanDerWaalsContact C-N 3.3Å; K56-P58 VanDerWaalsContact O-N 3.15Å; P58-L61 WeakPolarHBondContact O-CD1 3.13Å; P58-L61 WeakPolarHBondContact O-CG 3.31Å; P58-N267 PolarHBondContact O-ND2 3.16Å; P58-N267 PolarHBondContact O-OD1 3.02Å
59N91.8Very high92.8Very high13 Ų1370.1 Ų70.17%0.0734%0.341CS..G310 helixtrans-94.7-1.4179.1-65.8-16.7000112.9V49 E53 S54 K56 L57V49-N59 HydrophobicContact CG1-CB 4.13Å; E53-N59 WeakPolarHBondContact CB-ND2 3.34Å; S54-N59 VanDerWaalsContact O-CB 3.28Å; S54-N59 WeakPolarHBondContact O-CB 3.14Å; S54-N59 PolarHBondContact O-ND2 2.83Å; S54-N59 PolarHBondContact OG-ND2 3.07Å; K56-N59 WeakPolarHBondContact O-CB 3.28Å; K56-N59 PolarHBondContact O-N 2.76Å; L57-N59 PolarHBondContact O-N 2.82Å; L57-N59 VanDerWaalsContact O-N 3.12Å
60L94.5Very high92.9Very high44 Ų4472.4 Ų72.423%0.2336%0.355CS..SBendtrans-1041.9179-65.5172.2000112.7L50 L57 T62 L63 I64L50-L60 HydrophobicContact CD1-CD2 3.87Å; L50-L60 HydrophobicContact CD2-CD2 3.52Å; L50-L60 HydrophobicContact CD2-CG 4.47Å; L50-L60 HydrophobicContact CG-CD2 4.17Å; L57-L60 PolarHBondContact O-N 3.32Å; L60-T62 VanDerWaalsContact C-N 3.34Å; L60-T62 PolarHBondContact O-N 2.78Å; L60-L63 HydrophobicContact CD2-CD2 4.3Å; L60-L63 WeakPolarHBondContact O-CB 3.42Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L63 VanDerWaalsContact O-N 3.11Å; L60-I64 HydrophobicContact CB-CD1 4.18Å; L60-I64 WeakPolarHBondContact O-CG1 3.25Å; L60-I64 PolarHBondContact O-N 3.41Å
61L95.1Very high93.1Very high25 Ų2573.1 Ų73.113%0.13137%0.366CS..Hα-helixtrans-63.1-39.6-169.9-62174000112.3P58 L63 I64 L65 N267 L270 R271 I274P58-L61 WeakPolarHBondContact O-CD1 3.13Å; P58-L61 WeakPolarHBondContact O-CG 3.31Å; L61-L63 VanDerWaalsContact C-N 3.35Å; L61-I64 PolarHBondContact O-N 3.09Å; L61-L65 WeakPolarHBondContact O-CB 3.36Å; L61-L65 PolarHBondContact O-N 3.42Å; L61-N267 PolarHBondContact N-OD1 3.44Å; L61-L270 VanDerWaalsContact C-CD2 3.48Å; L61-L270 HydrophobicContact CB-CD2 3.56Å; L61-L270 HydrophobicContact CB-CG 3.99Å; L61-L270 WeakPolarHBondContact O-CD2 3.36Å; L61-R271 HydrophobicContact CD1-CB 3.63Å; L61-R271 HydrophobicContact CD1-CG 4.1Å; L61-I274 HydrophobicContact CD1-CD1 4Å; L61-I274 HydrophobicContact CD2-CD1 3.79Å; L61-I274 HydrophobicContact CG-CD1 4.42Å
62T95.3Very high93.2Very high1 Ų165.3 Ų65.31%0.00634%0.34CS..Hα-helixtrans-67.5-35.5176.752.50000112.3L42 N45 S46 L60 G66 P266 N267 L270L42-T62 HydrophobicContact CD2-CG2 4.09Å; N45-T62 PolarHBondContact OD1-OG1 2.87Å; S46-T62 WeakPolarHBondContact CB-OG1 3.35Å; L60-T62 VanDerWaalsContact C-N 3.34Å; L60-T62 PolarHBondContact O-N 2.78Å; T62-G66 PolarHBondContact O-N 2.99Å; T62-P266 HydrophobicContact CG2-CB 4.31Å; T62-N267 HydrophobicContact CG2-CB 3.94Å; T62-L270 HydrophobicContact CG2-CD2 4.33Å
63L96Very high93.4Very high43 Ų4361.7 Ų61.723%0.22532%0.324CS..Hα-helixtrans-65.1-49.6173.5-178.259.1000111L60 L61 L65 G66 L67L60-L63 HydrophobicContact CD2-CD2 4.3Å; L60-L63 WeakPolarHBondContact O-CB 3.42Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L63 VanDerWaalsContact O-N 3.11Å; L61-L63 VanDerWaalsContact C-N 3.35Å; L63-L65 VanDerWaalsContact C-N 3.3Å; L63-L65 PolarHBondContact O-N 2.88Å; L63-G66 PolarHBondContact O-N 3.3Å; L63-L67 HydrophobicContact CD1-CD1 4.04Å; L63-L67 HydrophobicContact CD1-CG 4.08Å; L63-L67 HydrophobicContact CG-CD1 4.01Å; L63-L67 HydrophobicContact CG-CG 4.41Å; L63-L67 WeakPolarHBondContact O-CG 3.46Å; L63-L67 PolarHBondContact O-N 2.82Å
64I96.2Very high93.7Very high84 Ų8462.7 Ų62.743%0.43133%0.331SS..Hα-helixtrans-58.2-45.9179.4-68.2166.5000110L57 L60 L61 L67 A68L57-I64 HydrophobicContact CD1-CD1 3.68Å; L60-I64 HydrophobicContact CB-CD1 4.18Å; L60-I64 WeakPolarHBondContact O-CG1 3.25Å; L60-I64 PolarHBondContact O-N 3.41Å; L61-I64 PolarHBondContact O-N 3.09Å; I64-L67 PolarHBondContact O-N 2.82Å; I64-A68 VanDerWaalsContact O-CB 3.27Å; I64-A68 WeakPolarHBondContact O-CB 3.45Å; I64-A68 PolarHBondContact O-N 3.38Å
65L96.4Very high93.9Very high66 Ų6663.3 Ų63.335%0.34633%0.329SS..Hα-helixtrans-64-44.1177.9-177.560.3000111.9L42 L61 L63 L67 A68 I69 L270L42-L65 HydrophobicContact CD1-CB 4.41Å; L42-L65 HydrophobicContact CD1-CD2 3.95Å; L42-L65 HydrophobicContact CD1-CG 3.89Å; L42-L65 HydrophobicContact CD2-CD2 4.14Å; L61-L65 WeakPolarHBondContact O-CB 3.36Å; L61-L65 PolarHBondContact O-N 3.42Å; L63-L65 VanDerWaalsContact C-N 3.3Å; L63-L65 PolarHBondContact O-N 2.88Å; L65-L67 PolarHBondContact O-N 2.97Å; L65-A68 PolarHBondContact O-N 3.19Å; L65-I69 HydrophobicContact CD1-CD1 4.24Å; L65-I69 HydrophobicContact CD1-CG1 4.42Å; L65-I69 HydrophobicContact CG-CD1 4.09Å; L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.33Å; L65-I69 PolarHBondContact O-N 2.82Å; L65-L270 HydrophobicContact CB-CD2 4.12Å; L65-L270 HydrophobicContact CD2-CD1 4.14Å; L65-L270 HydrophobicContact CD2-CD2 3.89Å
66G96.2Very high94.1Very high0 Ų061.6 Ų61.60%032%0.323CS..Hα-helixtrans-59.3-47.1176.800000112.3T62 L63 I69 V70T62-G66 PolarHBondContact O-N 2.99Å; L63-G66 PolarHBondContact O-N 3.3Å; G66-I69 PolarHBondContact O-N 2.87Å; G66-V70 WeakPolarHBondContact O-CG2 3.42Å; G66-V70 PolarHBondContact O-N 2.98Å
67L96.9Very high94.2Very high95 Ų9558.5 Ų58.550%0.49732%0.316SS..Hα-helixtrans-66.6-37.7177.2-67177.7000112.4L63 I64 L65 I69 V70 A71L63-L67 HydrophobicContact CD1-CD1 4.04Å; L63-L67 HydrophobicContact CD1-CG 4.08Å; L63-L67 HydrophobicContact CG-CD1 4.01Å; L63-L67 HydrophobicContact CG-CG 4.41Å; L63-L67 WeakPolarHBondContact O-CG 3.46Å; L63-L67 PolarHBondContact O-N 2.82Å; I64-L67 PolarHBondContact O-N 2.82Å; L65-L67 PolarHBondContact O-N 2.97Å; L67-I69 VanDerWaalsContact C-N 3.35Å; L67-V70 PolarHBondContact O-N 2.97Å; L67-A71 WeakPolarHBondContact O-CB 3.25Å; L67-A71 PolarHBondContact O-N 3.34Å
68A96.2Very high94.4Very high46 Ų4656.7 Ų56.738%0.3831%0.306SS..Hα-helixtrans-62.1-42.9175.200000111.3I64 L65 A71 L72I64-A68 VanDerWaalsContact O-CB 3.27Å; I64-A68 WeakPolarHBondContact O-CB 3.45Å; I64-A68 PolarHBondContact O-N 3.38Å; L65-A68 PolarHBondContact O-N 3.19Å; A68-A71 PolarHBondContact O-N 2.99Å; A68-L72 VanDerWaalsContact O-CG 3.29Å; A68-L72 WeakPolarHBondContact O-CG 3.22Å; A68-L72 PolarHBondContact O-N 3.32Å
69I95.6Very high94.5Very high33 Ų3354.5 Ų54.517%0.16929%0.293CS..Hα-helixtrans-63.6-43.5176.1-65.2163.8000110.7I35 V39 L42 L65 G66 L67 A71 L72 I73I35-I69 HydrophobicContact CD1-CG2 3.94Å; I35-I69 HydrophobicContact CG1-CG2 3.82Å; V39-I69 HydrophobicContact CG2-CB 3.92Å; V39-I69 HydrophobicContact CG2-CG2 3.45Å; V39-I69 VanDerWaalsContact CG2-CG2 3.45Å; L42-I69 HydrophobicContact CD1-CD1 3.73Å; L65-I69 HydrophobicContact CD1-CD1 4.24Å; L65-I69 HydrophobicContact CD1-CG1 4.42Å; L65-I69 HydrophobicContact CG-CD1 4.09Å; L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.33Å; L65-I69 PolarHBondContact O-N 2.82Å; G66-I69 PolarHBondContact O-N 2.87Å; L67-I69 VanDerWaalsContact C-N 3.35Å; I69-A71 PolarHBondContact O-N 3.2Å; I69-L72 PolarHBondContact O-N 3.37Å; I69-I73 HydrophobicContact CG2-CD1 3.98Å; I69-I73 WeakPolarHBondContact O-CG1 3.23Å; I69-I73 PolarHBondContact O-N 3.12Å
70V96.1Very high94.6Very high49 Ų4956.6 Ų56.630%0.29731%0.307SS..Hα-helixtrans-59.4-46.7174.9171.80000111V39 G66 L67 L72 I73 I74V39-V70 HydrophobicContact CG1-CG2 3.54Å; V39-V70 HydrophobicContact CG2-CG2 4.32Å; G66-V70 WeakPolarHBondContact O-CG2 3.42Å; G66-V70 PolarHBondContact O-N 2.98Å; L67-V70 PolarHBondContact O-N 2.97Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 2.69Å; V70-I73 PolarHBondContact O-N 2.85Å; V70-I74 HydrophobicContact CG1-CD1 3.77Å; V70-I74 HydrophobicContact CG1-CG1 4.41Å; V70-I74 WeakPolarHBondContact O-CG1 3.46Å; V70-I74 PolarHBondContact O-N 2.74Å
71A96Very high94.5Very high54 Ų5464.4 Ų64.445%0.44633%0.334SS..Hα-helixtrans-60.1-40.8177.200000111.9L67 A68 I69 I74 L75L67-A71 WeakPolarHBondContact O-CB 3.25Å; L67-A71 PolarHBondContact O-N 3.34Å; A68-A71 PolarHBondContact O-N 2.99Å; I69-A71 PolarHBondContact O-N 3.2Å; A71-I74 PolarHBondContact O-N 3.3Å; A71-L75 WeakPolarHBondContact O-CB 3.44Å; A71-L75 PolarHBondContact O-N 3.39Å
72L94.5Very high94.3Very high47 Ų4769.4 Ų69.425%0.24636%0.359CS..Hα-helixtrans-64-42175.3-70.8175.4000112.5A68 I69 V70 L75 R76 P94 A98A68-L72 VanDerWaalsContact O-CG 3.29Å; A68-L72 WeakPolarHBondContact O-CG 3.22Å; A68-L72 PolarHBondContact O-N 3.32Å; I69-L72 PolarHBondContact O-N 3.37Å; V70-L72 VanDerWaalsContact C-N 3.31Å; V70-L72 PolarHBondContact O-N 2.69Å; L72-L75 PolarHBondContact O-N 3.18Å; L72-R76 WeakPolarHBondContact O-CB 3.34Å; L72-R76 PolarHBondContact O-N 2.76Å; L72-P94 HydrophobicContact CD2-CB 3.61Å; L72-P94 HydrophobicContact CD2-CG 3.94Å; L72-A98 HydrophobicContact CD1-CB 3.95Å
73I93.3Very high94.1Very high44 Ų4472.6 Ų72.623%0.22638%0.376CS..Hα-helixtrans-62.3-46.5176.6-68.1166.1000110.2I35 Y36 I69 V70 R76 T77I35-I73 HydrophobicContact CD1-CD1 4Å; I35-I73 HydrophobicContact CD1-CG1 4.21Å; I35-I73 HydrophobicContact CG1-CD1 4.23Å; Y36-I73 HydrophobicContact CE1-CD1 4.49Å; I69-I73 HydrophobicContact CG2-CD1 3.98Å; I69-I73 WeakPolarHBondContact O-CG1 3.23Å; I69-I73 PolarHBondContact O-N 3.12Å; V70-I73 PolarHBondContact O-N 2.85Å; I73-R76 PolarHBondContact O-N 3.01Å; I73-T77 WeakPolarHBondContact O-CB 3.32Å; I73-T77 PolarHBondContact O-N 2.62Å; I73-T77 PolarHBondContact O-OG1 3.45Å
74I93.9Very high93.7Very high89 Ų8973.8 Ų73.846%0.45639%0.386SS..Hα-helixtrans-61.8-49.5178-68.1171000110V70 A71 R76 T77 I78V70-I74 HydrophobicContact CG1-CD1 3.77Å; V70-I74 HydrophobicContact CG1-CG1 4.41Å; V70-I74 WeakPolarHBondContact O-CG1 3.46Å; V70-I74 PolarHBondContact O-N 2.74Å; A71-I74 PolarHBondContact O-N 3.3Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 3.06Å; I74-T77 PolarHBondContact O-N 2.88Å; I74-T77 VanDerWaalsContact O-N 3.16Å; I74-I78 HydrophobicContact CG2-CD1 3.72Å; I74-I78 HydrophobicContact CG2-CG1 4.29Å; I74-I78 WeakPolarHBondContact O-CB 3.45Å; I74-I78 PolarHBondContact O-N 3.09Å
75L92.8Very high93.1Very high74 Ų7476.1 Ų76.139%0.38740%0.4SS..Hα-helixtrans-59.3-42.5-179.3-177.163.8000111.7A71 L72 G79 L91 P94A71-L75 WeakPolarHBondContact O-CB 3.44Å; A71-L75 PolarHBondContact O-N 3.39Å; L72-L75 PolarHBondContact O-N 3.18Å; L75-G79 WeakPolarHBondContact O-CA 3.26Å; L75-G79 PolarHBondContact O-N 3.26Å; L75-L91 HydrophobicContact CD1-CD2 3.83Å; L75-L91 HydrophobicContact CD2-CD2 4.15Å; L75-L91 HydrophobicContact CG-CD2 3.86Å; L75-P94 HydrophobicContact CD2-CG 4.5Å
76R90.9Very high92.6Very high175 Ų17577.9 Ų77.966%0.6640%0.402SS*.Hα-helixtrans-71.1-30.5178.5-162.4-143.5-174.4-173.42.7113.1L72 I73 I74 P80L72-R76 WeakPolarHBondContact O-CB 3.34Å; L72-R76 PolarHBondContact O-N 2.76Å; I73-R76 PolarHBondContact O-N 3.01Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 3.06Å; R76-P80 WeakPolarHBondContact O-CD 3.3Å; R76-P80 WeakPolarHBondContact O-CG 3.4Å
77T92.2Very high92.2Very high77 Ų7778.4 Ų78.447%0.47241%0.406SS..Hα-helixtrans-85.5-39.8-176.5-52.90000112.1I73 I74I73-T77 WeakPolarHBondContact O-CB 3.32Å; I73-T77 PolarHBondContact O-N 2.62Å; I73-T77 PolarHBondContact O-OG1 3.45Å; I74-T77 PolarHBondContact O-N 2.88Å; I74-T77 VanDerWaalsContact O-N 3.16Å
78I93.8Very high91.9Very high78 Ų7875.6 Ų75.640%0.439%0.392SS..Hα-helixtrans-93.7-37.7-176.3-58-174.8000111.3I74 R81 I82I74-I78 HydrophobicContact CG2-CD1 3.72Å; I74-I78 HydrophobicContact CG2-CG1 4.29Å; I74-I78 WeakPolarHBondContact O-CB 3.45Å; I74-I78 PolarHBondContact O-N 3.09Å; I78-R81 WeakPolarHBondContact O-CB 3.47Å; I78-R81 PolarHBondContact O-N 2.92Å; I78-I82 HydrophobicContact CG2-CD1 3.46Å; I78-I82 VanDerWaalsContact CG2-CD1 3.46Å; I78-I82 HydrophobicContact CG2-CG1 4.11Å
79G91.8Very high91.7Very high8 Ų875.6 Ų75.68%0.08239%0.385CS..Hα-helixtrans-50.5-49.6-175.400000114.3L75 R81 I82 L83L75-G79 WeakPolarHBondContact O-CA 3.26Å; L75-G79 PolarHBondContact O-N 3.26Å; G79-R81 PolarHBondContact O-N 3.27Å; G79-R81 VanDerWaalsContact O-N 3.09Å; G79-I82 PolarHBondContact O-N 2.82Å; G79-L83 WeakPolarHBondContact O-CB 3.46Å; G79-L83 WeakPolarHBondContact O-CG 3.47Å; G79-L83 PolarHBondContact O-N 3.38Å
80P92.1Very high91.6Very high56 Ų5676.6 Ų76.636%0.36439%0.391SS..Hα-helixtrans-61.8-17.9178.2-22.532.8000115.1R76 V88 L91R76-P80 WeakPolarHBondContact O-CD 3.3Å; R76-P80 WeakPolarHBondContact O-CG 3.4Å; P80-V88 HydrophobicContact CB-CG1 3.98Å; P80-V88 HydrophobicContact CB-CG2 4.3Å; P80-V88 HydrophobicContact CG-CG1 3.91Å; P80-L91 HydrophobicContact CG-CD1 4.2Å
81R92.5Very high91.5Very high208 Ų20875.4 Ų75.479%0.78538%0.382SS*.Hα-helixtrans-84.8-18.1177.9-57.4-178-179178.2-1.2113I78 G79I78-R81 WeakPolarHBondContact O-CB 3.47Å; I78-R81 PolarHBondContact O-N 2.92Å; G79-R81 PolarHBondContact O-N 3.27Å; G79-R81 VanDerWaalsContact O-N 3.09Å
82I91.8Very high91.4Very high130 Ų13075 Ų7567%0.66738%0.377SS*.Hα-helixtrans-114.4-34.6-172.2-55.2-179.1000110.9I78 G79I78-I82 HydrophobicContact CG2-CD1 3.46Å; I78-I82 VanDerWaalsContact CG2-CD1 3.46Å; I78-I82 HydrophobicContact CG2-CG1 4.11Å; G79-I82 PolarHBondContact O-N 2.82Å
83L89.9Confident91.5Very high68 Ų6874 Ų7436%0.35637%0.371SS..SBendtrans-87.3147.8-175.5-68.2178.7000111.8G79 S87 V88 L91G79-L83 WeakPolarHBondContact O-CB 3.46Å; G79-L83 WeakPolarHBondContact O-CG 3.47Å; G79-L83 PolarHBondContact O-N 3.38Å; L83-S87 WeakPolarHBondContact CB-OG 3.35Å; L83-V88 HydrophobicContact CB-CG2 4.43Å; L83-L91 HydrophobicContact CD1-CD1 4.05Å; L83-L91 HydrophobicContact CD1-CD2 3.72Å; L83-L91 HydrophobicContact CD1-CG 4.1Å
84P87.5Confident91.6Very high68 Ų6874 Ų7444%0.44237%0.374SS..  trans-65.3145.3173.826.7-32.8000111.1W86 S87 V88P84-W86 VanDerWaalsContact C-N 3.27Å; P84-W86 HydrophobicContact CG-CZ2 4.4Å; P84-W86 PolarHBondContact O-N 3.48Å; P84-W86 VanDerWaalsContact O-N 3.09Å; P84-S87 WeakPolarHBondContact CD-OG 3.12Å; P84-S87 WeakPolarHBondContact CG-OG 3.4Å; P84-S87 PolarHBondContact O-N 2.78Å; P84-S87 PolarHBondContact O-OG 3.25Å; P84-V88 PolarHBondContact O-N 3.35Å
85D85.6Confident91.6Very high134 Ų13472.4 Ų72.472%0.71737%0.368SS*.Hα-helixtrans-50.9-41-169.1-66.6-32000114.1S87 V88D85-S87 PolarHBondContact O-N 3.47Å; D85-V88 WeakPolarHBondContact O-CB 3.45Å; D85-V88 PolarHBondContact O-N 3.46Å
86W85Confident91.7Very high103 Ų10371.1 Ų71.139%0.3936%0.364SS..Hα-helixtrans-59.9-33.417969.9-95.5000113P84 L90 F303P84-W86 VanDerWaalsContact C-N 3.27Å; P84-W86 HydrophobicContact CG-CZ2 4.4Å; P84-W86 PolarHBondContact O-N 3.48Å; P84-W86 VanDerWaalsContact O-N 3.09Å; W86-L90 HydrophobicContact CZ3-CD1 4.31Å; W86-F303 HydrophobicContact CB-CB 3.99Å; W86-F303 HydrophobicContact CB-CD2 4.23Å; W86-F303 AromaticContact CD1-CD2 3.78Å; W86-F303 HydrophobicContact CD2-CB 4.47Å; W86-F303 HydrophobicContact CD2-CD2 4.01Å; W86-F303 HydrophobicContact CG-CB 4.24Å; W86-F303 AromaticContact CG-CD2 3.75Å; W86-F303 HydrophobicContact CG-CD2 3.75Å; W86-F303 HydrophobicContact CG-CG 4.47Å
87S87.6Confident92Very high11 Ų1164.5 Ų64.58%0.07734%0.341CS..Hα-helixtrans-88.2-14.9-175.671.70000113.3L83 P84 D85 I89 L90L83-S87 WeakPolarHBondContact CB-OG 3.35Å; P84-S87 WeakPolarHBondContact CD-OG 3.12Å; P84-S87 WeakPolarHBondContact CG-OG 3.4Å; P84-S87 PolarHBondContact O-N 2.78Å; P84-S87 PolarHBondContact O-OG 3.25Å; D85-S87 PolarHBondContact O-N 3.47Å; S87-I89 PolarHBondContact O-N 3.19Å; S87-L90 VanDerWaalsContact O-CB 3.28Å; S87-L90 WeakPolarHBondContact O-CB 3.24Å; S87-L90 PolarHBondContact O-N 2.83Å
88V90.9Very high92.1Very high36 Ų3662.8 Ų62.822%0.21834%0.335CS..Hα-helixtrans-59.3-33.2177.9176.70000111.2P80 L83 P84 D85 L90 L91P80-V88 HydrophobicContact CB-CG1 3.98Å; P80-V88 HydrophobicContact CB-CG2 4.3Å; P80-V88 HydrophobicContact CG-CG1 3.91Å; L83-V88 HydrophobicContact CB-CG2 4.43Å; P84-V88 PolarHBondContact O-N 3.35Å; D85-V88 WeakPolarHBondContact O-CB 3.45Å; D85-V88 PolarHBondContact O-N 3.46Å; V88-L90 PolarHBondContact O-N 2.73Å; V88-L91 HydrophobicContact CG1-CD1 4.46Å; V88-L91 WeakPolarHBondContact O-CB 3.37Å; V88-L91 PolarHBondContact O-N 2.79Å; V88-L91 VanDerWaalsContact O-N 3.07Å
89I91.6Very high92.2Very high45 Ų4565.5 Ų65.523%0.23134%0.344CS..G310 helixtrans-56.5-36.3175.1-64.9177.6000111.3S87 L91 S92 F295 L298 A299 N302S87-I89 PolarHBondContact O-N 3.19Å; I89-L91 PolarHBondContact O-N 3.37Å; I89-S92 WeakPolarHBondContact O-CB 3.35Å; I89-S92 PolarHBondContact O-N 2.69Å; I89-S92 PolarHBondContact O-OG 3.25Å; I89-F295 HydrophobicContact CG2-CD1 3.8Å; I89-L298 HydrophobicContact CG2-CB 4.18Å; I89-A299 HydrophobicContact CB-CB 4.46Å; I89-N302 HydrophobicContact CD1-CB 3.75Å; I89-N302 VanDerWaalsContact CD1-ND2 3.32Å; I89-N302 WeakPolarHBondContact CD1-ND2 3.37Å
90L94.1Very high92.4Very high55 Ų5567.4 Ų67.429%0.28835%0.349SS..G310 helixtrans-65.2-24.7-179.2-58.7177000112.6W86 S87 V88 S92 I93 V296 A299W86-L90 HydrophobicContact CZ3-CD1 4.31Å; S87-L90 VanDerWaalsContact O-CB 3.28Å; S87-L90 WeakPolarHBondContact O-CB 3.24Å; S87-L90 PolarHBondContact O-N 2.83Å; V88-L90 PolarHBondContact O-N 2.73Å; L90-S92 PolarHBondContact O-N 2.86Å; L90-I93 HydrophobicContact CB-CD1 4.33Å; L90-I93 HydrophobicContact CD2-CD1 3.92Å; L90-I93 WeakPolarHBondContact O-CB 2.96Å; L90-I93 WeakPolarHBondContact O-CG1 3.19Å; L90-I93 PolarHBondContact O-N 2.62Å; L90-I93 VanDerWaalsContact O-N 3.11Å; L90-V296 HydrophobicContact CD2-CG2 4.05Å; L90-A299 HydrophobicContact CD2-CB 3.61Å; L90-A299 HydrophobicContact CG-CB 3.96Å
91L93.5Very high92.6Very high23 Ų2367.5 Ų67.512%0.1234%0.344CS..G310 helixtrans-65.9-16.4173.5-53.7177.9000112.8L75 P80 L83 V88 I89 I93 P94 T95L75-L91 HydrophobicContact CD1-CD2 3.83Å; L75-L91 HydrophobicContact CD2-CD2 4.15Å; L75-L91 HydrophobicContact CG-CD2 3.86Å; P80-L91 HydrophobicContact CG-CD1 4.2Å; L83-L91 HydrophobicContact CD1-CD1 4.05Å; L83-L91 HydrophobicContact CD1-CD2 3.72Å; L83-L91 HydrophobicContact CD1-CG 4.1Å; V88-L91 HydrophobicContact CG1-CD1 4.46Å; V88-L91 WeakPolarHBondContact O-CB 3.37Å; V88-L91 PolarHBondContact O-N 2.79Å; V88-L91 VanDerWaalsContact O-N 3.07Å; I89-L91 PolarHBondContact O-N 3.37Å; L91-I93 VanDerWaalsContact C-N 3.31Å; L91-P94 WeakPolarHBondContact O-CD 3.49Å; L91-T95 PolarHBondContact O-OG1 3.31Å
92S93.6Very high92.7Very high47 Ų4763.3 Ų63.333%0.32933%0.331SS..Hα-helixtrans-74.5-21.2175.1-53.50000112.6I89 L90 T95 T96I89-S92 WeakPolarHBondContact O-CB 3.35Å; I89-S92 PolarHBondContact O-N 2.69Å; I89-S92 PolarHBondContact O-OG 3.25Å; L90-S92 PolarHBondContact O-N 2.86Å; S92-T95 PolarHBondContact O-N 3.35Å; S92-T96 VanDerWaalsContact O-CB 3.3Å; S92-T96 WeakPolarHBondContact O-CB 3.47Å; S92-T96 PolarHBondContact O-N 2.72Å; S92-T96 PolarHBondContact O-OG1 2.89Å
93I96.2Very high92.9Very high26 Ų2660.6 Ų60.613%0.13332%0.321CS..Hα-helixtrans-57.4-61.1179.6-65.6166.3000111.3L90 L91 T95 T96 I97 T292 F295 V296L90-I93 HydrophobicContact CB-CD1 4.33Å; L90-I93 HydrophobicContact CD2-CD1 3.92Å; L90-I93 WeakPolarHBondContact O-CB 2.96Å; L90-I93 WeakPolarHBondContact O-CG1 3.19Å; L90-I93 PolarHBondContact O-N 2.62Å; L90-I93 VanDerWaalsContact O-N 3.11Å; L91-I93 VanDerWaalsContact C-N 3.31Å; I93-T95 VanDerWaalsContact C-N 3.27Å; I93-T95 PolarHBondContact O-N 3.38Å; I93-T96 PolarHBondContact O-N 2.84Å; I93-I97 HydrophobicContact CG2-CD1 3.76Å; I93-I97 WeakPolarHBondContact O-CG1 3.17Å; I93-I97 PolarHBondContact O-N 2.86Å; I93-T292 HydrophobicContact CD1-CG2 4.31Å; I93-F295 HydrophobicContact CD1-CB 3.89Å; I93-F295 HydrophobicContact CG1-CB 3.41Å; I93-F295 VanDerWaalsContact CG1-CB 3.41Å; I93-F295 HydrophobicContact CG1-CD2 3.82Å; I93-F295 HydrophobicContact CG1-CG 3.83Å; I93-V296 HydrophobicContact CD1-CG2 4.34Å
94P95.9Very high93.2Very high43 Ų4359 Ų5928%0.27931%0.314SS..Hα-helixtrans-66.5-30.7-176.329-38.5000112.3L72 L75 L91 A98L72-P94 HydrophobicContact CD2-CB 3.61Å; L72-P94 HydrophobicContact CD2-CG 3.94Å; L75-P94 HydrophobicContact CD2-CG 4.5Å; L91-P94 WeakPolarHBondContact O-CD 3.49Å; P94-A98 WeakPolarHBondContact O-CB 3.46Å; P94-A98 PolarHBondContact O-N 3.41Å
95T93.3Very high93.6Very high55 Ų5558.4 Ų58.434%0.33730%0.304SS..Hα-helixtrans-65.7-42.7174.8-54.60000111.5L91 S92 I93 A98 F99L91-T95 PolarHBondContact O-OG1 3.31Å; S92-T95 PolarHBondContact O-N 3.35Å; I93-T95 VanDerWaalsContact C-N 3.27Å; I93-T95 PolarHBondContact O-N 3.38Å; T95-A98 PolarHBondContact O-N 2.92Å; T95-F99 WeakPolarHBondContact O-CB 3.24Å; T95-F99 PolarHBondContact O-N 3.34Å
96T95.7Very high93.9Very high47 Ų4759.4 Ų59.429%0.28830%0.298SS..Hα-helixtrans-70.8-39.8179.4-54.30000111.4S92 I93 F99 Y100 I291 F295S92-T96 VanDerWaalsContact O-CB 3.3Å; S92-T96 WeakPolarHBondContact O-CB 3.47Å; S92-T96 PolarHBondContact O-N 2.72Å; S92-T96 PolarHBondContact O-OG1 2.89Å; I93-T96 PolarHBondContact O-N 2.84Å; T96-F99 PolarHBondContact O-N 3Å; T96-Y100 WeakPolarHBondContact O-CB 3.37Å; T96-Y100 PolarHBondContact O-N 2.98Å; T96-I291 HydrophobicContact CG2-CD1 4.3Å; T96-I291 HydrophobicContact CG2-CG1 4.43Å; T96-I291 HydrophobicContact CG2-CG2 3.84Å; T96-F295 HydrophobicContact CG2-CE2 4Å; T96-F295 VanDerWaalsContact OG1-CE2 3.25Å; T96-F295 WeakPolarHBondContact OG1-CE2 3.2Å; T96-F295 WeakPolarHBondContact OG1-CZ 3.25Å
97I97.1Very high94.4Very high36 Ų3659 Ų5919%0.18530%0.304CS..Hα-helixtrans-62.9-43.1173-69.4174.3000110.5I93 F99 Y100 F101 C288 I291I93-I97 HydrophobicContact CG2-CD1 3.76Å; I93-I97 WeakPolarHBondContact O-CG1 3.17Å; I93-I97 PolarHBondContact O-N 2.86Å; I97-F99 VanDerWaalsContact C-N 3.35Å; I97-F99 PolarHBondContact O-N 2.94Å; I97-Y100 WeakPolarHBondContact O-CB 3.39Å; I97-Y100 PolarHBondContact O-N 2.57Å; I97-F101 HydrophobicContact CG2-CD2 3.7Å; I97-F101 HydrophobicContact CG2-CE2 3.72Å; I97-F101 WeakPolarHBondContact O-CD2 3.46Å; I97-F101 PolarHBondContact O-N 2.92Å; I97-C288 HydrophobicContact CD1-CB 4.29Å; I97-I291 HydrophobicContact CG1-CD1 4.34Å; I97-I291 HydrophobicContact CG1-CG2 4.04Å
98A94.9Very high94.8Very high41 Ų4159 Ų5934%0.33930%0.302SS..Hα-helixtrans-62.1-42.4175.900000111.7L72 P94 T95 F101 F102L72-A98 HydrophobicContact CD1-CB 3.95Å; P94-A98 WeakPolarHBondContact O-CB 3.46Å; P94-A98 PolarHBondContact O-N 3.41Å; T95-A98 PolarHBondContact O-N 2.92Å; A98-F101 PolarHBondContact O-N 3.08Å; A98-F102 WeakPolarHBondContact O-CB 3.45Å; A98-F102 PolarHBondContact O-N 2.74Å
99F94.4Very high94.9Very high135 Ų13559 Ų5959%0.59230%0.301SS*.Hα-helixtrans-63.6-42.4174.9-178.4-103.6000112.1T95 T96 I97 F102 V103T95-F99 WeakPolarHBondContact O-CB 3.24Å; T95-F99 PolarHBondContact O-N 3.34Å; T96-F99 PolarHBondContact O-N 3Å; I97-F99 VanDerWaalsContact C-N 3.35Å; I97-F99 PolarHBondContact O-N 2.94Å; F99-F102 WeakPolarHBondContact O-CB 3.5Å; F99-F102 PolarHBondContact O-N 3.31Å; F99-V103 HydrophobicContact CD1-CG2 4.48Å; F99-V103 HydrophobicContact CE1-CG2 4.03Å; F99-V103 HydrophobicContact CE2-CG2 4.47Å; F99-V103 HydrophobicContact CZ-CG2 4.03Å; F99-V103 WeakPolarHBondContact O-CG2 3.42Å; F99-V103 PolarHBondContact O-N 3.42Å
100Y96.7Very high95.1Very high48 Ų4858.9 Ų58.919%0.18830%0.304CS..Hα-helixtrans-56.4-53173.3165.3-107.9000111.3T96 I97 F102 V103 V104 H284 V287T96-Y100 WeakPolarHBondContact O-CB 3.37Å; T96-Y100 PolarHBondContact O-N 2.98Å; I97-Y100 WeakPolarHBondContact O-CB 3.39Å; I97-Y100 PolarHBondContact O-N 2.57Å; Y100-F102 VanDerWaalsContact C-N 3.26Å; Y100-F102 PolarHBondContact O-N 2.92Å; Y100-V103 PolarHBondContact O-N 3.09Å; Y100-V103 VanDerWaalsContact O-N 3.1Å; Y100-V104 HydrophobicContact CD2-CG2 4.15Å; Y100-V104 HydrophobicContact CE1-CG2 4.15Å; Y100-V104 HydrophobicContact CE2-CG2 3.67Å; Y100-V104 WeakPolarHBondContact O-CG2 3.2Å; Y100-V104 PolarHBondContact O-N 2.92Å; Y100-H284 AromaticContact CE1-ND1 3.8Å; Y100-H284 AromaticContact CZ-ND1 3.7Å; Y100-H284 PolarHBondContact OH-ND1 3.23Å; Y100-V287 HydrophobicContact CD1-CG1 4.32Å; Y100-V287 HydrophobicContact CD2-CG1 3.98Å; Y100-V287 HydrophobicContact CE1-CB 4.38Å; Y100-V287 HydrophobicContact CE1-CG1 4.08Å; Y100-V287 HydrophobicContact CE2-CB 4.43Å; Y100-V287 HydrophobicContact CE2-CG1 3.72Å; Y100-V287 HydrophobicContact CG-CG1 4.26Å
101F96.6Very high95Very high59 Ų5958.7 Ų58.726%0.25930%0.303SS..Hα-helixtrans-66.1-27.8178.3-80.4-66.3000113.1I97 A98 V104 F105 F273 H284I97-F101 HydrophobicContact CG2-CD2 3.7Å; I97-F101 HydrophobicContact CG2-CE2 3.72Å; I97-F101 WeakPolarHBondContact O-CD2 3.46Å; I97-F101 PolarHBondContact O-N 2.92Å; A98-F101 PolarHBondContact O-N 3.08Å; F101-V104 PolarHBondContact O-N 3.18Å; F101-F105 WeakPolarHBondContact O-CB 3.36Å; F101-F105 PolarHBondContact O-N 2.94Å; F101-F273 HydrophobicContact CB-CZ 4.46Å; F101-F273 HydrophobicContact CD1-CE1 4.43Å; F101-F273 AromaticContact CD1-CZ 3.92Å; F101-F273 HydrophobicContact CD1-CZ 3.92Å; F101-H284 HydrophobicContact CE1-CB 4.36Å; F101-H284 HydrophobicContact CZ-CB 4.21Å
102F94.5Very high95Very high119 Ų11957.7 Ų57.752%0.52230%0.298SS..Hα-helixtrans-62.5-45170.2172.2-96.4000111.4A98 F99 Y100 F105 W106A98-F102 WeakPolarHBondContact O-CB 3.45Å; A98-F102 PolarHBondContact O-N 2.74Å; F99-F102 WeakPolarHBondContact O-CB 3.5Å; F99-F102 PolarHBondContact O-N 3.31Å; Y100-F102 VanDerWaalsContact C-N 3.26Å; Y100-F102 PolarHBondContact O-N 2.92Å; F102-F105 PolarHBondContact O-N 3.21Å; F102-W106 WeakPolarHBondContact O-CB 3.22Å; F102-W106 PolarHBondContact O-N 3.46Å
103V95.3Very high94.9Very high73 Ų7359.8 Ų59.844%0.44231%0.305SS..Hα-helixtrans-63.8-44176174.90000111.2F99 Y100 W106 N107F99-V103 HydrophobicContact CD1-CG2 4.48Å; F99-V103 HydrophobicContact CE1-CG2 4.03Å; F99-V103 HydrophobicContact CE2-CG2 4.47Å; F99-V103 HydrophobicContact CZ-CG2 4.03Å; F99-V103 WeakPolarHBondContact O-CG2 3.42Å; F99-V103 PolarHBondContact O-N 3.42Å; Y100-V103 PolarHBondContact O-N 3.09Å; Y100-V103 VanDerWaalsContact O-N 3.1Å; V103-W106 PolarHBondContact O-N 2.79Å; V103-N107 PolarHBondContact O-N 3.43Å
104V96.1Very high94.7Very high35 Ų3564 Ų6421%0.21233%0.326CS..Hα-helixtrans-63.7-43.2176.7-175.60000110.8Y100 F101 W106 N107 F108 F273Y100-V104 HydrophobicContact CD2-CG2 4.15Å; Y100-V104 HydrophobicContact CE1-CG2 4.15Å; Y100-V104 HydrophobicContact CE2-CG2 3.67Å; Y100-V104 WeakPolarHBondContact O-CG2 3.2Å; Y100-V104 PolarHBondContact O-N 2.92Å; F101-V104 PolarHBondContact O-N 3.18Å; V104-W106 VanDerWaalsContact C-N 3.34Å; V104-W106 PolarHBondContact O-N 3.42Å; V104-N107 PolarHBondContact O-N 3.33Å; V104-F108 WeakPolarHBondContact O-CB 3.09Å; V104-F108 PolarHBondContact O-N 2.86Å; V104-F273 HydrophobicContact CB-CE2 4.22Å; V104-F273 HydrophobicContact CB-CZ 4.48Å; V104-F273 HydrophobicContact CG1-CE2 3.88Å; V104-F273 HydrophobicContact CG1-CZ 4.46Å
105F96Very high94.3Very high55 Ų5566 Ų6624%0.24133%0.329CS..Hα-helixtrans-61.8-42.6176.2177-101.4000111.7F101 F102 N107 F108 L109 F273F101-F105 WeakPolarHBondContact O-CB 3.36Å; F101-F105 PolarHBondContact O-N 2.94Å; F102-F105 PolarHBondContact O-N 3.21Å; F105-N107 VanDerWaalsContact C-N 3.33Å; F105-N107 PolarHBondContact O-N 3.49Å; F105-F108 HydrophobicContact CD2-CD1 4.32Å; F105-F108 HydrophobicContact CE2-CD1 4.41Å; F105-F108 PolarHBondContact O-N 3.1Å; F105-L109 HydrophobicContact CE1-CD2 4.22Å; F105-L109 VanDerWaalsContact O-CB 3.31Å; F105-L109 WeakPolarHBondContact O-CB 3.13Å; F105-L109 PolarHBondContact O-N 3.24Å; F105-F273 VanDerWaalsContact CA-CE2 3.45Å; F105-F273 HydrophobicContact CB-CD2 4.16Å; F105-F273 HydrophobicContact CB-CE1 4.27Å; F105-F273 HydrophobicContact CB-CE2 3.81Å; F105-F273 HydrophobicContact CB-CZ 3.84Å; F105-F273 HydrophobicContact CD2-CB 3.83Å; F105-F273 AromaticContact CD2-CD1 3.89Å; F105-F273 HydrophobicContact CD2-CD1 3.89Å; F105-F273 AromaticContact CD2-CD2 3.84Å; F105-F273 HydrophobicContact CD2-CD2 3.84Å; F105-F273 HydrophobicContact CD2-CE1 4.37Å; F105-F273 HydrophobicContact CD2-CE2 4.32Å; F105-F273 AromaticContact CD2-CG 3.57Å; F105-F273 HydrophobicContact CD2-CG 3.57Å; F105-F273 HydrophobicContact CE2-CB 4.11Å; F105-F273 HydrophobicContact CE2-CG 4.34Å
106W93.3Very high94Very high156 Ų15666.2 Ų66.259%0.59133%0.326SS*.Hα-helixtrans-60.9-42.8176.5-176.3-96.5000111.8F102 V103 V104 L109 S110F102-W106 WeakPolarHBondContact O-CB 3.22Å; F102-W106 PolarHBondContact O-N 3.46Å; V103-W106 PolarHBondContact O-N 2.79Å; V104-W106 VanDerWaalsContact C-N 3.34Å; V104-W106 PolarHBondContact O-N 3.42Å; W106-L109 PolarHBondContact O-N 3.31Å; W106-S110 WeakPolarHBondContact O-CB 3.47Å; W106-S110 PolarHBondContact O-N 3.12Å; W106-S110 PolarHBondContact O-OG 3.39Å
107N94Very high93.6Very high95 Ų9570.5 Ų70.551%0.50835%0.346SS..Hα-helixtrans-64.3-48.5175.5-175.8-95.4000111.7V103 V104 F105 L109 S110 I111V103-N107 PolarHBondContact O-N 3.43Å; V104-N107 PolarHBondContact O-N 3.33Å; F105-N107 VanDerWaalsContact C-N 3.33Å; F105-N107 PolarHBondContact O-N 3.49Å; N107-L109 VanDerWaalsContact C-N 3.32Å; N107-L109 PolarHBondContact O-N 2.84Å; N107-S110 WeakPolarHBondContact O-CB 3.45Å; N107-S110 PolarHBondContact O-N 3.41Å; N107-I111 WeakPolarHBondContact O-CG1 3.48Å; N107-I111 PolarHBondContact O-N 2.86Å; N107-I111 WeakPolarHBondContact OD1-CD1 3.12Å
108F96.2Very high93.1Very high9 Ų971.1 Ų71.14%0.03935%0.35CS..Hα-helixtrans-54.5-47174.3163.1-94.3000112.1V104 F105 I111 S112 F240 F269 E272 F273 V276V104-F108 WeakPolarHBondContact O-CB 3.09Å; V104-F108 PolarHBondContact O-N 2.86Å; F105-F108 HydrophobicContact CD2-CD1 4.32Å; F105-F108 HydrophobicContact CE2-CD1 4.41Å; F105-F108 PolarHBondContact O-N 3.1Å; F108-I111 PolarHBondContact O-N 2.82Å; F108-S112 VanDerWaalsContact O-CB 3.28Å; F108-S112 WeakPolarHBondContact O-CB 3.3Å; F108-S112 PolarHBondContact O-N 3.02Å; F108-S112 PolarHBondContact O-OG 2.81Å; F108-F240 AromaticContact CD2-CD1 3.83Å; F108-F240 HydrophobicContact CD2-CD1 3.83Å; F108-F240 AromaticContact CD2-CE1 3.92Å; F108-F240 HydrophobicContact CD2-CE1 3.92Å; F108-F240 AromaticContact CE2-CD1 3.72Å; F108-F240 HydrophobicContact CE2-CD1 3.72Å; F108-F240 HydrophobicContact CE2-CE1 4.23Å; F108-F269 HydrophobicContact CE1-CD1 4.06Å; F108-F269 HydrophobicContact CZ-CD1 4.41Å; F108-E272 HydrophobicContact CE2-CB 4.4Å; F108-E272 HydrophobicContact CZ-CB 3.67Å; F108-F273 HydrophobicContact CB-CD2 4.03Å; F108-F273 HydrophobicContact CD1-CB 3.86Å; F108-F273 HydrophobicContact CD1-CD2 4.07Å; F108-F273 HydrophobicContact CD1-CG 4.43Å; F108-F273 HydrophobicContact CE1-CB 3.83Å; F108-F273 HydrophobicContact CG-CB 4.4Å; F108-F273 AromaticContact CG-CD2 4Å; F108-F273 HydrophobicContact CG-CD2 4Å; F108-F273 HydrophobicContact CZ-CB 4.33Å; F108-V276 HydrophobicContact CD2-CB 4.32Å; F108-V276 HydrophobicContact CD2-CG1 4.41Å; F108-V276 HydrophobicContact CD2-CG2 4.25Å; F108-V276 HydrophobicContact CE2-CB 4.32Å; F108-V276 HydrophobicContact CE2-CG2 3.85Å
109L94.8Very high92.8Very high38 Ų3878.2 Ų78.220%0.19937%0.373CS..Hα-helixtrans-65-42.9-179.9-176.564.2000110.9F105 W106 N107 I111 S112 L113 F269F105-L109 HydrophobicContact CE1-CD2 4.22Å; F105-L109 VanDerWaalsContact O-CB 3.31Å; F105-L109 WeakPolarHBondContact O-CB 3.13Å; F105-L109 PolarHBondContact O-N 3.24Å; W106-L109 PolarHBondContact O-N 3.31Å; N107-L109 VanDerWaalsContact C-N 3.32Å; N107-L109 PolarHBondContact O-N 2.84Å; L109-I111 PolarHBondContact O-N 3.41Å; L109-S112 PolarHBondContact O-N 2.86Å; L109-L113 HydrophobicContact CD1-CD1 4.46Å; L109-L113 HydrophobicContact CD1-CG 4.39Å; L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 HydrophobicContact CG-CG 4.47Å; L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.42Å; L109-L113 PolarHBondContact O-N 3.24Å; L109-F269 HydrophobicContact CD1-CD1 4.19Å; L109-F269 HydrophobicContact CD1-CE1 4.38Å; L109-F269 HydrophobicContact CD1-CG 4.3Å
110S93.9Very high92.6Very high41 Ų4172.9 Ų72.929%0.28735%0.352SS..Hα-helixtrans-58.8-48.7178.1-59.30000111.2W106 N107 L113 I114W106-S110 WeakPolarHBondContact O-CB 3.47Å; W106-S110 PolarHBondContact O-N 3.12Å; W106-S110 PolarHBondContact O-OG 3.39Å; N107-S110 WeakPolarHBondContact O-CB 3.45Å; N107-S110 PolarHBondContact O-N 3.41Å; S110-L113 PolarHBondContact O-N 2.88Å; S110-I114 WeakPolarHBondContact O-CG1 3.06Å; S110-I114 PolarHBondContact O-N 2.64Å; S110-I114 VanDerWaalsContact O-N 3.08Å
111I92.9Very high92.4Very high51 Ų5178.4 Ų78.426%0.26238%0.377SS..Hα-helixtrans-65-44.6177.8-62.8168.2000110.5N107 F108 L109 L113 I114 Y115 F240N107-I111 WeakPolarHBondContact O-CG1 3.48Å; N107-I111 PolarHBondContact O-N 2.86Å; N107-I111 WeakPolarHBondContact OD1-CD1 3.12Å; F108-I111 PolarHBondContact O-N 2.82Å; L109-I111 PolarHBondContact O-N 3.41Å; I111-L113 PolarHBondContact O-N 3.35Å; I111-I114 PolarHBondContact O-N 2.9Å; I111-Y115 HydrophobicContact CG2-CD2 3.75Å; I111-Y115 HydrophobicContact CG2-CE2 3.67Å; I111-Y115 WeakPolarHBondContact O-CD2 3.24Å; I111-Y115 PolarHBondContact O-N 3.14Å; I111-F240 HydrophobicContact CB-CE2 4.48Å; I111-F240 HydrophobicContact CG2-CD2 3.62Å; I111-F240 HydrophobicContact CG2-CE1 4.49Å; I111-F240 HydrophobicContact CG2-CE2 3.38Å; I111-F240 HydrophobicContact CG2-CG 4.29Å; I111-F240 HydrophobicContact CG2-CZ 3.86Å
112S93.1Very high92.3Very high3 Ų379 Ų792%0.02138%0.378CS..Hα-helixtrans-62-31179-600000113.2F108 L109 Q116F108-S112 VanDerWaalsContact O-CB 3.28Å; F108-S112 WeakPolarHBondContact O-CB 3.3Å; F108-S112 PolarHBondContact O-N 3.02Å; F108-S112 PolarHBondContact O-OG 2.81Å; L109-S112 PolarHBondContact O-N 2.86Å; S112-Q116 WeakPolarHBondContact O-CG 3.35Å; S112-Q116 PolarHBondContact O-NE2 3.48Å
113L92Very high92.4Very high90 Ų9076.7 Ų76.747%0.47137%0.371SS..Hα-helixtrans-73.5-39.7173-71171.8000111.6L109 S110 I111 Q116L109-L113 HydrophobicContact CD1-CD1 4.46Å; L109-L113 HydrophobicContact CD1-CG 4.39Å; L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 HydrophobicContact CG-CG 4.47Å; L109-L113 WeakPolarHBondContact O-CB 3.32Å; L109-L113 VanDerWaalsContact O-CG 3.25Å; L109-L113 WeakPolarHBondContact O-CG 3.42Å; L109-L113 PolarHBondContact O-N 3.24Å; S110-L113 PolarHBondContact O-N 2.88Å; I111-L113 PolarHBondContact O-N 3.35Å; L113-Q116 WeakPolarHBondContact O-CB 3.04Å; L113-Q116 PolarHBondContact O-N 3.22Å
114I91.6Very high92.5Very high114 Ų11474.2 Ų74.259%0.58536%0.355SS*.Hα-helixtrans-62-43.8176.6-68.7164.7000110.9S110 I111 Q116 L117S110-I114 WeakPolarHBondContact O-CG1 3.06Å; S110-I114 PolarHBondContact O-N 2.64Å; S110-I114 VanDerWaalsContact O-N 3.08Å; I111-I114 PolarHBondContact O-N 2.9Å; I114-Q116 PolarHBondContact O-N 2.99Å; I114-Q116 VanDerWaalsContact O-N 3.13Å; I114-L117 WeakPolarHBondContact O-CB 3.21Å; I114-L117 PolarHBondContact O-N 2.89Å
115Y88.5Confident92.6Very high85 Ų8574.5 Ų74.533%0.33336%0.355SS..Hα-helixtrans-58.7-25.9176.8-92.4-107.9000113.3I111 L117 I239 F240I111-Y115 HydrophobicContact CG2-CD2 3.75Å; I111-Y115 HydrophobicContact CG2-CE2 3.67Å; I111-Y115 WeakPolarHBondContact O-CD2 3.24Å; I111-Y115 PolarHBondContact O-N 3.14Å; Y115-L117 VanDerWaalsContact C-N 3.29Å; Y115-L117 PolarHBondContact O-N 3.32Å; Y115-I239 HydrophobicContact CD1-CG2 4.04Å; Y115-F240 AromaticContact CD2-CD2 3.88Å; Y115-F240 HydrophobicContact CD2-CD2 3.88Å; Y115-F240 HydrophobicContact CE1-CD2 4.33Å; Y115-F240 AromaticContact CE2-CD2 3.65Å; Y115-F240 HydrophobicContact CE2-CD2 3.65Å; Y115-F240 AromaticContact CE2-CE2 4Å; Y115-F240 HydrophobicContact CE2-CE2 4Å; Y115-F240 HydrophobicContact CG-CD2 4.32Å; Y115-F240 AromaticContact CZ-CD2 3.88Å
116Q86.5Confident92.7Very high61 Ų6172 Ų7229%0.28535%0.345SS..THydrogen-bonded Turntrans-77.3-14.6177.2-71.3171.279.600113.5S112 L113 I114 N118 N236S112-Q116 WeakPolarHBondContact O-CG 3.35Å; S112-Q116 PolarHBondContact O-NE2 3.48Å; L113-Q116 WeakPolarHBondContact O-CB 3.04Å; L113-Q116 PolarHBondContact O-N 3.22Å; I114-Q116 PolarHBondContact O-N 2.99Å; I114-Q116 VanDerWaalsContact O-N 3.13Å; Q116-N118 PolarHBondContact O-N 3.16Å; Q116-N236 HydrophobicContact CG-CB 4.22Å; Q116-N236 PolarHBondContact OE1-ND2 2.89Å; Q116-N236 VanDerWaalsContact OE1-ND2 3.09Å
117L87.3Confident93Very high136 Ų13664.6 Ų64.671%0.71232%0.316SS*.THydrogen-bonded Turntrans-85.43.9178.7-58.1179000112.8I114 Y115 K119I114-L117 WeakPolarHBondContact O-CB 3.21Å; I114-L117 PolarHBondContact O-N 2.89Å; Y115-L117 VanDerWaalsContact C-N 3.29Å; Y115-L117 PolarHBondContact O-N 3.32Å; L117-K119 PolarHBondContact O-N 3.31Å
118N86.4Confident93.2Very high49 Ų4960.1 Ų60.126%0.26229%0.292SS..  trans-58.6133.1179.8-176.229.3000112Q116 D254 G255Q116-N118 PolarHBondContact O-N 3.16Å; N118-D254 WeakPolarHBondContact ND2-CB 3.32Å; N118-G255 PolarHBondContact ND2-O 2.96Å; N118-G255 VanDerWaalsContact ND2-O 3.1Å
119K88.6Confident93.3Very high190 Ų19059.7 Ų59.783%0.82629%0.29SS*.  trans-121.186.3173.8-68.9-175.3-177.5179.90108.2L117L117-K119 PolarHBondContact O-N 3.31Å
120P89.7Confident93.4Very high23 Ų2357.9 Ų57.915%0.14928%0.281CS..  trans-64.5150.3-176.627.1-36.8000112.2F154 I231 I256P120-F154 HydrophobicContact CB-CE2 4.04Å; P120-F154 HydrophobicContact CG-CD2 4.1Å; P120-F154 HydrophobicContact CG-CE2 3.6Å; P120-I231 HydrophobicContact CB-CD1 3.29Å; P120-I231 HydrophobicContact CG-CD1 3.5Å; P120-I256 HydrophobicContact CG-CG2 3.66Å
121K93.1Very high93.6Very high165 Ų16556.5 Ų56.572%0.71727%0.274SS*.  trans-75142.6171.6-66.3178.8-177.61780109.8N123 Q124K121-N123 WeakPolarHBondContact CB-OD1 3.27Å; K121-N123 PolarHBondContact O-N 3.08Å; K121-N123 PolarHBondContact O-OD1 3.2Å; K121-Q124 PolarHBondContact O-NE2 3.39Å
122Y95.3Very high93.5Very high70 Ų7055.9 Ų55.928%0.27528%0.276SS..SBendtrans-80.362.4176.1-61.1-68.6000110.9F154 E157 Q158 K161 T162Y122-F154 AromaticContact CD1-CE2 3.89Å; Y122-F154 HydrophobicContact CD1-CE2 3.89Å; Y122-F154 HydrophobicContact CD1-CZ 4.1Å; Y122-F154 HydrophobicContact CE1-CD2 4.27Å; Y122-F154 AromaticContact CE1-CE2 3.96Å; Y122-F154 HydrophobicContact CE1-CE2 3.96Å; Y122-E157 HydrophobicContact CD1-CB 4.45Å; Y122-E157 HydrophobicContact CE1-CB 3.62Å; Y122-E157 PolarHBondContact OH-OE2 3.38Å; Y122-Q158 VanDerWaalsContact C-OE1 3.23Å; Y122-Q158 HydrophobicContact CD1-CB 3.97Å; Y122-K161 HydrophobicContact CD1-CD 4.46Å; Y122-K161 HydrophobicContact CD2-CD 3.52Å; Y122-K161 HydrophobicContact CE1-CD 4.41Å; Y122-K161 HydrophobicContact CE2-CD 3.49Å; Y122-K161 VanDerWaalsContact CE2-CD 3.49Å; Y122-K161 HydrophobicContact CG-CD 4.03Å; Y122-K161 PolarHBondContact OH-NZ 3.18Å; Y122-T162 VanDerWaalsContact O-CG2 3.26Å; Y122-T162 WeakPolarHBondContact O-CG2 3.35Å
123N96.2Very high93.5Very high71 Ų7156.6 Ų56.638%0.3828%0.284SS..  trans-144.132.7178.271.8-41000110.8K121 H229K121-N123 WeakPolarHBondContact CB-OD1 3.27Å; K121-N123 PolarHBondContact O-N 3.08Å; K121-N123 PolarHBondContact O-OD1 3.2Å; N123-H229 VanDerWaalsContact O-CB 3.23Å; N123-H229 WeakPolarHBondContact O-CB 3.29Å
124Q97.4Very high93.5Very high21 Ų2153.4 Ų53.410%0.09827%0.267CS..  trans-88.5135.1-178.2-50.1-55-43.300109.4K121 F154 Q158 P166 A230 I231K121-Q124 PolarHBondContact O-NE2 3.39Å; Q124-F154 HydrophobicContact CB-CE1 3.97Å; Q124-F154 HydrophobicContact CB-CZ 4.33Å; Q124-F154 HydrophobicContact CG-CE1 3.65Å; Q124-F154 HydrophobicContact CG-CZ 3.54Å; Q124-Q158 PolarHBondContact O-NE2 3.01Å; Q124-P166 WeakPolarHBondContact O-CB 3.47Å; Q124-A230 PolarHBondContact OE1-O 3.28Å; Q124-I231 HydrophobicContact CB-CG2 4.47Å; Q124-I231 HydrophobicContact CG-CB 4.19Å; Q124-I231 HydrophobicContact CG-CG2 4.02Å
125D97.8Very high93.3Very high41 Ų4152.3 Ų52.322%0.21926%0.261CS..SBendtrans-82.6-34.8170.6-61-59.4000110.8P166 Q167 K224 Y228 H229D125-P166 CarbonylContact O-C 3.42Å; D125-P166 WeakPolarHBondContact O-CA 3.43Å; D125-Q167 PolarHBondContact O-N 3.42Å; D125-K224 HydrophobicContact CB-CD 4.3Å; D125-K224 IonicContact OD1-NZ 2.74Å; D125-K224 PolarHBondContact OD1-NZ 2.98Å; D125-K224 IonicContact OD2-NZ 3.02Å; D125-K224 PolarHBondContact OD2-NZ 2.83Å; D125-Y228 VanDerWaalsContact OD2-CA 3.27Å; D125-Y228 WeakPolarHBondContact OD2-CA 3.2Å; D125-H229 WeakPolarHBondContact CA-O 3.32Å; D125-H229 WeakPolarHBondContact CB-O 3.2Å; D125-H229 PolarHBondContact N-O 3.41Å; D125-H229 PolarHBondContact OD2-N 2.73Å
126F98.4Very high93.3Very high4 Ų451.1 Ų51.12%0.01828%0.275CS..EExtended strand (participates in β ladder)trans-130.3143.4-178.1-57.3-84.9000112.4Q167 I201 M220 E223 K224 Y228 H229 A230 I231F126-Q167 CarbonylContact C-O 3.42Å; F126-Q167 WeakPolarHBondContact CA-O 3.36Å; F126-Q167 HydrophobicContact CD1-CB 3.89Å; F126-Q167 HydrophobicContact CE1-CB 4.16Å; F126-Q167 VanDerWaalsContact CE1-OE1 3.28Å; F126-I201 HydrophobicContact CD1-CD1 4.4Å; F126-I201 HydrophobicContact CE1-CD1 3.95Å; F126-M220 HydrophobicContact CB-CG 4.07Å; F126-M220 HydrophobicContact CB-SD 3.49Å; F126-M220 WeakPolarHBondContact CB-SD 3.24Å; F126-M220 HydrophobicContact CD1-CG 3.87Å; F126-M220 HydrophobicContact CD1-SD 4.43Å; F126-M220 HydrophobicContact CD2-CB 4Å; F126-M220 HydrophobicContact CD2-CG 3.6Å; F126-M220 HydrophobicContact CD2-SD 3.69Å; F126-M220 HydrophobicContact CE1-CG 4.2Å; F126-M220 HydrophobicContact CE2-CB 3.94Å; F126-M220 HydrophobicContact CE2-CG 3.96Å; F126-M220 HydrophobicContact CG-CB 4.44Å; F126-M220 HydrophobicContact CG-CG 3.57Å; F126-M220 HydrophobicContact CG-SD 3.62Å; F126-M220 HydrophobicContact CZ-CB 4.32Å; F126-M220 HydrophobicContact CZ-CG 4.25Å; F126-E223 HydrophobicContact CE1-CB 4.23Å; F126-E223 HydrophobicContact CZ-CB 3.81Å; F126-K224 HydrophobicContact CE2-CB 4.14Å; F126-K224 HydrophobicContact CZ-CB 4.34Å; F126-Y228 HydrophobicContact CD2-CD2 4.31Å; F126-Y228 HydrophobicContact CD2-CG 4.21Å; F126-Y228 HydrophobicContact CE2-CG 4.16Å; F126-H229 PolarHBondContact N-O 3.26Å; F126-A230 HydrophobicContact CB-CB 4.05Å; F126-A230 VanDerWaalsContact O-CA 3.3Å; F126-A230 WeakPolarHBondContact O-CA 3.37Å; F126-I231 PolarHBondContact O-N 3.04Å
127V98.5Very high93.4Very high0 Ų048.3 Ų48.30%026%0.263CS..EExtended strand (participates in β ladder)trans-120.9103.1169-179.80000108.1A151 F154 P166 Q167 L168 L169 I231 T233V127-A151 HydrophobicContact CG1-CB 3.79Å; V127-F154 HydrophobicContact CG2-CD1 3.56Å; V127-F154 HydrophobicContact CG2-CE1 3.95Å; V127-P166 HydrophobicContact CG2-CB 3.81Å; V127-P166 HydrophobicContact CG2-CG 3.74Å; V127-Q167 PolarHBondContact N-O 2.91Å; V127-L168 HydrophobicContact CB-CD2 3.72Å; V127-L168 HydrophobicContact CG1-CD2 4.11Å; V127-L168 HydrophobicContact CG2-CD2 4.24Å; V127-L169 PolarHBondContact O-N 3.05Å; V127-I231 CarbonylContact C-O 3.54Å; V127-I231 WeakPolarHBondContact CA-O 3.37Å; V127-I231 HydrophobicContact CB-CG2 4.26Å; V127-I231 HydrophobicContact CG1-CG2 4.13Å; V127-I231 HydrophobicContact CG2-CG2 3.83Å; V127-T233 HydrophobicContact CG1-CG2 3.59Å
128I98.7Very high93.6Very high0 Ų047.7 Ų47.70%025%0.254CS..EExtended strand (participates in β ladder)trans-73.7128.6176.4-54.8169.5000108.6L130 L169 M220 I231 F232 T233 L251 I253I128-L130 HydrophobicContact CG2-CD2 4.07Å; I128-L169 CarbonylContact C-O 3.53Å; I128-L169 WeakPolarHBondContact CA-O 3.46Å; I128-L169 HydrophobicContact CG1-CB 4.49Å; I128-L169 HydrophobicContact CG2-CD2 4.43Å; I128-M220 HydrophobicContact CD1-CE 3.77Å; I128-M220 HydrophobicContact CD1-SD 4.17Å; I128-M220 HydrophobicContact CG1-CE 4.49Å; I128-M220 HydrophobicContact CG1-SD 4.26Å; I128-I231 PolarHBondContact N-O 3.01Å; I128-F232 HydrophobicContact CB-CB 3.93Å; I128-F232 CarbonylContact O-C 3.28Å; I128-F232 VanDerWaalsContact O-CA 3.24Å; I128-F232 WeakPolarHBondContact O-CA 3.46Å; I128-T233 PolarHBondContact O-N 3.46Å; I128-T233 PolarHBondContact O-OG1 3.38Å; I128-L251 HydrophobicContact CD1-CD1 4.43Å; I128-I253 HydrophobicContact CD1-CD1 3.82Å
129V98.6Very high93.9Very high0 Ų052.5 Ų52.50%027%0.273CS..EExtended strand (participates in β ladder)trans-107.7117.4172.2-168.20000107.9R147 I148 A151 L169 M170 S171 M186 T233V129-R147 HydrophobicContact CG1-CB 4.09Å; V129-I148 HydrophobicContact CG1-CG1 4.02Å; V129-A151 HydrophobicContact CG2-CB 3.4Å; V129-A151 VanDerWaalsContact CG2-CB 3.4Å; V129-L169 PolarHBondContact N-O 2.78Å; V129-M170 HydrophobicContact CB-SD 3.67Å; V129-M170 HydrophobicContact CG1-SD 4.2Å; V129-M170 HydrophobicContact CG2-CE 4.26Å; V129-M170 HydrophobicContact CG2-SD 3.58Å; V129-M170 VanDerWaalsContact CG2-SD 3.58Å; V129-S171 PolarHBondContact O-N 3.4Å; V129-M186 HydrophobicContact CB-CE 3.64Å; V129-M186 HydrophobicContact CG1-CE 3.52Å; V129-M186 VanDerWaalsContact O-CE 3.28Å; V129-M186 WeakPolarHBondContact O-CE 3.48Å; V129-T233 WeakPolarHBondContact CA-OG1 3.22Å
130L98Very high94.2Very high0 Ų044.2 Ų44.20%024%0.238CC..EExtended strand (participates in β ladder)trans-83.5133.1-179.2-63.1179.4000111.8I128 R147 T209 N212 M213 F232 T233 A242I128-L130 HydrophobicContact CG2-CD2 4.07Å; L130-R147 WeakPolarHBondContact O-CD 3.45Å; L130-R147 PolarHBondContact O-NH1 2.65Å; L130-T209 HydrophobicContact CD1-CG2 4.06Å; L130-N212 HydrophobicContact CD2-CB 3.7Å; L130-M213 HydrophobicContact CD1-CE 3.81Å; L130-M213 HydrophobicContact CD2-CE 3.94Å; L130-M213 HydrophobicContact CD2-SD 4.31Å; L130-M213 HydrophobicContact CG-CE 4.33Å; L130-F232 HydrophobicContact CD1-CD2 3.92Å; L130-F232 HydrophobicContact CD1-CE2 4.39Å; L130-F232 HydrophobicContact CG-CD2 4.49Å; L130-T233 PolarHBondContact N-O 3.47Å; L130-A242 HydrophobicContact CD1-CB 3.69Å
131G96.1Very high94.4Very high13 Ų1344.3 Ų44.313%0.13424%0.239CC..  trans-55.7154.7171.300000115.1R147 S171 E182G131-R147 PolarHBondContact O-NH1 2.77Å; G131-S171 PolarHBondContact N-O 3.12Å; G131-E182 WeakPolarHBondContact CA-OE2 3.42Å
132A92.7Very high94.4Very high38 Ų3841.1 Ų41.131%0.31424%0.235SC..  trans-147.412-177.500000114.1L144 E182A132-L144 HydrophobicContact CB-CB 4.11Å; A132-L144 HydrophobicContact CB-CD1 4.14Å; A132-E182 PolarHBondContact N-OE2 2.9Å
133G91.1Very high94.2Very high18 Ų1840.2 Ų40.219%0.18623%0.234CC..  trans87.1153.2-176.700000114.7T141 E178 E182G133-T141 WeakPolarHBondContact O-CG2 3.5Å; G133-T141 PolarHBondContact O-OG1 2.9Å; G133-E178 WeakPolarHBondContact CA-OE1 3.43Å; G133-E182 VanDerWaalsContact CA-OE1 3.24Å; G133-E182 WeakPolarHBondContact CA-OE1 3.34Å; G133-E182 PolarHBondContact N-OE1 3.15Å; G133-E182 PolarHBondContact N-OE2 3.35Å
134L92.1Very high94.2Very high22 Ų2236.9 Ų36.912%0.11522%0.216CC..EExtended strand (participates in β ladder)trans-105.5145.6179.3-57.2179.5000114.2K139 V140 L144 E178 I180 E182 A185L134-K139 CarbonylContact C-O 3.54Å; L134-K139 WeakPolarHBondContact CA-O 3.31Å; L134-V140 HydrophobicContact CD2-CG1 4.48Å; L134-L144 HydrophobicContact CD2-CD2 3.8Å; L134-E178 PolarHBondContact N-OE1 3.5Å; L134-I180 HydrophobicContact CD1-CG1 3.97Å; L134-E182 HydrophobicContact CG-CG 4.16Å; L134-A185 HydrophobicContact CD1-CB 3.97Å; L134-A185 HydrophobicContact CD2-CB 3.59Å; L134-A185 HydrophobicContact CG-CB 4.45Å
135I88.4Confident94.2Very high91 Ų9136.4 Ų36.447%0.46722%0.216SC..EExtended strand (participates in β ladder)trans-74.5123.8166.6-58.3-179000108.8G137 K138 K139 T141I135-G137 PolarHBondContact O-N 3.38Å; I135-G137 VanDerWaalsContact O-N 3.09Å; I135-K138 PolarHBondContact O-N 2.66Å; I135-K139 HydrophobicContact CB-CB 4.38Å; I135-K139 PolarHBondContact N-O 3.09Å; I135-K139 PolarHBondContact O-N 3.36Å; I135-T141 HydrophobicContact CD1-CG2 4.29Å; I135-T141 HydrophobicContact CG1-CG2 3.5Å
136G87.8Confident94.1Very high60 Ų6039.1 Ų39.162%0.61923%0.226SC*.THydrogen-bonded Turntrans6020.4179.300000113.6K138G136-K138 VanDerWaalsContact C-N 3.25Å; G136-K138 PolarHBondContact O-N 2.95Å
137G88.7Confident94Very high3 Ų339.5 Ų39.53%0.03123%0.227CC..THydrogen-bonded Turntrans69.113.7-17900000115.4I135 K179 I180I135-G137 PolarHBondContact O-N 3.38Å; I135-G137 VanDerWaalsContact O-N 3.09Å; G137-K179 WeakPolarHBondContact O-CB 3.49Å; G137-K179 PolarHBondContact O-N 2.96Å; G137-I180 PolarHBondContact O-N 3.22Å
138K92.7Very high94Very high123 Ų12339.5 Ų39.554%0.53523%0.227SC..THydrogen-bonded Turntrans-140.2-30.9-178.3-70.7-171.5170-170.10115.1I135 G136 K179I135-K138 PolarHBondContact O-N 2.66Å; G136-K138 VanDerWaalsContact C-N 3.25Å; G136-K138 PolarHBondContact O-N 2.95Å; K138-K179 HydrophobicContact CD-CB 4.45Å; K138-K179 HydrophobicContact CD-CD 4.12Å; K138-K179 HydrophobicContact CG-CB 3.87Å; K138-K179 HydrophobicContact CG-CD 4.05Å; K138-K179 HydrophobicContact CG-CG 4.4Å
139K92.6Very high94Very high149 Ų14941.6 Ų41.665%0.64824%0.238SC*.EExtended strand (participates in β ladder)trans-106.5138.8-171.7-172.5173.2-176.7173.20110.9L134 I135 T141L134-K139 CarbonylContact C-O 3.54Å; L134-K139 WeakPolarHBondContact CA-O 3.31Å; I135-K139 HydrophobicContact CB-CB 4.38Å; I135-K139 PolarHBondContact N-O 3.09Å; I135-K139 PolarHBondContact O-N 3.36Å; K139-T141 PolarHBondContact O-N 3.35Å
140V95.1Very high93.9Very high16 Ų1644.5 Ų44.510%0.09725%0.25CC..EExtended strand (participates in β ladder)trans-58.2135175.1-60.90000111.5L134 L144 A145 I148 A185 Y189L134-V140 HydrophobicContact CD2-CG1 4.48Å; V140-L144 HydrophobicContact CB-CB 4.4Å; V140-L144 HydrophobicContact CB-CD2 4.17Å; V140-L144 HydrophobicContact CB-CG 4.31Å; V140-L144 HydrophobicContact CG1-CD2 4.01Å; V140-L144 HydrophobicContact CG1-CG 4.35Å; V140-A145 HydrophobicContact CG2-CB 4.28Å; V140-I148 HydrophobicContact CG1-CD1 4.03Å; V140-A185 HydrophobicContact CG1-CB 4.09Å; V140-Y189 HydrophobicContact CG1-CG 4.49Å; V140-Y189 HydrophobicContact CG2-CD2 3.45Å; V140-Y189 VanDerWaalsContact CG2-CD2 3.45Å; V140-Y189 HydrophobicContact CG2-CE2 3.87Å; V140-Y189 HydrophobicContact CG2-CG 3.97Å
141T93.5Very high93.9Very high26 Ų2644.5 Ų44.516%0.1625%0.25CC..  trans-72.3159.4172.658.60000110.8G133 I135 K139 L143 L144 A145G133-T141 WeakPolarHBondContact O-CG2 3.5Å; G133-T141 PolarHBondContact O-OG1 2.9Å; I135-T141 HydrophobicContact CD1-CG2 4.29Å; I135-T141 HydrophobicContact CG1-CG2 3.5Å; K139-T141 PolarHBondContact O-N 3.35Å; T141-L143 PolarHBondContact O-N 3.5Å; T141-L144 PolarHBondContact O-N 3.34Å; T141-L144 VanDerWaalsContact O-N 3.08Å; T141-L144 VanDerWaalsContact OG1-CB 3.31Å; T141-L144 WeakPolarHBondContact OG1-CB 3.45Å; T141-L144 PolarHBondContact OG1-N 3.48Å; T141-L144 VanDerWaalsContact OG1-N 3.12Å; T141-A145 WeakPolarHBondContact O-CB 3.43Å; T141-A145 PolarHBondContact O-N 3.21Å
142P92.1Very high94Very high98 Ų9844.2 Ų44.264%0.63625%0.245SC*.Hα-helixtrans-54.2-35.1171.4-28.934.6000113.7K146P142-K146 VanDerWaalsContact O-CG 3.24Å; P142-K146 WeakPolarHBondContact O-CG 3.15Å; P142-K146 PolarHBondContact O-N 2.71Å; P142-K146 VanDerWaalsContact O-N 3.12Å
143L91.9Very high94.3Very high51 Ų5146.4 Ų46.427%0.26725%0.249SC..Hα-helixtrans-68.9-42.8175.9-74.8174.9000111.9T141 K146 R147 N235 T260 Y264T141-L143 PolarHBondContact O-N 3.5Å; L143-K146 PolarHBondContact O-N 2.87Å; L143-R147 WeakPolarHBondContact O-CG 3.28Å; L143-R147 PolarHBondContact O-N 2.96Å; L143-N235 PolarHBondContact O-ND2 3.25Å; L143-T260 HydrophobicContact CD2-CG2 4.12Å; L143-Y264 HydrophobicContact CD1-CE1 4.29Å
144L95.4Very high94.6Very high0 Ų045.7 Ų45.70%024%0.24CC..Hα-helixtrans-66.1-46177-174.952.3000111.2A132 L134 V140 T141 K146 R147 I148 M186A132-L144 HydrophobicContact CB-CB 4.11Å; A132-L144 HydrophobicContact CB-CD1 4.14Å; L134-L144 HydrophobicContact CD2-CD2 3.8Å; V140-L144 HydrophobicContact CB-CB 4.4Å; V140-L144 HydrophobicContact CB-CD2 4.17Å; V140-L144 HydrophobicContact CB-CG 4.31Å; V140-L144 HydrophobicContact CG1-CD2 4.01Å; V140-L144 HydrophobicContact CG1-CG 4.35Å; T141-L144 PolarHBondContact O-N 3.34Å; T141-L144 VanDerWaalsContact O-N 3.08Å; T141-L144 VanDerWaalsContact OG1-CB 3.31Å; T141-L144 WeakPolarHBondContact OG1-CB 3.45Å; T141-L144 PolarHBondContact OG1-N 3.48Å; T141-L144 VanDerWaalsContact OG1-N 3.12Å; L144-K146 VanDerWaalsContact C-N 3.26Å; L144-K146 PolarHBondContact O-N 3.21Å; L144-R147 WeakPolarHBondContact O-CA 3.38Å; L144-R147 WeakPolarHBondContact O-CB 3.46Å; L144-R147 PolarHBondContact O-N 3.34Å; L144-I148 HydrophobicContact CG-CD1 4.18Å; L144-I148 WeakPolarHBondContact O-CG1 3.23Å; L144-I148 PolarHBondContact O-N 2.96Å; L144-M186 HydrophobicContact CD1-CE 4.23Å; L144-M186 HydrophobicContact CD1-CG 4.01Å; L144-M186 HydrophobicContact CD1-SD 4Å; L144-M186 HydrophobicContact CD2-CG 3.88Å; L144-M186 HydrophobicContact CD2-SD 4.39Å; L144-M186 HydrophobicContact CG-CG 4.11Å
145A96.8Very high94.9Very high12 Ų1245.7 Ų45.710%0.09924%0.239CC..Hα-helixtrans-53.6-43.9174.300000111.4V140 T141 R147 I148 D149 Y189V140-A145 HydrophobicContact CG2-CB 4.28Å; T141-A145 WeakPolarHBondContact O-CB 3.43Å; T141-A145 PolarHBondContact O-N 3.21Å; A145-R147 VanDerWaalsContact C-N 3.27Å; A145-R147 PolarHBondContact O-N 2.86Å; A145-I148 PolarHBondContact O-N 2.89Å; A145-D149 WeakPolarHBondContact O-CB 3.16Å; A145-D149 PolarHBondContact O-N 3.46Å; A145-Y189 HydrophobicContact CB-CE1 4.28Å; A145-Y189 HydrophobicContact CB-CE2 4.34Å
146K96.3Very high95.3Very high97 Ų9747.5 Ų47.542%0.42224%0.24SC..Hα-helixtrans-62.3-30.6176.7-72.9-72.9157.2-126.60113.9P142 L143 L144 D149 R150 S258P142-K146 VanDerWaalsContact O-CG 3.24Å; P142-K146 WeakPolarHBondContact O-CG 3.15Å; P142-K146 PolarHBondContact O-N 2.71Å; P142-K146 VanDerWaalsContact O-N 3.12Å; L143-K146 PolarHBondContact O-N 2.87Å; L144-K146 VanDerWaalsContact C-N 3.26Å; L144-K146 PolarHBondContact O-N 3.21Å; K146-D149 IonicContact NZ-OD2 2.79Å; K146-D149 PolarHBondContact NZ-OD2 3.17Å; K146-R150 WeakPolarHBondContact O-CB 3.35Å; K146-R150 PolarHBondContact O-N 3.26Å; K146-S258 WeakPolarHBondContact O-CB 3.46Å
147R97.3Very high95.8Very high13 Ų1347 Ų475%0.04922%0.221CC..Hα-helixtrans-70.7-47.8174.1-60.5177.8-179.1-162.84.9110.6V129 L130 G131 L143 L144 A145 R150 A151 S234 N235V129-R147 HydrophobicContact CG1-CB 4.09Å; L130-R147 WeakPolarHBondContact O-CD 3.45Å; L130-R147 PolarHBondContact O-NH1 2.65Å; G131-R147 PolarHBondContact O-NH1 2.77Å; L143-R147 WeakPolarHBondContact O-CG 3.28Å; L143-R147 PolarHBondContact O-N 2.96Å; L144-R147 WeakPolarHBondContact O-CA 3.38Å; L144-R147 WeakPolarHBondContact O-CB 3.46Å; L144-R147 PolarHBondContact O-N 3.34Å; A145-R147 VanDerWaalsContact C-N 3.27Å; A145-R147 PolarHBondContact O-N 2.86Å; R147-R150 WeakPolarHBondContact O-CB 3.43Å; R147-R150 PolarHBondContact O-N 3.34Å; R147-R150 VanDerWaalsContact O-N 3.14Å; R147-A151 PolarHBondContact O-N 3.04Å; R147-S234 PolarHBondContact NE-OG 3.36Å; R147-S234 PolarHBondContact NH1-OG 2.85Å; R147-S234 VanDerWaalsContact NH1-OG 3.16Å; R147-S234 PolarHBondContact NH2-OG 3.49Å; R147-N235 VanDerWaalsContact CZ-OD1 3.22Å; R147-N235 PolarHBondContact NE-OD1 3.22Å; R147-N235 PolarHBondContact NH2-OD1 2.84Å
148I98.2Very high96.2Very high0 Ų046.9 Ų46.90%022%0.22CC..Hα-helixtrans-61.3-47.8177.8-54162.3000110V129 V140 L144 A145 R150 A151 I152 M170 M186 Y189 A190V129-I148 HydrophobicContact CG1-CG1 4.02Å; V140-I148 HydrophobicContact CG1-CD1 4.03Å; L144-I148 HydrophobicContact CG-CD1 4.18Å; L144-I148 WeakPolarHBondContact O-CG1 3.23Å; L144-I148 PolarHBondContact O-N 2.96Å; A145-I148 PolarHBondContact O-N 2.89Å; I148-R150 PolarHBondContact O-N 2.89Å; I148-A151 WeakPolarHBondContact O-CA 3.48Å; I148-A151 WeakPolarHBondContact O-CB 3.4Å; I148-A151 PolarHBondContact O-N 3.13Å; I148-I152 HydrophobicContact CG2-CD1 3.75Å; I148-I152 HydrophobicContact CG2-CG1 4.21Å; I148-I152 WeakPolarHBondContact O-CG1 3.25Å; I148-I152 PolarHBondContact O-N 2.97Å; I148-M170 HydrophobicContact CG2-CE 4.19Å; I148-M186 HydrophobicContact CD1-CB 4Å; I148-M186 HydrophobicContact CD1-CG 3.91Å; I148-M186 HydrophobicContact CG1-CB 4.44Å; I148-M186 HydrophobicContact CG1-CG 4.35Å; I148-Y189 HydrophobicContact CB-CD1 4.03Å; I148-Y189 HydrophobicContact CB-CE1 4.32Å; I148-Y189 HydrophobicContact CD1-CD1 3.72Å; I148-Y189 HydrophobicContact CD1-CE1 4.49Å; I148-Y189 HydrophobicContact CD1-CG 4.09Å; I148-Y189 HydrophobicContact CG2-CD1 3.78Å; I148-Y189 HydrophobicContact CG2-CE1 4.33Å; I148-A190 HydrophobicContact CG2-CB 4.2Å
149D98.1Very high96.4Very high43 Ų4342.3 Ų42.323%0.2320%0.203CC..Hα-helixtrans-52.8-40.9174.6-70.9-14.1000111.7A145 K146 I152 Q153 Y189A145-D149 WeakPolarHBondContact O-CB 3.16Å; A145-D149 PolarHBondContact O-N 3.46Å; K146-D149 IonicContact NZ-OD2 2.79Å; K146-D149 PolarHBondContact NZ-OD2 3.17Å; D149-I152 PolarHBondContact O-N 2.97Å; D149-Q153 WeakPolarHBondContact O-CB 3.47Å; D149-Q153 PolarHBondContact O-N 3.06Å; D149-Y189 PolarHBondContact OD1-OH 3.08Å
150R97.4Very high96.6Very high62 Ų6242.8 Ų42.823%0.23421%0.208CC..Hα-helixtrans-70.5-37.7-179.8-174.857.8175149.810.3111.7K146 R147 I148 F154 I256K146-R150 WeakPolarHBondContact O-CB 3.35Å; K146-R150 PolarHBondContact O-N 3.26Å; R147-R150 WeakPolarHBondContact O-CB 3.43Å; R147-R150 PolarHBondContact O-N 3.34Å; R147-R150 VanDerWaalsContact O-N 3.14Å; I148-R150 PolarHBondContact O-N 2.89Å; R150-F154 PolarHBondContact O-N 3.39Å; R150-F154 VanDerWaalsContact O-N 3.11Å; R150-I256 HydrophobicContact CG-CD1 4.28Å; R150-I256 HydrophobicContact CG-CG1 4.47Å
151A98.1Very high96.7Very high0 Ų047.8 Ų47.80%023%0.228CC..Hα-helixtrans-65.6-45.7173.100000111.5V127 V129 R147 I148 Q153 F154 Y155 L168 T233V127-A151 HydrophobicContact CG1-CB 3.79Å; V129-A151 HydrophobicContact CG2-CB 3.4Å; V129-A151 VanDerWaalsContact CG2-CB 3.4Å; R147-A151 PolarHBondContact O-N 3.04Å; I148-A151 WeakPolarHBondContact O-CA 3.48Å; I148-A151 WeakPolarHBondContact O-CB 3.4Å; I148-A151 PolarHBondContact O-N 3.13Å; A151-Q153 VanDerWaalsContact C-N 3.32Å; A151-Q153 PolarHBondContact O-N 3.28Å; A151-F154 PolarHBondContact O-N 3.35Å; A151-F154 VanDerWaalsContact O-N 3.15Å; A151-Y155 WeakPolarHBondContact O-CB 3.43Å; A151-Y155 PolarHBondContact O-N 3.24Å; A151-L168 HydrophobicContact CB-CD2 4.17Å; A151-T233 HydrophobicContact CB-CG2 3.69Å
152I98.3Very high96.8Very high6 Ų649.3 Ų49.33%0.03124%0.238CC..Hα-helixtrans-59.7-42.8175.4-71173.6000111.1I148 D149 F154 Y155 R156 L168 A190 Q193 I195I148-I152 HydrophobicContact CG2-CD1 3.75Å; I148-I152 HydrophobicContact CG2-CG1 4.21Å; I148-I152 WeakPolarHBondContact O-CG1 3.25Å; I148-I152 PolarHBondContact O-N 2.97Å; D149-I152 PolarHBondContact O-N 2.97Å; I152-F154 VanDerWaalsContact C-N 3.35Å; I152-F154 PolarHBondContact O-N 2.95Å; I152-Y155 WeakPolarHBondContact O-CB 3.24Å; I152-Y155 PolarHBondContact O-N 2.88Å; I152-R156 HydrophobicContact CG2-CG 4.47Å; I152-R156 WeakPolarHBondContact O-CG 3.44Å; I152-R156 PolarHBondContact O-N 3.11Å; I152-L168 HydrophobicContact CG1-CD1 4.18Å; I152-A190 HydrophobicContact CD1-CB 4.39Å; I152-Q193 HydrophobicContact CD1-CB 3.58Å; I152-Q193 HydrophobicContact CD1-CG 3.81Å; I152-I195 HydrophobicContact CB-CD1 4.47Å; I152-I195 HydrophobicContact CD1-CG1 4.11Å; I152-I195 HydrophobicContact CG1-CD1 4.06Å; I152-I195 HydrophobicContact CG1-CG1 3.82Å; I152-I195 HydrophobicContact CG2-CD1 4.07Å
153Q97.5Very high96.9Very high85 Ų8552.1 Ų52.140%0.39725%0.247SC..Hα-helixtrans-58.9-48.6174.9-177.9-173.2-2.600110.7D149 A151 R156 E157D149-Q153 WeakPolarHBondContact O-CB 3.47Å; D149-Q153 PolarHBondContact O-N 3.06Å; A151-Q153 VanDerWaalsContact C-N 3.32Å; A151-Q153 PolarHBondContact O-N 3.28Å; Q153-R156 PolarHBondContact O-N 2.94Å; Q153-E157 HydrophobicContact CG-CG 4.48Å; Q153-E157 WeakPolarHBondContact CG-OE1 3.47Å; Q153-E157 PolarHBondContact NE2-OE1 2.84Å; Q153-E157 WeakPolarHBondContact O-CB 3.28Å; Q153-E157 VanDerWaalsContact O-CG 3.32Å; Q153-E157 WeakPolarHBondContact O-CG 3.44Å; Q153-E157 PolarHBondContact O-N 3.4Å
154F97.5Very high97Very high3 Ų352.9 Ų52.91%0.01326%0.256CS..Hα-helixtrans-63.4-42.9178.8-176.2-89.2000112P120 Y122 Q124 V127 R150 A151 I152 R156 E157 Q158 P166 I231 I256P120-F154 HydrophobicContact CB-CE2 4.04Å; P120-F154 HydrophobicContact CG-CD2 4.1Å; P120-F154 HydrophobicContact CG-CE2 3.6Å; Y122-F154 AromaticContact CD1-CE2 3.89Å; Y122-F154 HydrophobicContact CD1-CE2 3.89Å; Y122-F154 HydrophobicContact CD1-CZ 4.1Å; Y122-F154 HydrophobicContact CE1-CD2 4.27Å; Y122-F154 AromaticContact CE1-CE2 3.96Å; Y122-F154 HydrophobicContact CE1-CE2 3.96Å; Q124-F154 HydrophobicContact CB-CE1 3.97Å; Q124-F154 HydrophobicContact CB-CZ 4.33Å; Q124-F154 HydrophobicContact CG-CE1 3.65Å; Q124-F154 HydrophobicContact CG-CZ 3.54Å; V127-F154 HydrophobicContact CG2-CD1 3.56Å; V127-F154 HydrophobicContact CG2-CE1 3.95Å; R150-F154 PolarHBondContact O-N 3.39Å; R150-F154 VanDerWaalsContact O-N 3.11Å; A151-F154 PolarHBondContact O-N 3.35Å; A151-F154 VanDerWaalsContact O-N 3.15Å; I152-F154 VanDerWaalsContact C-N 3.35Å; I152-F154 PolarHBondContact O-N 2.95Å; F154-R156 PolarHBondContact O-N 3.33Å; F154-E157 PolarHBondContact O-N 3.06Å; F154-Q158 HydrophobicContact CE1-CB 4.42Å; F154-Q158 WeakPolarHBondContact O-CB 3.34Å; F154-Q158 PolarHBondContact O-N 2.93Å; F154-P166 HydrophobicContact CD1-CG 4.48Å; F154-I231 HydrophobicContact CD1-CG2 4.49Å; F154-I231 HydrophobicContact CE1-CG2 4.3Å; F154-I256 HydrophobicContact CB-CD1 3.79Å; F154-I256 HydrophobicContact CD2-CD1 4.11Å; F154-I256 HydrophobicContact CG-CD1 4Å
155Y98.3Very high97.1Very high21 Ų2155.4 Ų55.48%0.08227%0.273CS..Hα-helixtrans-52.6-55.4173.3170.5-79.9000110.5A151 I152 E157 Q158 S159 P165 P166 L168 I195 D199A151-Y155 WeakPolarHBondContact O-CB 3.43Å; A151-Y155 PolarHBondContact O-N 3.24Å; I152-Y155 WeakPolarHBondContact O-CB 3.24Å; I152-Y155 PolarHBondContact O-N 2.88Å; Y155-E157 PolarHBondContact O-N 3.41Å; Y155-Q158 PolarHBondContact O-N 2.85Å; Y155-S159 WeakPolarHBondContact O-CB 3.48Å; Y155-S159 PolarHBondContact O-N 3.14Å; Y155-S159 PolarHBondContact O-OG 3.5Å; Y155-P165 HydrophobicContact CD2-CB 4.23Å; Y155-P165 HydrophobicContact CE2-CB 3.46Å; Y155-P165 VanDerWaalsContact CE2-CB 3.46Å; Y155-P166 HydrophobicContact CD2-CG 3.98Å; Y155-P166 WeakPolarHBondContact CD2-O 3.2Å; Y155-P166 VanDerWaalsContact CE2-O 3.32Å; Y155-P166 WeakPolarHBondContact CE2-O 3.35Å; Y155-P166 HydrophobicContact CG-CG 4.45Å; Y155-L168 HydrophobicContact CD2-CD2 4.23Å; Y155-L168 HydrophobicContact CD2-CG 4.1Å; Y155-I195 HydrophobicContact CD1-CD1 3.63Å; Y155-I195 HydrophobicContact CE1-CD1 3.79Å; Y155-I195 HydrophobicContact CG-CD1 4.17Å; Y155-D199 HydrophobicContact CE2-CB 3.84Å; Y155-D199 WeakPolarHBondContact CE2-OD2 3.39Å; Y155-D199 PolarHBondContact OH-OD2 2.81Å
156R98Very high97.1Very high129 Ų12954.8 Ų54.849%0.48727%0.268SS..Hα-helixtrans-62-44.8-178-70.1176.6-177.3169.92.3112I152 Q153 F154 Q158 S159 E160 Q193I152-R156 HydrophobicContact CG2-CG 4.47Å; I152-R156 WeakPolarHBondContact O-CG 3.44Å; I152-R156 PolarHBondContact O-N 3.11Å; Q153-R156 PolarHBondContact O-N 2.94Å; F154-R156 PolarHBondContact O-N 3.33Å; R156-Q158 VanDerWaalsContact C-N 3.32Å; R156-Q158 PolarHBondContact O-N 2.96Å; R156-S159 PolarHBondContact O-N 3.18Å; R156-E160 WeakPolarHBondContact O-CB 3.43Å; R156-E160 PolarHBondContact O-N 3.43Å; R156-Q193 PolarHBondContact NH2-O 2.83Å
157E97.3Very high97.2Very high49 Ų4952.8 Ų52.823%0.22926%0.26CS..Hα-helixtrans-62-38.7177.8-73.9176.8-164.900112.4Y122 Q153 F154 Y155 K161Y122-E157 HydrophobicContact CD1-CB 4.45Å; Y122-E157 HydrophobicContact CE1-CB 3.62Å; Y122-E157 PolarHBondContact OH-OE2 3.38Å; Q153-E157 HydrophobicContact CG-CG 4.48Å; Q153-E157 WeakPolarHBondContact CG-OE1 3.47Å; Q153-E157 PolarHBondContact NE2-OE1 2.84Å; Q153-E157 WeakPolarHBondContact O-CB 3.28Å; Q153-E157 VanDerWaalsContact O-CG 3.32Å; Q153-E157 WeakPolarHBondContact O-CG 3.44Å; Q153-E157 PolarHBondContact O-N 3.4Å; F154-E157 PolarHBondContact O-N 3.06Å; Y155-E157 PolarHBondContact O-N 3.41Å; E157-K161 WeakPolarHBondContact O-CB 3.39Å; E157-K161 WeakPolarHBondContact O-CD 3.45Å; E157-K161 WeakPolarHBondContact O-CG 3.4Å; E157-K161 PolarHBondContact O-N 2.95Å
158Q97.8Very high97.3Very high2 Ų252.2 Ų52.21%0.00926%0.258CS..Hα-helixtrans-70.7-49.4175.7-176.4170.3-69.700110.9Y122 Q124 F154 Y155 R156 E160 K161 T162 S164Y122-Q158 VanDerWaalsContact C-OE1 3.23Å; Y122-Q158 HydrophobicContact CD1-CB 3.97Å; Q124-Q158 PolarHBondContact O-NE2 3.01Å; F154-Q158 HydrophobicContact CE1-CB 4.42Å; F154-Q158 WeakPolarHBondContact O-CB 3.34Å; F154-Q158 PolarHBondContact O-N 2.93Å; Y155-Q158 PolarHBondContact O-N 2.85Å; R156-Q158 VanDerWaalsContact C-N 3.32Å; R156-Q158 PolarHBondContact O-N 2.96Å; Q158-E160 PolarHBondContact O-N 3.16Å; Q158-K161 PolarHBondContact O-N 3.2Å; Q158-T162 HydrophobicContact CG-CG2 4.39Å; Q158-T162 PolarHBondContact O-N 3.28Å; Q158-T162 PolarHBondContact O-OG1 2.79Å; Q158-S164 PolarHBondContact NE2-O 3.21Å
159S97.1Very high97.3Very high26 Ų2652.2 Ų52.218%0.18226%0.258CS..Hα-helixtrans-54.6-42.1179.3-55.20000111.9Y155 R156 L163 P165Y155-S159 WeakPolarHBondContact O-CB 3.48Å; Y155-S159 PolarHBondContact O-N 3.14Å; Y155-S159 PolarHBondContact O-OG 3.5Å; R156-S159 PolarHBondContact O-N 3.18Å; S159-L163 VanDerWaalsContact O-CA 3.26Å; S159-L163 WeakPolarHBondContact O-CA 3.32Å; S159-L163 PolarHBondContact O-N 2.71Å; S159-P165 WeakPolarHBondContact OG-CA 3.4Å; S159-P165 VanDerWaalsContact OG-CB 3.28Å; S159-P165 WeakPolarHBondContact OG-CB 3.4Å
160E96.9Very high97.4Very high159 Ų15950.1 Ų50.174%0.74325%0.247SC*.Hα-helixtrans-65.8-39176.6-173.3-177.5177.700112.5R156 Q158R156-E160 WeakPolarHBondContact O-CB 3.43Å; R156-E160 PolarHBondContact O-N 3.43Å; Q158-E160 PolarHBondContact O-N 3.16Å
161K96.5Very high97.4Very high121 Ų12147.2 Ų47.253%0.52624%0.236SC..Hα-helixtrans-85-29.8-173.5-72.8174.9-175179.80114.4Y122 E157 Q158Y122-K161 HydrophobicContact CD1-CD 4.46Å; Y122-K161 HydrophobicContact CD2-CD 3.52Å; Y122-K161 HydrophobicContact CE1-CD 4.41Å; Y122-K161 HydrophobicContact CE2-CD 3.49Å; Y122-K161 VanDerWaalsContact CE2-CD 3.49Å; Y122-K161 HydrophobicContact CG-CD 4.03Å; Y122-K161 PolarHBondContact OH-NZ 3.18Å; E157-K161 WeakPolarHBondContact O-CB 3.39Å; E157-K161 WeakPolarHBondContact O-CD 3.45Å; E157-K161 WeakPolarHBondContact O-CG 3.4Å; E157-K161 PolarHBondContact O-N 2.95Å; Q158-K161 PolarHBondContact O-N 3.2Å
162T96Very high97.4Very high58 Ų5847.3 Ų47.336%0.35624%0.237SC..Hα-helixtrans-122.7-9.4-171.766.80000114Y122 Q158 S164Y122-T162 VanDerWaalsContact O-CG2 3.26Å; Y122-T162 WeakPolarHBondContact O-CG2 3.35Å; Q158-T162 HydrophobicContact CG-CG2 4.39Å; Q158-T162 PolarHBondContact O-N 3.28Å; Q158-T162 PolarHBondContact O-OG1 2.79Å; T162-S164 PolarHBondContact O-N 3Å; T162-S164 VanDerWaalsContact O-N 3.14Å; T162-S164 PolarHBondContact OG1-N 3.48Å; T162-S164 PolarHBondContact OG1-O 3.25Å
163L94.1Very high97.2Very high157 Ų15747.1 Ų47.182%0.82224%0.237SC*.SBendtrans57.319.4-170.3-51174.7000112.9S159S159-L163 VanDerWaalsContact O-CA 3.26Å; S159-L163 WeakPolarHBondContact O-CA 3.32Å; S159-L163 PolarHBondContact O-N 2.71Å
164S94.5Very high96.9Very high67 Ų6748.1 Ų48.147%0.46924%0.241SC..  trans-128.187.9-180-174.30000108.8Q158 T162Q158-S164 PolarHBondContact NE2-O 3.21Å; T162-S164 PolarHBondContact O-N 3Å; T162-S164 VanDerWaalsContact O-N 3.14Å; T162-S164 PolarHBondContact OG1-N 3.48Å; T162-S164 PolarHBondContact OG1-O 3.25Å
165P96.7Very high96.3Very high53 Ų5349 Ų4934%0.34425%0.252SS..PPolyproline II helixtrans-58.2141.2175.122.3-30.9000111Y155 S159Y155-P165 HydrophobicContact CD2-CB 4.23Å; Y155-P165 HydrophobicContact CE2-CB 3.46Å; Y155-P165 VanDerWaalsContact CE2-CB 3.46Å; S159-P165 WeakPolarHBondContact OG-CA 3.4Å; S159-P165 VanDerWaalsContact OG-CB 3.28Å; S159-P165 WeakPolarHBondContact OG-CB 3.4Å
166P97.9Very high95.6Very high0 Ų054.4 Ų54.40%029%0.289CS..PPolyproline II helixtrans-77.3156.2166.532.1-31.2000110.4Q124 D125 V127 F154 Y155Q124-P166 WeakPolarHBondContact O-CB 3.47Å; D125-P166 CarbonylContact O-C 3.42Å; D125-P166 WeakPolarHBondContact O-CA 3.43Å; V127-P166 HydrophobicContact CG2-CB 3.81Å; V127-P166 HydrophobicContact CG2-CG 3.74Å; F154-P166 HydrophobicContact CD1-CG 4.48Å; Y155-P166 HydrophobicContact CD2-CG 3.98Å; Y155-P166 WeakPolarHBondContact CD2-O 3.2Å; Y155-P166 VanDerWaalsContact CE2-O 3.32Å; Y155-P166 WeakPolarHBondContact CE2-O 3.35Å; Y155-P166 HydrophobicContact CG-CG 4.45Å
167Q98.5Very high94.8Very high55 Ų5555.1 Ų55.126%0.25730%0.303SS..EExtended strand (participates in β ladder)trans-78131.4165.6-67.6-166.9-64.400110.7D125 F126 V127 L169 E198 D199 I201D125-Q167 PolarHBondContact O-N 3.42Å; F126-Q167 CarbonylContact C-O 3.42Å; F126-Q167 WeakPolarHBondContact CA-O 3.36Å; F126-Q167 HydrophobicContact CD1-CB 3.89Å; F126-Q167 HydrophobicContact CE1-CB 4.16Å; F126-Q167 VanDerWaalsContact CE1-OE1 3.28Å; V127-Q167 PolarHBondContact N-O 2.91Å; Q167-L169 PolarHBondContact O-N 3.4Å; Q167-E198 PolarHBondContact NE2-O 2.99Å; Q167-D199 CarbonylContact C-O 3.51Å; Q167-D199 WeakPolarHBondContact CA-O 3.36Å; Q167-I201 HydrophobicContact CB-CD1 4.14Å; Q167-I201 HydrophobicContact CG-CD1 4.46Å
168L98.8Very high94.3Very high0 Ų053.9 Ų53.90%030%0.297CS..EExtended strand (participates in β ladder)trans-84.5110.4172.5-60.6-171.5000109.6V127 A151 I152 Y155 M170 I195 D199 I200 I201V127-L168 HydrophobicContact CB-CD2 3.72Å; V127-L168 HydrophobicContact CG1-CD2 4.11Å; V127-L168 HydrophobicContact CG2-CD2 4.24Å; A151-L168 HydrophobicContact CB-CD2 4.17Å; I152-L168 HydrophobicContact CG1-CD1 4.18Å; Y155-L168 HydrophobicContact CD2-CD2 4.23Å; Y155-L168 HydrophobicContact CD2-CG 4.1Å; L168-M170 HydrophobicContact CB-CE 3.83Å; L168-M170 HydrophobicContact CD1-CE 3.94Å; L168-I195 HydrophobicContact CD1-CD1 4.4Å; L168-I195 HydrophobicContact CD1-CG1 4.07Å; L168-I195 HydrophobicContact CD1-CG2 4.04Å; L168-D199 PolarHBondContact N-O 3.4Å; L168-I200 WeakPolarHBondContact O-CA 3.38Å; L168-I201 PolarHBondContact O-N 2.93Å
169L98.8Very high94Very high0 Ų060.7 Ų60.70%033%0.326CS..EExtended strand (participates in β ladder)trans-95.6100.1177.7-166.4163.1000109.3V127 I128 V129 Q167 S171 I201 E203 S216 I219 M220V127-L169 PolarHBondContact O-N 3.05Å; I128-L169 CarbonylContact C-O 3.53Å; I128-L169 WeakPolarHBondContact CA-O 3.46Å; I128-L169 HydrophobicContact CG1-CB 4.49Å; I128-L169 HydrophobicContact CG2-CD2 4.43Å; V129-L169 PolarHBondContact N-O 2.78Å; Q167-L169 PolarHBondContact O-N 3.4Å; L169-S171 PolarHBondContact O-N 3.43Å; L169-I201 CarbonylContact C-O 3.6Å; L169-I201 WeakPolarHBondContact CA-O 3.3Å; L169-I201 HydrophobicContact CG-CB 4.39Å; L169-I201 HydrophobicContact CG-CG2 4.41Å; L169-E203 HydrophobicContact CD2-CB 3.99Å; L169-S216 VanDerWaalsContact CD2-OG 3.25Å; L169-S216 WeakPolarHBondContact CD2-OG 3.35Å; L169-I219 HydrophobicContact CD1-CB 4.19Å; L169-I219 HydrophobicContact CD1-CG2 3.86Å; L169-M220 HydrophobicContact CD1-CG 3.86Å
170M98.6Very high93.9Very high0 Ų060.7 Ų60.70%032%0.324CS..EExtended strand (participates in β ladder)trans-78.4105.7177.6-57.2-58175.600109.5V129 I148 L168 S183 M186 A190 I200 I201 E203V129-M170 HydrophobicContact CB-SD 3.67Å; V129-M170 HydrophobicContact CG1-SD 4.2Å; V129-M170 HydrophobicContact CG2-CE 4.26Å; V129-M170 HydrophobicContact CG2-SD 3.58Å; V129-M170 VanDerWaalsContact CG2-SD 3.58Å; I148-M170 HydrophobicContact CG2-CE 4.19Å; L168-M170 HydrophobicContact CB-CE 3.83Å; L168-M170 HydrophobicContact CD1-CE 3.94Å; M170-S183 WeakPolarHBondContact O-CB 3.43Å; M170-M186 HydrophobicContact CB-CB 3.95Å; M170-M186 HydrophobicContact CB-CE 3.92Å; M170-M186 HydrophobicContact CB-SD 4.49Å; M170-M186 HydrophobicContact CG-CB 3.96Å; M170-M186 HydrophobicContact CG-CE 4.43Å; M170-M186 HydrophobicContact SD-CB 3.89Å; M170-M186 HydrophobicContact SD-CE 3.83Å; M170-A190 HydrophobicContact CE-CB 3.6Å; M170-I200 HydrophobicContact CE-CG2 4.45Å; M170-I200 HydrophobicContact CG-CG2 3.91Å; M170-I201 PolarHBondContact N-O 3.23Å; M170-E203 PolarHBondContact O-N 2.82Å
171S98.4Very high93.9Very high0 Ų054.3 Ų54.30%030%0.297CS..EExtended strand (participates in β ladder)trans-109.7114.6-176.2176.70000112.2V129 G131 L169 E203 N212 S216V129-S171 PolarHBondContact O-N 3.4Å; G131-S171 PolarHBondContact N-O 3.12Å; L169-S171 PolarHBondContact O-N 3.43Å; S171-E203 PolarHBondContact OG-OE2 3.28Å; S171-N212 WeakPolarHBondContact OG-CA 3.39Å; S171-N212 WeakPolarHBondContact OG-CB 2.83Å; S171-N212 PolarHBondContact OG-ND2 2.97Å; S171-N212 PolarHBondContact OG-O 2.94Å; S171-S216 WeakPolarHBondContact CB-OG 3.46Å; S171-S216 PolarHBondContact OG-OG 3.09Å
172G97.2Very high93.9Very high2 Ų250 Ų502%0.02128%0.278CS..  trans173.1118.5177.200000111E182 S183 E203 S206G172-E182 PolarHBondContact O-N 2.82Å; G172-S183 VanDerWaalsContact O-CB 3.22Å; G172-S183 WeakPolarHBondContact O-CB 3.49Å; G172-S183 PolarHBondContact O-N 2.94Å; G172-S183 PolarHBondContact O-OG 3.43Å; G172-E203 CarbonylContact C-O 3.53Å; G172-E203 PolarHBondContact N-O 3.23Å; G172-S206 WeakPolarHBondContact CA-OG 3.41Å
173G95.1Very high94Very high3 Ų347.2 Ų47.23%0.03126%0.261CS..  trans-78.8-158.7174.900000113.5P181 E182 A204 S206G173-P181 WeakPolarHBondContact O-CA 3.47Å; G173-E182 PolarHBondContact O-N 2.9Å; G173-A204 WeakPolarHBondContact CA-O 3.47Å; G173-S206 WeakPolarHBondContact CA-O 3.34Å; G173-S206 PolarHBondContact N-O 3.06Å; G173-S206 PolarHBondContact N-OG 2.9Å
174Q91.7Very high94.1Very high105 Ų10543.1 Ų43.149%0.49124%0.238SC..  trans-101.4110.9-177.8-1741730.300110.4E178 P181Q174-E178 HydrophobicContact CG-CB 4.16Å; Q174-E178 PolarHBondContact NE2-O 3.3Å; Q174-P181 HydrophobicContact CB-CB 4.44Å; Q174-P181 HydrophobicContact CB-CG 4.28Å
175G84.3Confident94.3Very high23 Ų2340.1 Ų40.124%0.23722%0.217CC..  trans-67.1161.1170.800000112.7D177 E178G175-D177 PolarHBondContact O-N 3.23Å; G175-E178 PolarHBondContact N-OE2 2.77Å; G175-E178 WeakPolarHBondContact O-CB 3.36Å; G175-E178 PolarHBondContact O-N 2.89Å
176P83Confident94.4Very high134 Ų13437.6 Ų37.687%0.8720%0.201SC*.THydrogen-bonded Turntrans-62.6-27.8-178.223.7-33.1000113.6E178P176-E178 VanDerWaalsContact C-N 3.34Å
177D82.7Confident94.4Very high144 Ų14440.7 Ų40.777%0.7721%0.212SC*.THydrogen-bonded Turntrans-92.97.2177.7-63.6-35.5000112.5G175G175-D177 PolarHBondContact O-N 3.23Å
178E86.9Confident94.4Very high22 Ų2242 Ų4210%0.10322%0.218CC..  trans-107.7141.2-172.1-56.2-173146.100112.3G133 L134 Q174 G175 P176 E182G133-E178 WeakPolarHBondContact CA-OE1 3.43Å; L134-E178 PolarHBondContact N-OE1 3.5Å; Q174-E178 HydrophobicContact CG-CB 4.16Å; Q174-E178 PolarHBondContact NE2-O 3.3Å; G175-E178 PolarHBondContact N-OE2 2.77Å; G175-E178 WeakPolarHBondContact O-CB 3.36Å; G175-E178 PolarHBondContact O-N 2.89Å; P176-E178 VanDerWaalsContact C-N 3.34Å; E178-E182 WeakPolarHBondContact OE1-CG 3.18Å; E178-E182 VanDerWaalsContact OE2-CG 3.25Å; E178-E182 WeakPolarHBondContact OE2-CG 3.37Å
179K90.5Very high94.3Very high145 Ų14544.1 Ų44.163%0.6323%0.227SC*.SBendtrans-93.7-19.1-177.9-59.7-179-179.31770112.4G137 K138G137-K179 WeakPolarHBondContact O-CB 3.49Å; G137-K179 PolarHBondContact O-N 2.96Å; K138-K179 HydrophobicContact CD-CB 4.45Å; K138-K179 HydrophobicContact CD-CD 4.12Å; K138-K179 HydrophobicContact CG-CB 3.87Å; K138-K179 HydrophobicContact CG-CD 4.05Å; K138-K179 HydrophobicContact CG-CG 4.4Å
180I94.6Very high94.3Very high27 Ų2744.1 Ų44.114%0.13823%0.227CC..SBendtrans-140155.9175.659.8176.3000108.1L134 G137 A185L134-I180 HydrophobicContact CD1-CG1 3.97Å; G137-I180 PolarHBondContact O-N 3.22Å; I180-A185 HydrophobicContact CD1-CB 3.97Å
181P96.2Very high94.3Very high25 Ų2547 Ų4716%0.16224%0.242CC..  trans-57.8143.5170.7-22.233000111.9G173 Q174 S183 Q184 A185 A204G173-P181 WeakPolarHBondContact O-CA 3.47Å; Q174-P181 HydrophobicContact CB-CB 4.44Å; Q174-P181 HydrophobicContact CB-CG 4.28Å; P181-S183 PolarHBondContact O-N 3.24Å; P181-Q184 WeakPolarHBondContact O-CB 3.32Å; P181-Q184 PolarHBondContact O-N 3.29Å; P181-Q184 VanDerWaalsContact O-N 3.09Å; P181-A185 PolarHBondContact O-N 2.88Å; P181-A204 HydrophobicContact CB-CB 3.86Å; P181-A204 HydrophobicContact CG-CB 4.11Å
182E97.1Very high94.3Very high29 Ų2954.1 Ų54.114%0.13628%0.275CS..Hα-helixtrans-55.1-43.3176.6-61.4-165.2-160.800111.6G131 A132 G133 L134 G172 G173 E178 Q184 A185 M186G131-E182 WeakPolarHBondContact CA-OE2 3.42Å; A132-E182 PolarHBondContact N-OE2 2.9Å; G133-E182 VanDerWaalsContact CA-OE1 3.24Å; G133-E182 WeakPolarHBondContact CA-OE1 3.34Å; G133-E182 PolarHBondContact N-OE1 3.15Å; G133-E182 PolarHBondContact N-OE2 3.35Å; L134-E182 HydrophobicContact CG-CG 4.16Å; G172-E182 PolarHBondContact O-N 2.82Å; G173-E182 PolarHBondContact O-N 2.9Å; E178-E182 WeakPolarHBondContact OE1-CG 3.18Å; E178-E182 VanDerWaalsContact OE2-CG 3.25Å; E178-E182 WeakPolarHBondContact OE2-CG 3.37Å; E182-Q184 PolarHBondContact O-N 3.48Å; E182-A185 PolarHBondContact O-N 3.34Å; E182-A185 VanDerWaalsContact O-N 3.1Å; E182-M186 HydrophobicContact CB-SD 4.18Å; E182-M186 WeakPolarHBondContact O-CG 3.32Å; E182-M186 PolarHBondContact O-N 3.2Å
183S97.8Very high94.3Very high0 Ų057.4 Ų57.40%029%0.29CS..Hα-helixtrans-55.6-35.217849.40000113.5M170 G172 P181 M186 R187 E203 A204M170-S183 WeakPolarHBondContact O-CB 3.43Å; G172-S183 VanDerWaalsContact O-CB 3.22Å; G172-S183 WeakPolarHBondContact O-CB 3.49Å; G172-S183 PolarHBondContact O-N 2.94Å; G172-S183 PolarHBondContact O-OG 3.43Å; P181-S183 PolarHBondContact O-N 3.24Å; S183-M186 PolarHBondContact O-N 3.3Å; S183-R187 PolarHBondContact O-N 2.89Å; S183-E203 VanDerWaalsContact CB-O 3.25Å; S183-E203 WeakPolarHBondContact CB-O 3.36Å; S183-E203 PolarHBondContact OG-O 3.15Å; S183-A204 WeakPolarHBondContact OG-CA 3.39Å; S183-A204 WeakPolarHBondContact OG-CB 3.49Å
184Q97.9Very high94.5Very high71 Ų7160.2 Ų60.233%0.33232%0.319SS..Hα-helixtrans-66.7-49.9175.4-176.4-177-24.700111P181 E182 M186 R187 E188 M202P181-Q184 WeakPolarHBondContact O-CB 3.32Å; P181-Q184 PolarHBondContact O-N 3.29Å; P181-Q184 VanDerWaalsContact O-N 3.09Å; E182-Q184 PolarHBondContact O-N 3.48Å; Q184-M186 PolarHBondContact O-N 3.48Å; Q184-R187 PolarHBondContact O-N 3.01Å; Q184-E188 PolarHBondContact NE2-OE1 2.97Å; Q184-E188 WeakPolarHBondContact O-CG 3.31Å; Q184-E188 PolarHBondContact O-N 3.46Å; Q184-M202 HydrophobicContact CB-SD 4.38Å
185A97.6Very high94.8Very high4 Ų455.5 Ų55.53%0.03330%0.297CS..Hα-helixtrans-61.7-34.4177.300000111.9L134 V140 I180 P181 E182 Y189L134-A185 HydrophobicContact CD1-CB 3.97Å; L134-A185 HydrophobicContact CD2-CB 3.59Å; L134-A185 HydrophobicContact CG-CB 4.45Å; V140-A185 HydrophobicContact CG1-CB 4.09Å; I180-A185 HydrophobicContact CD1-CB 3.97Å; P181-A185 PolarHBondContact O-N 2.88Å; E182-A185 PolarHBondContact O-N 3.34Å; E182-A185 VanDerWaalsContact O-N 3.1Å; A185-Y189 WeakPolarHBondContact O-CB 3.37Å; A185-Y189 PolarHBondContact O-N 2.93Å
186M98.4Very high95.4Very high0 Ų056.9 Ų56.90%030%0.301CS..Hα-helixtrans-68-41.9176.2-66.5160.966.800112.2V129 L144 I148 M170 E182 S183 Q184 Y189 A190V129-M186 HydrophobicContact CB-CE 3.64Å; V129-M186 HydrophobicContact CG1-CE 3.52Å; V129-M186 VanDerWaalsContact O-CE 3.28Å; V129-M186 WeakPolarHBondContact O-CE 3.48Å; L144-M186 HydrophobicContact CD1-CE 4.23Å; L144-M186 HydrophobicContact CD1-CG 4.01Å; L144-M186 HydrophobicContact CD1-SD 4Å; L144-M186 HydrophobicContact CD2-CG 3.88Å; L144-M186 HydrophobicContact CD2-SD 4.39Å; L144-M186 HydrophobicContact CG-CG 4.11Å; I148-M186 HydrophobicContact CD1-CB 4Å; I148-M186 HydrophobicContact CD1-CG 3.91Å; I148-M186 HydrophobicContact CG1-CB 4.44Å; I148-M186 HydrophobicContact CG1-CG 4.35Å; M170-M186 HydrophobicContact CB-CB 3.95Å; M170-M186 HydrophobicContact CB-CE 3.92Å; M170-M186 HydrophobicContact CB-SD 4.49Å; M170-M186 HydrophobicContact CG-CB 3.96Å; M170-M186 HydrophobicContact CG-CE 4.43Å; M170-M186 HydrophobicContact SD-CB 3.89Å; M170-M186 HydrophobicContact SD-CE 3.83Å; E182-M186 HydrophobicContact CB-SD 4.18Å; E182-M186 WeakPolarHBondContact O-CG 3.32Å; E182-M186 PolarHBondContact O-N 3.2Å; S183-M186 PolarHBondContact O-N 3.3Å; Q184-M186 PolarHBondContact O-N 3.48Å; M186-Y189 PolarHBondContact O-N 2.82Å; M186-A190 PolarHBondContact O-N 2.77Å
187R98.2Very high96.1Very high65 Ų6554.2 Ų54.225%0.24528%0.28CS..Hα-helixtrans-61.1-50173.6172.4173.3173.3-89.28.3110.9S183 Q184 Y189 A190 L191 D197 I200 M202S183-R187 PolarHBondContact O-N 2.89Å; Q184-R187 PolarHBondContact O-N 3.01Å; R187-Y189 VanDerWaalsContact C-N 3.29Å; R187-Y189 PolarHBondContact O-N 3.35Å; R187-A190 PolarHBondContact O-N 3.5Å; R187-A190 VanDerWaalsContact O-N 3.09Å; R187-L191 HydrophobicContact CG-CD1 4.03Å; R187-L191 HydrophobicContact CG-CG 4.33Å; R187-L191 WeakPolarHBondContact O-CG 3.31Å; R187-L191 PolarHBondContact O-N 3.35Å; R187-D197 IonicContact CZ-OD1 3Å; R187-D197 IonicContact CZ-OD2 2.88Å; R187-D197 IonicContact NE-OD1 2.79Å; R187-D197 PolarHBondContact NE-OD1 2.91Å; R187-D197 IonicContact NH2-OD1 2.62Å; R187-D197 PolarHBondContact NH2-OD1 3.05Å; R187-D197 IonicContact NH2-OD2 3.84Å; R187-D197 PolarHBondContact NH2-OD2 3.26Å; R187-I200 HydrophobicContact CB-CG2 4.02Å; R187-I200 HydrophobicContact CG-CD1 4.31Å; R187-I200 HydrophobicContact CG-CG2 3.88Å; R187-M202 HydrophobicContact CB-CG 4.07Å; R187-M202 HydrophobicContact CB-SD 3.79Å; R187-M202 VanDerWaalsContact CD-SD 3.53Å; R187-M202 HydrophobicContact CG-SD 4.28Å
188E97.9Very high96.9Very high82 Ų8254.9 Ų54.938%0.38328%0.279SS..Hα-helixtrans-55.3-46178.1-71.4171.1-167.800111.1Q184 A190 L191 E192Q184-E188 PolarHBondContact NE2-OE1 2.97Å; Q184-E188 WeakPolarHBondContact O-CG 3.31Å; Q184-E188 PolarHBondContact O-N 3.46Å; E188-A190 PolarHBondContact O-N 3.45Å; E188-L191 PolarHBondContact O-N 3.07Å; E188-E192 WeakPolarHBondContact O-CG 3.37Å; E188-E192 PolarHBondContact O-N 3.22Å
189Y98.3Very high97.4Very high46 Ų4654.9 Ų54.918%0.1828%0.279CS..Hα-helixtrans-62.2-42.2176-171.9-93.6000113.1V140 A145 I148 D149 A185 M186 R187 E192 Q193V140-Y189 HydrophobicContact CG1-CG 4.49Å; V140-Y189 HydrophobicContact CG2-CD2 3.45Å; V140-Y189 VanDerWaalsContact CG2-CD2 3.45Å; V140-Y189 HydrophobicContact CG2-CE2 3.87Å; V140-Y189 HydrophobicContact CG2-CG 3.97Å; A145-Y189 HydrophobicContact CB-CE1 4.28Å; A145-Y189 HydrophobicContact CB-CE2 4.34Å; I148-Y189 HydrophobicContact CB-CD1 4.03Å; I148-Y189 HydrophobicContact CB-CE1 4.32Å; I148-Y189 HydrophobicContact CD1-CD1 3.72Å; I148-Y189 HydrophobicContact CD1-CE1 4.49Å; I148-Y189 HydrophobicContact CD1-CG 4.09Å; I148-Y189 HydrophobicContact CG2-CD1 3.78Å; I148-Y189 HydrophobicContact CG2-CE1 4.33Å; D149-Y189 PolarHBondContact OD1-OH 3.08Å; A185-Y189 WeakPolarHBondContact O-CB 3.37Å; A185-Y189 PolarHBondContact O-N 2.93Å; M186-Y189 PolarHBondContact O-N 2.82Å; R187-Y189 VanDerWaalsContact C-N 3.29Å; R187-Y189 PolarHBondContact O-N 3.35Å; Y189-E192 WeakPolarHBondContact O-CB 3.38Å; Y189-E192 PolarHBondContact O-N 2.98Å; Y189-Q193 HydrophobicContact CD1-CG 4.17Å; Y189-Q193 HydrophobicContact CE1-CG 3.87Å; Y189-Q193 WeakPolarHBondContact O-CG 3.44Å; Y189-Q193 PolarHBondContact O-N 3.32Å; Y189-Q193 VanDerWaalsContact O-N 3.12Å
190A98.6Very high97.8Very high0 Ų048.8 Ų48.80%025%0.253CS..Hα-helixtrans-67.1-37.2179.200000112.8I148 I152 M170 M186 R187 E188 Q193 G194 I195 I200I148-A190 HydrophobicContact CG2-CB 4.2Å; I152-A190 HydrophobicContact CD1-CB 4.39Å; M170-A190 HydrophobicContact CE-CB 3.6Å; M186-A190 PolarHBondContact O-N 2.77Å; R187-A190 PolarHBondContact O-N 3.5Å; R187-A190 VanDerWaalsContact O-N 3.09Å; E188-A190 PolarHBondContact O-N 3.45Å; A190-Q193 CarbonylContact O-C 3.53Å; A190-Q193 PolarHBondContact O-N 3.01Å; A190-Q193 VanDerWaalsContact O-N 3.16Å; A190-G194 PolarHBondContact O-N 3.39Å; A190-I195 HydrophobicContact CB-CB 4.38Å; A190-I195 HydrophobicContact CB-CG1 4.32Å; A190-I195 WeakPolarHBondContact O-CB 3.48Å; A190-I195 PolarHBondContact O-N 2.9Å; A190-I195 VanDerWaalsContact O-N 3.09Å; A190-I200 HydrophobicContact CB-CD1 3.84Å
191L98.4Very high98Very high59 Ų5948.7 Ų48.731%0.30925%0.253SS..Hα-helixtrans-61.7-43.6172.3-67.8173.3000111.3R187 E188 Q193 G194 I195 D197 I200R187-L191 HydrophobicContact CG-CD1 4.03Å; R187-L191 HydrophobicContact CG-CG 4.33Å; R187-L191 WeakPolarHBondContact O-CG 3.31Å; R187-L191 PolarHBondContact O-N 3.35Å; E188-L191 PolarHBondContact O-N 3.07Å; L191-Q193 PolarHBondContact O-N 3.41Å; L191-G194 WeakPolarHBondContact O-CA 3.4Å; L191-G194 PolarHBondContact O-N 3.28Å; L191-I195 WeakPolarHBondContact CD2-O 3.29Å; L191-D197 HydrophobicContact CD2-CB 3.81Å; L191-I200 HydrophobicContact CD2-CD1 3.8Å; L191-I200 HydrophobicContact CG-CD1 3.99Å
192E97.9Very high98.1Very high150 Ų15051.5 Ų51.570%0.70127%0.265SS*.Hα-helixtrans-61-29.3174.4-72.2176.9-179.300112.8E188 Y189 G194E188-E192 WeakPolarHBondContact O-CG 3.37Å; E188-E192 PolarHBondContact O-N 3.22Å; Y189-E192 WeakPolarHBondContact O-CB 3.38Å; Y189-E192 PolarHBondContact O-N 2.98Å; E192-G194 PolarHBondContact O-N 3.19Å
193Q98.1Very high98.1Very high72 Ų7250.3 Ų50.334%0.33626%0.259SS..THydrogen-bonded Turntrans-82.94.4173.6-63.4-53.1-57.700113.5I152 R156 Y189 A190 L191I152-Q193 HydrophobicContact CD1-CB 3.58Å; I152-Q193 HydrophobicContact CD1-CG 3.81Å; R156-Q193 PolarHBondContact NH2-O 2.83Å; Y189-Q193 HydrophobicContact CD1-CG 4.17Å; Y189-Q193 HydrophobicContact CE1-CG 3.87Å; Y189-Q193 WeakPolarHBondContact O-CG 3.44Å; Y189-Q193 PolarHBondContact O-N 3.32Å; Y189-Q193 VanDerWaalsContact O-N 3.12Å; A190-Q193 CarbonylContact O-C 3.53Å; A190-Q193 PolarHBondContact O-N 3.01Å; A190-Q193 VanDerWaalsContact O-N 3.16Å; L191-Q193 PolarHBondContact O-N 3.41Å
194G97.9Very high98.1Very high62 Ų6251.9 Ų51.964%0.63927%0.272SS*.THydrogen-bonded Turntrans82.221.6174.900000115A190 L191 E192A190-G194 PolarHBondContact O-N 3.39Å; L191-G194 WeakPolarHBondContact O-CA 3.4Å; L191-G194 PolarHBondContact O-N 3.28Å; E192-G194 PolarHBondContact O-N 3.19Å
195I98.3Very high98Very high6 Ų655.6 Ų55.63%0.03129%0.289CS..  trans-75.1133.7168.2-59.6-57.5000109.2I152 Y155 L168 A190 L191 D199 I200I152-I195 HydrophobicContact CB-CD1 4.47Å; I152-I195 HydrophobicContact CD1-CG1 4.11Å; I152-I195 HydrophobicContact CG1-CD1 4.06Å; I152-I195 HydrophobicContact CG1-CG1 3.82Å; I152-I195 HydrophobicContact CG2-CD1 4.07Å; Y155-I195 HydrophobicContact CD1-CD1 3.63Å; Y155-I195 HydrophobicContact CE1-CD1 3.79Å; Y155-I195 HydrophobicContact CG-CD1 4.17Å; L168-I195 HydrophobicContact CD1-CD1 4.4Å; L168-I195 HydrophobicContact CD1-CG1 4.07Å; L168-I195 HydrophobicContact CD1-CG2 4.04Å; A190-I195 HydrophobicContact CB-CB 4.38Å; A190-I195 HydrophobicContact CB-CG1 4.32Å; A190-I195 WeakPolarHBondContact O-CB 3.48Å; A190-I195 PolarHBondContact O-N 2.9Å; A190-I195 VanDerWaalsContact O-N 3.09Å; L191-I195 WeakPolarHBondContact CD2-O 3.29Å; I195-D199 HydrophobicContact CG2-CB 4.3Å; I195-I200 HydrophobicContact CB-CD1 4.17Å; I195-I200 HydrophobicContact CG2-CD1 3.85Å; I195-I200 HydrophobicContact CG2-CG1 3.69Å
196P98Very high98Very high51 Ų5155.6 Ų55.633%0.33129%0.289SS..  trans-60.3141173.3-22.534.1000111.8E198 D199P196-E198 VanDerWaalsContact C-N 3.27Å; P196-E198 HydrophobicContact CB-CG 3.91Å; P196-E198 PolarHBondContact O-N 3.47Å; P196-D199 PolarHBondContact O-N 3.45Å; P196-D199 VanDerWaalsContact O-N 3.13Å
197D98.1Very high97.8Very high78 Ų7860.7 Ų60.742%0.41732%0.321SS..G310 helixtrans-63-34.3-178.6-168.338.7000113.3R187 L191 D199 I200R187-D197 IonicContact CZ-OD1 3Å; R187-D197 IonicContact CZ-OD2 2.88Å; R187-D197 IonicContact NE-OD1 2.79Å; R187-D197 PolarHBondContact NE-OD1 2.91Å; R187-D197 IonicContact NH2-OD1 2.62Å; R187-D197 PolarHBondContact NH2-OD1 3.05Å; R187-D197 IonicContact NH2-OD2 3.84Å; R187-D197 PolarHBondContact NH2-OD2 3.26Å; L191-D197 HydrophobicContact CD2-CB 3.81Å; D197-D199 PolarHBondContact O-N 2.92Å; D197-I200 PolarHBondContact O-N 2.9Å
198E97.6Very high97.6Very high159 Ų15960.9 Ų60.974%0.74333%0.326SS*.G310 helixtrans-62.6-21.3176.959.1-169.9-159.200114Q167 P196Q167-E198 PolarHBondContact NE2-O 2.99Å; P196-E198 VanDerWaalsContact C-N 3.27Å; P196-E198 HydrophobicContact CB-CG 3.91Å; P196-E198 PolarHBondContact O-N 3.47Å
199D98.1Very high97.5Very high22 Ų2258.3 Ų58.312%0.11832%0.316CS..G310 helixtrans-92.23.2177.4-70.3-30.3000112.9Y155 Q167 L168 I195 P196 D197Y155-D199 HydrophobicContact CE2-CB 3.84Å; Y155-D199 WeakPolarHBondContact CE2-OD2 3.39Å; Y155-D199 PolarHBondContact OH-OD2 2.81Å; Q167-D199 CarbonylContact C-O 3.51Å; Q167-D199 WeakPolarHBondContact CA-O 3.36Å; L168-D199 PolarHBondContact N-O 3.4Å; I195-D199 HydrophobicContact CG2-CB 4.3Å; P196-D199 PolarHBondContact O-N 3.45Å; P196-D199 VanDerWaalsContact O-N 3.13Å; D197-D199 PolarHBondContact O-N 2.92Å
200I98.6Very high97.4Very high16 Ų1659.3 Ų59.38%0.08233%0.325CS..EExtended strand (participates in β ladder)trans-113.9123.6-177.7-55170.1000110.5L168 M170 R187 A190 L191 I195 D197L168-I200 WeakPolarHBondContact O-CA 3.38Å; M170-I200 HydrophobicContact CE-CG2 4.45Å; M170-I200 HydrophobicContact CG-CG2 3.91Å; R187-I200 HydrophobicContact CB-CG2 4.02Å; R187-I200 HydrophobicContact CG-CD1 4.31Å; R187-I200 HydrophobicContact CG-CG2 3.88Å; A190-I200 HydrophobicContact CB-CD1 3.84Å; L191-I200 HydrophobicContact CD2-CD1 3.8Å; L191-I200 HydrophobicContact CG-CD1 3.99Å; I195-I200 HydrophobicContact CB-CD1 4.17Å; I195-I200 HydrophobicContact CG2-CD1 3.85Å; I195-I200 HydrophobicContact CG2-CG1 3.69Å; D197-I200 PolarHBondContact O-N 2.9Å
201I98.4Very high97.4Very high26 Ų2662 Ų6213%0.13334%0.337CS..EExtended strand (participates in β ladder)trans-111140.8170.3-59167000109F126 Q167 L168 L169 M170 I219 E223F126-I201 HydrophobicContact CD1-CD1 4.4Å; F126-I201 HydrophobicContact CE1-CD1 3.95Å; Q167-I201 HydrophobicContact CB-CD1 4.14Å; Q167-I201 HydrophobicContact CG-CD1 4.46Å; L168-I201 PolarHBondContact O-N 2.93Å; L169-I201 CarbonylContact C-O 3.6Å; L169-I201 WeakPolarHBondContact CA-O 3.3Å; L169-I201 HydrophobicContact CG-CB 4.39Å; L169-I201 HydrophobicContact CG-CG2 4.41Å; M170-I201 PolarHBondContact N-O 3.23Å; I201-I219 HydrophobicContact CG2-CG2 3.8Å; I201-E223 HydrophobicContact CD1-CG 4.18Å
202M98.3Very high97.3Very high83 Ų8359.6 Ų59.641%0.40933%0.325SS..EExtended strand (participates in β ladder)trans-108.2137.1175.3-64.9-171.4-57.300111.8Q184 R187Q184-M202 HydrophobicContact CB-SD 4.38Å; R187-M202 HydrophobicContact CB-CG 4.07Å; R187-M202 HydrophobicContact CB-SD 3.79Å; R187-M202 VanDerWaalsContact CD-SD 3.53Å; R187-M202 HydrophobicContact CG-SD 4.28Å
203E98.2Very high97.4Very high5 Ų552.5 Ų52.52%0.02329%0.291CS..EExtended strand (participates in β ladder)trans-118.1109.8165-173.2-73.6110.600108.4L169 M170 S171 G172 S183 Q205 S206 F215 I219L169-E203 HydrophobicContact CD2-CB 3.99Å; M170-E203 PolarHBondContact O-N 2.82Å; S171-E203 PolarHBondContact OG-OE2 3.28Å; G172-E203 CarbonylContact C-O 3.53Å; G172-E203 PolarHBondContact N-O 3.23Å; S183-E203 VanDerWaalsContact CB-O 3.25Å; S183-E203 WeakPolarHBondContact CB-O 3.36Å; S183-E203 PolarHBondContact OG-O 3.15Å; E203-Q205 WeakPolarHBondContact OE1-CA 3.32Å; E203-Q205 PolarHBondContact OE1-N 3.29Å; E203-S206 VanDerWaalsContact CD-OG 3.32Å; E203-S206 PolarHBondContact OE1-N 3.48Å; E203-S206 PolarHBondContact OE1-OG 2.86Å; E203-S206 WeakPolarHBondContact OE2-CB 3.44Å; E203-S206 PolarHBondContact OE2-OG 2.9Å; E203-F215 HydrophobicContact CG-CB 3.51Å; E203-F215 WeakPolarHBondContact OE1-CD2 3.49Å; E203-I219 HydrophobicContact CB-CD1 3.57Å; E203-I219 HydrophobicContact CG-CD1 3.63Å
204A97.3Very high97.4Very high32 Ų3254 Ų5426%0.26430%0.297SS..  trans-115.113.4-167.100000114.7G173 P181 S183G173-A204 WeakPolarHBondContact CA-O 3.47Å; P181-A204 HydrophobicContact CB-CB 3.86Å; P181-A204 HydrophobicContact CG-CB 4.11Å; S183-A204 WeakPolarHBondContact OG-CA 3.39Å; S183-A204 WeakPolarHBondContact OG-CB 3.49Å
205Q96.4Very high97.4Very high149 Ų14953.1 Ų53.170%0.69628%0.276SS*.  trans-106.3-23-173.7-62-59.9-65.500113.5E203 F215E203-Q205 WeakPolarHBondContact OE1-CA 3.32Å; E203-Q205 PolarHBondContact OE1-N 3.29Å; Q205-F215 HydrophobicContact CB-CD2 3.92Å; Q205-F215 HydrophobicContact CB-CE2 3.9Å
206S96.1Very high97.4Very high4 Ų452.9 Ų52.93%0.02827%0.274CS..  trans-67.3139.3-175.248.70000114.6G172 G173 E203 N212G172-S206 WeakPolarHBondContact CA-OG 3.41Å; G173-S206 WeakPolarHBondContact CA-O 3.34Å; G173-S206 PolarHBondContact N-O 3.06Å; G173-S206 PolarHBondContact N-OG 2.9Å; E203-S206 VanDerWaalsContact CD-OG 3.32Å; E203-S206 PolarHBondContact OE1-N 3.48Å; E203-S206 PolarHBondContact OE1-OG 2.86Å; E203-S206 WeakPolarHBondContact OE2-CB 3.44Å; E203-S206 PolarHBondContact OE2-OG 2.9Å; S206-N212 WeakPolarHBondContact CB-ND2 3.41Å; S206-N212 PolarHBondContact OG-ND2 3.17Å
207T94.4Very high97.4Very high108 Ų10852.7 Ų52.766%0.66327%0.268SS*.SBendtrans-108.8-11.5176.466.50000113.6E211T207-E211 WeakPolarHBondContact CB-OE2 3.26Å; T207-E211 PolarHBondContact N-OE2 3.45Å; T207-E211 VanDerWaalsContact OG1-CD 3.3Å; T207-E211 PolarHBondContact OG1-OE1 3.4Å; T207-E211 PolarHBondContact OG1-OE2 3.07Å
208N94.6Very high97.4Very high68 Ų6853.4 Ų53.436%0.36427%0.269SS..SBendtrans-154.8170.8-177.961.769.9000110.9L210 E211 N212N208-L210 VanDerWaalsContact C-N 3.32Å; N208-L210 PolarHBondContact O-N 3.22Å; N208-L210 WeakPolarHBondContact OD1-CB 3.39Å; N208-L210 PolarHBondContact OD1-N 2.8Å; N208-L210 VanDerWaalsContact OD1-N 3.09Å; N208-E211 PolarHBondContact ND2-OE1 3.29Å; N208-E211 PolarHBondContact O-N 3.47Å; N208-E211 PolarHBondContact OD1-N 3.31Å; N208-N212 PolarHBondContact O-N 2.93Å
209T95.4Very high97.4Very high28 Ų2846.6 Ų46.617%0.17224%0.238CC..Hα-helixtrans-65.2-30.6-175.4-47.10000114L130 N212 M213 A242 Y245L130-T209 HydrophobicContact CD1-CG2 4.06Å; T209-N212 WeakPolarHBondContact CA-OD1 3.4Å; T209-N212 WeakPolarHBondContact O-CB 3.41Å; T209-N212 PolarHBondContact O-N 2.9Å; T209-M213 WeakPolarHBondContact O-CG 3.4Å; T209-M213 PolarHBondContact O-N 3.06Å; T209-M213 VanDerWaalsContact O-N 3.15Å; T209-A242 HydrophobicContact CG2-CB 4.36Å; T209-Y245 HydrophobicContact CG2-CD2 3.64Å; T209-Y245 HydrophobicContact CG2-CE2 4.28Å
210L97Very high97.4Very high68 Ų6845.6 Ų45.636%0.35623%0.232SC..Hα-helixtrans-67-44.3175.4179.770.4000110.3N208 M213 K214 Y245 D248 V249N208-L210 VanDerWaalsContact C-N 3.32Å; N208-L210 PolarHBondContact O-N 3.22Å; N208-L210 WeakPolarHBondContact OD1-CB 3.39Å; N208-L210 PolarHBondContact OD1-N 2.8Å; N208-L210 VanDerWaalsContact OD1-N 3.09Å; L210-M213 PolarHBondContact O-N 3.21Å; L210-K214 WeakPolarHBondContact O-CB 3.27Å; L210-K214 PolarHBondContact O-N 3.4Å; L210-Y245 HydrophobicContact CB-CD1 4.04Å; L210-Y245 HydrophobicContact CB-CE1 4.44Å; L210-Y245 HydrophobicContact CB-CG 4.38Å; L210-Y245 HydrophobicContact CD1-CD1 3.95Å; L210-Y245 HydrophobicContact CD1-CG 4.49Å; L210-D248 HydrophobicContact CD1-CB 4.04Å; L210-V249 HydrophobicContact CD1-CG1 3.64Å; L210-V249 HydrophobicContact CG-CG1 4.43Å
211E97.7Very high97.4Very high55 Ų5549 Ų4926%0.25725%0.248SC..Hα-helixtrans-65.7-37.8174-75.5170.2-158.900112.5T207 N208 M213 K214 F215T207-E211 WeakPolarHBondContact CB-OE2 3.26Å; T207-E211 PolarHBondContact N-OE2 3.45Å; T207-E211 VanDerWaalsContact OG1-CD 3.3Å; T207-E211 PolarHBondContact OG1-OE1 3.4Å; T207-E211 PolarHBondContact OG1-OE2 3.07Å; N208-E211 PolarHBondContact ND2-OE1 3.29Å; N208-E211 PolarHBondContact O-N 3.47Å; N208-E211 PolarHBondContact OD1-N 3.31Å; E211-M213 VanDerWaalsContact C-N 3.3Å; E211-M213 PolarHBondContact O-N 3.43Å; E211-K214 PolarHBondContact O-N 2.87Å; E211-F215 HydrophobicContact CB-CD2 4.2Å; E211-F215 HydrophobicContact CB-CE2 3.88Å; E211-F215 HydrophobicContact CB-CZ 4.33Å; E211-F215 HydrophobicContact CG-CE2 4.17Å; E211-F215 HydrophobicContact CG-CZ 4.18Å; E211-F215 WeakPolarHBondContact O-CB 3.32Å; E211-F215 WeakPolarHBondContact O-CD2 3.22Å; E211-F215 WeakPolarHBondContact O-CG 3.4Å; E211-F215 PolarHBondContact O-N 2.89Å
212N97.8Very high97.3Very high10 Ų1055.8 Ų55.85%0.05327%0.272CS..Hα-helixtrans-52.5-52.8172.4-67.5150.2000110.1L130 S171 S206 N208 T209 S216L130-N212 HydrophobicContact CD2-CB 3.7Å; S171-N212 WeakPolarHBondContact OG-CA 3.39Å; S171-N212 WeakPolarHBondContact OG-CB 2.83Å; S171-N212 PolarHBondContact OG-ND2 2.97Å; S171-N212 PolarHBondContact OG-O 2.94Å; S206-N212 WeakPolarHBondContact CB-ND2 3.41Å; S206-N212 PolarHBondContact OG-ND2 3.17Å; N208-N212 PolarHBondContact O-N 2.93Å; T209-N212 WeakPolarHBondContact CA-OD1 3.4Å; T209-N212 WeakPolarHBondContact O-CB 3.41Å; T209-N212 PolarHBondContact O-N 2.9Å; N212-S216 WeakPolarHBondContact O-CB 3.33Å; N212-S216 PolarHBondContact O-N 2.95Å; N212-S216 PolarHBondContact O-OG 2.9Å
213M98Very high97.3Very high0 Ų056.4 Ų56.40%027%0.273CS..Hα-helixtrans-64.3-44.1-179-67.8-57.9-174.600111.9L130 T209 L210 E211 K217 F232 A242 A246 V249 L251 I253L130-M213 HydrophobicContact CD1-CE 3.81Å; L130-M213 HydrophobicContact CD2-CE 3.94Å; L130-M213 HydrophobicContact CD2-SD 4.31Å; L130-M213 HydrophobicContact CG-CE 4.33Å; T209-M213 WeakPolarHBondContact O-CG 3.4Å; T209-M213 PolarHBondContact O-N 3.06Å; T209-M213 VanDerWaalsContact O-N 3.15Å; L210-M213 PolarHBondContact O-N 3.21Å; E211-M213 VanDerWaalsContact C-N 3.3Å; E211-M213 PolarHBondContact O-N 3.43Å; M213-K217 WeakPolarHBondContact O-CB 3.35Å; M213-K217 PolarHBondContact O-N 3.38Å; M213-F232 HydrophobicContact CE-CB 4.14Å; M213-F232 HydrophobicContact CE-CD1 3.97Å; M213-F232 HydrophobicContact CE-CD2 3.93Å; M213-F232 HydrophobicContact CE-CE1 4.34Å; M213-F232 HydrophobicContact CE-CE2 4.32Å; M213-F232 HydrophobicContact CE-CG 3.75Å; M213-F232 HydrophobicContact CE-CZ 4.5Å; M213-A242 HydrophobicContact CE-CB 4.21Å; M213-A242 WeakPolarHBondContact CE-O 3.32Å; M213-A246 HydrophobicContact CE-CB 4.17Å; M213-A246 HydrophobicContact CG-CB 4.35Å; M213-A246 HydrophobicContact SD-CB 4.12Å; M213-V249 HydrophobicContact CB-CG1 4.48Å; M213-V249 HydrophobicContact CB-CG2 3.74Å; M213-L251 HydrophobicContact CB-CD1 4.22Å; M213-L251 WeakPolarHBondContact O-CD1 3.33Å; M213-L251 HydrophobicContact SD-CD1 4.33Å; M213-I253 HydrophobicContact SD-CD1 4.28Å
214K98.4Very high97.2Very high103 Ų10359.4 Ų59.445%0.44829%0.286SS..Hα-helixtrans-61.4-52.6179.7-175.4-177.1172.3-172.80112.1L210 E211 K217 E218 V249L210-K214 WeakPolarHBondContact O-CB 3.27Å; L210-K214 PolarHBondContact O-N 3.4Å; E211-K214 PolarHBondContact O-N 2.87Å; K214-K217 WeakPolarHBondContact O-CB 3.35Å; K214-K217 PolarHBondContact O-N 3.37Å; K214-E218 WeakPolarHBondContact CE-OE1 3.44Å; K214-E218 WeakPolarHBondContact O-CG 3.29Å; K214-E218 PolarHBondContact O-N 2.9Å; K214-E218 VanDerWaalsContact O-N 3.09Å; K214-V249 HydrophobicContact CB-CG1 4Å
215F98.5Very high97.1Very high45 Ų4563.3 Ų63.320%0.19731%0.309CS..Hα-helixtrans-72.7-32.6-176.4-59.5-25.3000111.8E203 Q205 E211 K217 E218 I219E203-F215 HydrophobicContact CG-CB 3.51Å; E203-F215 WeakPolarHBondContact OE1-CD2 3.49Å; Q205-F215 HydrophobicContact CB-CD2 3.92Å; Q205-F215 HydrophobicContact CB-CE2 3.9Å; E211-F215 HydrophobicContact CB-CD2 4.2Å; E211-F215 HydrophobicContact CB-CE2 3.88Å; E211-F215 HydrophobicContact CB-CZ 4.33Å; E211-F215 HydrophobicContact CG-CE2 4.17Å; E211-F215 HydrophobicContact CG-CZ 4.18Å; E211-F215 WeakPolarHBondContact O-CB 3.32Å; E211-F215 WeakPolarHBondContact O-CD2 3.22Å; E211-F215 WeakPolarHBondContact O-CG 3.4Å; E211-F215 PolarHBondContact O-N 2.89Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.49Å; F215-E218 PolarHBondContact O-N 3.44Å; F215-I219 WeakPolarHBondContact O-CG1 3.43Å; F215-I219 PolarHBondContact O-N 2.85Å
216S98.5Very high97Very high0 Ų061.7 Ų61.70%032%0.315CS..Hα-helixtrans-61.4-43170.2-60.40000111.4L169 S171 N212 I219 M220L169-S216 VanDerWaalsContact CD2-OG 3.25Å; L169-S216 WeakPolarHBondContact CD2-OG 3.35Å; S171-S216 WeakPolarHBondContact CB-OG 3.46Å; S171-S216 PolarHBondContact OG-OG 3.09Å; N212-S216 WeakPolarHBondContact O-CB 3.33Å; N212-S216 PolarHBondContact O-N 2.95Å; N212-S216 PolarHBondContact O-OG 2.9Å; S216-I219 PolarHBondContact O-N 3.33Å; S216-M220 VanDerWaalsContact O-CG 3.31Å; S216-M220 WeakPolarHBondContact O-CG 3.33Å; S216-M220 PolarHBondContact O-N 2.87Å
217K98.1Very high96.9Very high47 Ų4763.5 Ų63.520%0.20433%0.333CS..Hα-helixtrans-57.2-50.3174.7178.9178.6173.1170.60111.6M213 K214 F215 I219 M220 E221 V249 L251M213-K217 WeakPolarHBondContact O-CB 3.35Å; M213-K217 PolarHBondContact O-N 3.38Å; K214-K217 WeakPolarHBondContact O-CB 3.35Å; K214-K217 PolarHBondContact O-N 3.37Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.49Å; K217-I219 VanDerWaalsContact C-N 3.27Å; K217-I219 PolarHBondContact O-N 3.32Å; K217-M220 PolarHBondContact O-N 3.36Å; K217-E221 WeakPolarHBondContact CE-OE1 3.08Å; K217-E221 HydrophobicContact CG-CG 4.3Å; K217-E221 IonicContact NZ-OE1 3.89Å; K217-E221 WeakPolarHBondContact O-CB 3.43Å; K217-E221 WeakPolarHBondContact O-CG 3.47Å; K217-E221 PolarHBondContact O-N 2.84Å; K217-V249 WeakPolarHBondContact CD-O 3.48Å; K217-V249 PolarHBondContact NZ-O 3.44Å; K217-L251 HydrophobicContact CB-CD1 3.92Å; K217-L251 HydrophobicContact CB-CD2 3.85Å; K217-L251 HydrophobicContact CB-CG 3.89Å; K217-L251 HydrophobicContact CD-CD2 4.14Å; K217-L251 HydrophobicContact CD-CG 4.05Å; K217-L251 HydrophobicContact CG-CD2 3.82Å; K217-L251 HydrophobicContact CG-CG 4.12Å
218E98Very high97Very high93 Ų9360.8 Ų60.844%0.43531%0.311SS..Hα-helixtrans-59-39.5-179.6-70.5171-167.500111.9K214 F215 R222K214-E218 WeakPolarHBondContact CE-OE1 3.44Å; K214-E218 WeakPolarHBondContact O-CG 3.29Å; K214-E218 PolarHBondContact O-N 2.9Å; K214-E218 VanDerWaalsContact O-N 3.09Å; F215-E218 PolarHBondContact O-N 3.44Å; E218-R222 PolarHBondContact O-N 2.92Å
219I98.2Very high97.1Very high17 Ų1762.5 Ų62.59%0.08732%0.317CS..Hα-helixtrans-65.2-52.6174.6-70.2166.6000110.6L169 I201 E203 F215 S216 K217 E221 R222 E223L169-I219 HydrophobicContact CD1-CB 4.19Å; L169-I219 HydrophobicContact CD1-CG2 3.86Å; I201-I219 HydrophobicContact CG2-CG2 3.8Å; E203-I219 HydrophobicContact CB-CD1 3.57Å; E203-I219 HydrophobicContact CG-CD1 3.63Å; F215-I219 WeakPolarHBondContact O-CG1 3.43Å; F215-I219 PolarHBondContact O-N 2.85Å; S216-I219 PolarHBondContact O-N 3.33Å; K217-I219 VanDerWaalsContact C-N 3.27Å; K217-I219 PolarHBondContact O-N 3.32Å; I219-E221 VanDerWaalsContact C-N 3.31Å; I219-E221 PolarHBondContact O-N 3.26Å; I219-R222 WeakPolarHBondContact O-CB 3.36Å; I219-R222 PolarHBondContact O-N 3.45Å; I219-R222 VanDerWaalsContact O-N 3.08Å; I219-E223 HydrophobicContact CG2-CG 4.21Å; I219-E223 WeakPolarHBondContact O-CG 3.38Å; I219-E223 PolarHBondContact O-N 3.16Å
220M98.1Very high97.2Very high0 Ų061.5 Ų61.50%031%0.312CS..Hα-helixtrans-61.1-38.4-178.3-67.3-176.5-60.600112.7F126 I128 L169 S216 K217 R222 E223 K224 Y228 A230 L251F126-M220 HydrophobicContact CB-CG 4.07Å; F126-M220 HydrophobicContact CB-SD 3.49Å; F126-M220 WeakPolarHBondContact CB-SD 3.24Å; F126-M220 HydrophobicContact CD1-CG 3.87Å; F126-M220 HydrophobicContact CD1-SD 4.43Å; F126-M220 HydrophobicContact CD2-CB 4Å; F126-M220 HydrophobicContact CD2-CG 3.6Å; F126-M220 HydrophobicContact CD2-SD 3.69Å; F126-M220 HydrophobicContact CE1-CG 4.2Å; F126-M220 HydrophobicContact CE2-CB 3.94Å; F126-M220 HydrophobicContact CE2-CG 3.96Å; F126-M220 HydrophobicContact CG-CB 4.44Å; F126-M220 HydrophobicContact CG-CG 3.57Å; F126-M220 HydrophobicContact CG-SD 3.62Å; F126-M220 HydrophobicContact CZ-CB 4.32Å; F126-M220 HydrophobicContact CZ-CG 4.25Å; I128-M220 HydrophobicContact CD1-CE 3.77Å; I128-M220 HydrophobicContact CD1-SD 4.17Å; I128-M220 HydrophobicContact CG1-CE 4.49Å; I128-M220 HydrophobicContact CG1-SD 4.26Å; L169-M220 HydrophobicContact CD1-CG 3.86Å; S216-M220 VanDerWaalsContact O-CG 3.31Å; S216-M220 WeakPolarHBondContact O-CG 3.33Å; S216-M220 PolarHBondContact O-N 2.87Å; K217-M220 PolarHBondContact O-N 3.36Å; M220-R222 VanDerWaalsContact C-N 3.3Å; M220-R222 PolarHBondContact O-N 2.94Å; M220-E223 PolarHBondContact O-N 3.33Å; M220-K224 PolarHBondContact O-N 3.18Å; M220-Y228 HydrophobicContact CB-CD1 4.06Å; M220-Y228 HydrophobicContact CB-CD2 4.23Å; M220-Y228 HydrophobicContact CB-CE1 3.84Å; M220-Y228 HydrophobicContact CB-CE2 4.02Å; M220-Y228 HydrophobicContact CB-CG 4.26Å; M220-Y228 HydrophobicContact CE-CD2 4.34Å; M220-Y228 HydrophobicContact CE-CE2 3.57Å; M220-Y228 HydrophobicContact SD-CD2 4.09Å; M220-Y228 HydrophobicContact SD-CE2 3.92Å; M220-A230 HydrophobicContact CE-CB 4.17Å; M220-A230 HydrophobicContact SD-CB 3.56Å; M220-A230 VanDerWaalsContact SD-CB 3.56Å; M220-L251 HydrophobicContact CE-CD1 4.3Å; M220-L251 HydrophobicContact CE-CD2 3.68Å
221E97.6Very high97.2Very high89 Ų8958.4 Ų58.442%0.41630%0.295SS..Hα-helixtrans-64.9-34.6175.8-75.3177.8168.200112.3K217 I219 P225 Y228K217-E221 WeakPolarHBondContact CE-OE1 3.08Å; K217-E221 HydrophobicContact CG-CG 4.3Å; K217-E221 IonicContact NZ-OE1 3.89Å; K217-E221 WeakPolarHBondContact O-CB 3.43Å; K217-E221 WeakPolarHBondContact O-CG 3.47Å; K217-E221 PolarHBondContact O-N 2.84Å; I219-E221 VanDerWaalsContact C-N 3.31Å; I219-E221 PolarHBondContact O-N 3.26Å; E221-P225 VanDerWaalsContact O-CA 3.23Å; E221-P225 WeakPolarHBondContact O-CA 3.37Å; E221-Y228 HydrophobicContact CB-CE1 4.47Å; E221-Y228 HydrophobicContact CG-CE1 3.67Å
222R97.5Very high97.3Very high168 Ų16855.8 Ų55.863%0.63428%0.283SS*.Hα-helixtrans-72.4-43.3174.5-174.4-176.465-138.9-4.5112.1E218 I219 M220E218-R222 PolarHBondContact O-N 2.92Å; I219-R222 WeakPolarHBondContact O-CB 3.36Å; I219-R222 PolarHBondContact O-N 3.45Å; I219-R222 VanDerWaalsContact O-N 3.08Å; M220-R222 VanDerWaalsContact C-N 3.3Å; M220-R222 PolarHBondContact O-N 2.94Å
223E96.6Very high97.2Very high95 Ų9555.3 Ų55.344%0.44428%0.281SS..Hα-helixtrans-69.8-35.3179.9-63.4-49132.100111.9F126 I201 I219 M220F126-E223 HydrophobicContact CE1-CB 4.23Å; F126-E223 HydrophobicContact CZ-CB 3.81Å; I201-E223 HydrophobicContact CD1-CG 4.18Å; I219-E223 HydrophobicContact CG2-CG 4.21Å; I219-E223 WeakPolarHBondContact O-CG 3.38Å; I219-E223 PolarHBondContact O-N 3.16Å; M220-E223 PolarHBondContact O-N 3.33Å
224K96.7Very high97.2Very high68 Ų6855.3 Ų55.330%0.29628%0.281SS..  trans-137.672.3-176.8-154.3173.6-179.6-177.60112.8D125 F126 M220 S226 G227D125-K224 HydrophobicContact CB-CD 4.3Å; D125-K224 IonicContact OD1-NZ 2.74Å; D125-K224 PolarHBondContact OD1-NZ 2.98Å; D125-K224 IonicContact OD2-NZ 3.02Å; D125-K224 PolarHBondContact OD2-NZ 2.83Å; F126-K224 HydrophobicContact CE2-CB 4.14Å; F126-K224 HydrophobicContact CZ-CB 4.34Å; M220-K224 PolarHBondContact O-N 3.18Å; K224-S226 PolarHBondContact O-N 2.93Å; K224-G227 VanDerWaalsContact CD-O 3.29Å; K224-G227 WeakPolarHBondContact CD-O 3.32Å; K224-G227 WeakPolarHBondContact CE-O 3.17Å; K224-G227 VanDerWaalsContact CG-O 3.32Å; K224-G227 WeakPolarHBondContact CG-O 3.36Å; K224-G227 PolarHBondContact O-N 3.43Å; K224-G227 VanDerWaalsContact O-N 3.08Å
225P94.7Very high97Very high114 Ų11450.4 Ų50.474%0.7426%0.259SS*.THydrogen-bonded Turntrans-67.7-19.3-173.425.8-35000114.5E221 G227E221-P225 VanDerWaalsContact O-CA 3.23Å; E221-P225 WeakPolarHBondContact O-CA 3.37Å; P225-G227 PolarHBondContact O-N 3.46Å
226S94Very high96.8Very high116 Ų11649.3 Ų49.381%0.81126%0.256SS*.THydrogen-bonded Turntrans-76.6-5.217552.50000113.7K224K224-S226 PolarHBondContact O-N 2.93Å
227G94.7Very high96.6Very high41 Ų4149.7 Ų49.742%0.42326%0.257SS..  trans115150.5-178.800000112.4K224 P225K224-G227 VanDerWaalsContact CD-O 3.29Å; K224-G227 WeakPolarHBondContact CD-O 3.32Å; K224-G227 WeakPolarHBondContact CE-O 3.17Å; K224-G227 VanDerWaalsContact CG-O 3.32Å; K224-G227 WeakPolarHBondContact CG-O 3.36Å; K224-G227 PolarHBondContact O-N 3.43Å; K224-G227 VanDerWaalsContact O-N 3.08Å; P225-G227 PolarHBondContact O-N 3.46Å
228Y96.7Very high96.5Very high51 Ų5147.8 Ų47.820%0.225%0.249CC..  trans-141.1157.9-176.954.6-93.1000111.7D125 F126 M220 E221 A230 L251D125-Y228 VanDerWaalsContact OD2-CA 3.27Å; D125-Y228 WeakPolarHBondContact OD2-CA 3.2Å; F126-Y228 HydrophobicContact CD2-CD2 4.31Å; F126-Y228 HydrophobicContact CD2-CG 4.21Å; F126-Y228 HydrophobicContact CE2-CG 4.16Å; M220-Y228 HydrophobicContact CB-CD1 4.06Å; M220-Y228 HydrophobicContact CB-CD2 4.23Å; M220-Y228 HydrophobicContact CB-CE1 3.84Å; M220-Y228 HydrophobicContact CB-CE2 4.02Å; M220-Y228 HydrophobicContact CB-CG 4.26Å; M220-Y228 HydrophobicContact CE-CD2 4.34Å; M220-Y228 HydrophobicContact CE-CE2 3.57Å; M220-Y228 HydrophobicContact SD-CD2 4.09Å; M220-Y228 HydrophobicContact SD-CE2 3.92Å; E221-Y228 HydrophobicContact CB-CE1 4.47Å; E221-Y228 HydrophobicContact CG-CE1 3.67Å; Y228-A230 HydrophobicContact CD2-CB 3.95Å; Y228-A230 HydrophobicContact CE2-CB 4.22Å; Y228-L251 HydrophobicContact CE2-CD2 4.14Å; Y228-L251 WeakPolarHBondContact OH-CD2 3.49Å
229H97.1Very high96.4Very high105 Ų10543.4 Ų43.449%0.48623%0.228SC..  trans-103.6135.4161.3-67.5-59000109.4N123 D125 F126N123-H229 VanDerWaalsContact O-CB 3.23Å; N123-H229 WeakPolarHBondContact O-CB 3.29Å; D125-H229 WeakPolarHBondContact CA-O 3.32Å; D125-H229 WeakPolarHBondContact CB-O 3.2Å; D125-H229 PolarHBondContact N-O 3.41Å; D125-H229 PolarHBondContact OD2-N 2.73Å; F126-H229 PolarHBondContact N-O 3.26Å
230A97.7Very high96.2Very high7 Ų743.9 Ų43.96%0.05823%0.23CC..EExtended strand (participates in β ladder)trans-141.5154.6179.100000111.3Q124 F126 M220 Y228 I253Q124-A230 PolarHBondContact OE1-O 3.28Å; F126-A230 HydrophobicContact CB-CB 4.05Å; F126-A230 VanDerWaalsContact O-CA 3.3Å; F126-A230 WeakPolarHBondContact O-CA 3.37Å; M220-A230 HydrophobicContact CE-CB 4.17Å; M220-A230 HydrophobicContact SD-CB 3.56Å; M220-A230 VanDerWaalsContact SD-CB 3.56Å; Y228-A230 HydrophobicContact CD2-CB 3.95Å; Y228-A230 HydrophobicContact CE2-CB 4.22Å; A230-I253 HydrophobicContact CB-CG2 3.86Å; A230-I253 VanDerWaalsContact O-CB 3.32Å; A230-I253 WeakPolarHBondContact O-CB 3.29Å; A230-I253 WeakPolarHBondContact O-CG2 3.43Å
231I97.6Very high96.1Very high2 Ų245.8 Ų45.81%0.0124%0.237CC..EExtended strand (participates in β ladder)trans-134.6156.5172.7-160.2178.3000108.7P120 Q124 F126 V127 I128 F154 D254 I256P120-I231 HydrophobicContact CB-CD1 3.29Å; P120-I231 HydrophobicContact CG-CD1 3.5Å; Q124-I231 HydrophobicContact CB-CG2 4.47Å; Q124-I231 HydrophobicContact CG-CB 4.19Å; Q124-I231 HydrophobicContact CG-CG2 4.02Å; F126-I231 PolarHBondContact O-N 3.04Å; V127-I231 CarbonylContact C-O 3.54Å; V127-I231 WeakPolarHBondContact CA-O 3.37Å; V127-I231 HydrophobicContact CB-CG2 4.26Å; V127-I231 HydrophobicContact CG1-CG2 4.13Å; V127-I231 HydrophobicContact CG2-CG2 3.83Å; I128-I231 PolarHBondContact N-O 3.01Å; F154-I231 HydrophobicContact CD1-CG2 4.49Å; F154-I231 HydrophobicContact CE1-CG2 4.3Å; I231-D254 HydrophobicContact CG1-CB 4.47Å; I231-D254 WeakPolarHBondContact CG1-O 3.4Å; I231-I256 HydrophobicContact CD1-CB 4.38Å; I231-I256 HydrophobicContact CD1-CD1 4.25Å; I231-I256 HydrophobicContact CD1-CG1 4.02Å; I231-I256 HydrophobicContact CD1-CG2 3.68Å; I231-I256 HydrophobicContact CG1-CG1 4.49Å
232F97.9Very high96.1Very high1 Ų141.5 Ų41.50%0.00422%0.217CC..EExtended strand (participates in β ladder)trans-117.4155.8171.873.8-87.8000112.8I128 L130 M213 I239 A242 I253 D254 G255 I256I128-F232 HydrophobicContact CB-CB 3.93Å; I128-F232 CarbonylContact O-C 3.28Å; I128-F232 VanDerWaalsContact O-CA 3.24Å; I128-F232 WeakPolarHBondContact O-CA 3.46Å; L130-F232 HydrophobicContact CD1-CD2 3.92Å; L130-F232 HydrophobicContact CD1-CE2 4.39Å; L130-F232 HydrophobicContact CG-CD2 4.49Å; M213-F232 HydrophobicContact CE-CB 4.14Å; M213-F232 HydrophobicContact CE-CD1 3.97Å; M213-F232 HydrophobicContact CE-CD2 3.93Å; M213-F232 HydrophobicContact CE-CE1 4.34Å; M213-F232 HydrophobicContact CE-CE2 4.32Å; M213-F232 HydrophobicContact CE-CG 3.75Å; M213-F232 HydrophobicContact CE-CZ 4.5Å; F232-I239 HydrophobicContact CD2-CD1 4.41Å; F232-I239 HydrophobicContact CE2-CD1 3.78Å; F232-I239 HydrophobicContact CE2-CG2 4.48Å; F232-I239 HydrophobicContact CZ-CG2 4.24Å; F232-A242 HydrophobicContact CD2-CB 4.23Å; F232-A242 HydrophobicContact CE2-CB 3.46Å; F232-A242 VanDerWaalsContact CE2-CB 3.46Å; F232-A242 HydrophobicContact CZ-CB 3.9Å; F232-I253 HydrophobicContact CB-CD1 4.19Å; F232-I253 HydrophobicContact CD1-CD1 3.75Å; F232-I253 HydrophobicContact CD1-CG1 3.88Å; F232-I253 HydrophobicContact CE1-CG1 4.43Å; F232-I253 HydrophobicContact CG-CD1 4.42Å; F232-D254 WeakPolarHBondContact CD1-O 3.4Å; F232-D254 VanDerWaalsContact CE1-C 3.46Å; F232-D254 WeakPolarHBondContact CE1-O 3.34Å; F232-D254 PolarHBondContact N-O 3.39Å; F232-G255 VanDerWaalsContact CZ-CA 3.44Å; F232-G255 CarbonylContact O-C 3.38Å; F232-G255 VanDerWaalsContact O-CA 3.32Å; F232-G255 WeakPolarHBondContact O-CA 3.22Å; F232-I256 WeakPolarHBondContact O-CG1 3.46Å; F232-I256 PolarHBondContact O-N 2.96Å
233T97.4Very high96Very high0 Ų033.9 Ų33.90%019%0.191CC..EExtended strand (participates in β ladder)trans-117.6139.8175.970.60000110.3V127 I128 V129 L130 A151 I256V127-T233 HydrophobicContact CG1-CG2 3.59Å; I128-T233 PolarHBondContact O-N 3.46Å; I128-T233 PolarHBondContact O-OG1 3.38Å; V129-T233 WeakPolarHBondContact CA-OG1 3.22Å; L130-T233 PolarHBondContact N-O 3.47Å; A151-T233 HydrophobicContact CB-CG2 3.69Å; T233-I256 WeakPolarHBondContact CA-O 3.45Å; T233-I256 HydrophobicContact CG2-CD1 3.51Å; T233-I256 HydrophobicContact CG2-CG1 3.47Å; T233-I256 VanDerWaalsContact CG2-CG1 3.47Å
234S97Very high96Very high0 Ų031.1 Ų31.10%018%0.178CC..EExtended strand (participates in β ladder)trans-156.1-174.6173.9-158.70000111.3R147 H238 I256 G257 S258R147-S234 PolarHBondContact NE-OG 3.36Å; R147-S234 PolarHBondContact NH1-OG 2.85Å; R147-S234 VanDerWaalsContact NH1-OG 3.16Å; R147-S234 PolarHBondContact NH2-OG 3.49Å; S234-H238 PolarHBondContact OG-CD2 3.33Å; S234-H238 VanDerWaalsContact OG-CD2 3.31Å; S234-I256 PolarHBondContact N-O 3.46Å; S234-G257 CarbonylContact O-C 3.51Å; S234-S258 WeakPolarHBondContact O-CB 3.22Å; S234-S258 PolarHBondContact O-N 2.98Å; S234-S258 PolarHBondContact O-OG 3.49Å
235N95.2Very high96Very high0 Ų029.8 Ų29.80%017%0.172CC..EExtended strand (participates in β ladder)trans-71.8144.1168.6-58.2118000110L143 R147 Y237 H238 I239 S258L143-N235 PolarHBondContact O-ND2 3.25Å; R147-N235 VanDerWaalsContact CZ-OD1 3.22Å; R147-N235 PolarHBondContact NE-OD1 3.22Å; R147-N235 PolarHBondContact NH2-OD1 2.84Å; N235-Y237 HydrophobicContact CB-CD1 3.94Å; N235-Y237 HydrophobicContact CB-CE1 3.49Å; N235-Y237 VanDerWaalsContact CB-CE1 3.49Å; N235-Y237 HydrophobicContact CB-CE2 4.39Å; N235-Y237 PolarHBondContact O-N 3.48Å; N235-Y237 VanDerWaalsContact O-N 3.12Å; N235-Y237 PolarHBondContact OD1-OH 3.46Å; N235-H238 PolarHBondContact O-N 3.38Å; N235-I239 PolarHBondContact O-N 3.33Å; N235-S258 WeakPolarHBondContact CA-OG 3.39Å; N235-S258 PolarHBondContact ND2-OG 3.26Å; N235-S258 VanDerWaalsContact ND2-OG 3.12Å
236N94.1Very high96.1Very high22 Ų2224.4 Ų24.412%0.11814%0.136CC..THydrogen-bonded Turntrans-53.4-35.6-174.368.7-32.3000115Q116 H238 S258 T260Q116-N236 HydrophobicContact CG-CB 4.22Å; Q116-N236 PolarHBondContact OE1-ND2 2.89Å; Q116-N236 VanDerWaalsContact OE1-ND2 3.09Å; N236-H238 VanDerWaalsContact C-N 3.27Å; N236-H238 PolarHBondContact O-N 2.79Å; N236-S258 VanDerWaalsContact CB-O 3.32Å; N236-S258 WeakPolarHBondContact CB-O 3.35Å; N236-S258 PolarHBondContact N-O 3.47Å; N236-T260 VanDerWaalsContact OD1-CB 3.26Å; N236-T260 WeakPolarHBondContact OD1-CB 3.44Å; N236-T260 PolarHBondContact OD1-OG1 3.41Å
237Y93.9Very high96.2Very high7 Ų725.7 Ų25.73%0.02713%0.13CC..THydrogen-bonded Turntrans-69.6-22.8176.962.2-102.5000113.3N235 T260 Y264 L265 A268 E272N235-Y237 HydrophobicContact CB-CD1 3.94Å; N235-Y237 HydrophobicContact CB-CE1 3.49Å; N235-Y237 VanDerWaalsContact CB-CE1 3.49Å; N235-Y237 HydrophobicContact CB-CE2 4.39Å; N235-Y237 PolarHBondContact O-N 3.48Å; N235-Y237 VanDerWaalsContact O-N 3.12Å; N235-Y237 PolarHBondContact OD1-OH 3.46Å; Y237-T260 HydrophobicContact CD1-CG2 3.82Å; Y237-T260 WeakPolarHBondContact CD1-OG1 3.39Å; Y237-T260 HydrophobicContact CE1-CG2 3.67Å; Y237-Y264 HydrophobicContact CE1-CD1 4.27Å; Y237-Y264 HydrophobicContact CE1-CE1 4.05Å; Y237-L265 HydrophobicContact CD1-CD2 4.35Å; Y237-A268 HydrophobicContact CD1-CB 3.63Å; Y237-A268 HydrophobicContact CD2-CB 3.88Å; Y237-A268 HydrophobicContact CE1-CB 3.9Å; Y237-A268 HydrophobicContact CE2-CB 4.18Å; Y237-A268 HydrophobicContact CG-CB 3.61Å; Y237-E272 HydrophobicContact CD2-CG 3.66Å; Y237-E272 HydrophobicContact CE2-CG 4.39Å; Y237-E272 WeakPolarHBondContact O-CG 3.39Å
238H95.7Very high96.3Very high8 Ų828.9 Ų28.94%0.03714%0.137CC..THydrogen-bonded Turntrans-96.9-12.5-173-168.950.6000113.7S234 N235 N236 F240 R241 A242 E272S234-H238 PolarHBondContact OG-CD2 3.33Å; S234-H238 VanDerWaalsContact OG-CD2 3.31Å; N235-H238 PolarHBondContact O-N 3.38Å; N236-H238 VanDerWaalsContact C-N 3.27Å; N236-H238 PolarHBondContact O-N 2.79Å; H238-F240 VanDerWaalsContact C-N 3.3Å; H238-F240 PolarHBondContact O-N 3.21Å; H238-R241 PolarHBondContact CE1-NH2 2.9Å; H238-R241 PolarHBondContact O-N 2.96Å; H238-A242 WeakPolarHBondContact O-CB 3.29Å; H238-A242 PolarHBondContact O-N 2.84Å; H238-E272 IonicContact CE1-OE2 3.5Å; H238-E272 IonicContact CG-OE2 2.68Å; H238-E272 IonicContact ND1-OE1 3.86Å; H238-E272 PolarHBondContact ND1-OE1 3.41Å; H238-E272 IonicContact ND1-OE2 3.27Å; H238-E272 PolarHBondContact ND1-OE2 3.09Å
239I95.7Very high96.4Very high1 Ų127.7 Ų27.71%0.00514%0.135CC..Hα-helixtrans-56.1-42.7-173.2-66.2-64.3000112.4Y115 F232 N235 G243 I256Y115-I239 HydrophobicContact CD1-CG2 4.04Å; F232-I239 HydrophobicContact CD2-CD1 4.41Å; F232-I239 HydrophobicContact CE2-CD1 3.78Å; F232-I239 HydrophobicContact CE2-CG2 4.48Å; F232-I239 HydrophobicContact CZ-CG2 4.24Å; N235-I239 PolarHBondContact O-N 3.33Å; I239-G243 PolarHBondContact O-N 2.95Å; I239-I256 VanDerWaalsContact CD1-C 3.48Å; I239-I256 WeakPolarHBondContact CD1-O 3.35Å
240F95.4Very high96.3Very high26 Ų2625 Ų2511%0.11414%0.136CC..Hα-helixtrans-62.7-50.5-178.4176.8-124000112.1F108 I111 Y115 H238 G243 M244 V276F108-F240 AromaticContact CD2-CD1 3.83Å; F108-F240 HydrophobicContact CD2-CD1 3.83Å; F108-F240 AromaticContact CD2-CE1 3.92Å; F108-F240 HydrophobicContact CD2-CE1 3.92Å; F108-F240 AromaticContact CE2-CD1 3.72Å; F108-F240 HydrophobicContact CE2-CD1 3.72Å; F108-F240 HydrophobicContact CE2-CE1 4.23Å; I111-F240 HydrophobicContact CB-CE2 4.48Å; I111-F240 HydrophobicContact CG2-CD2 3.62Å; I111-F240 HydrophobicContact CG2-CE1 4.49Å; I111-F240 HydrophobicContact CG2-CE2 3.38Å; I111-F240 HydrophobicContact CG2-CG 4.29Å; I111-F240 HydrophobicContact CG2-CZ 3.86Å; Y115-F240 AromaticContact CD2-CD2 3.88Å; Y115-F240 HydrophobicContact CD2-CD2 3.88Å; Y115-F240 HydrophobicContact CE1-CD2 4.33Å; Y115-F240 AromaticContact CE2-CD2 3.65Å; Y115-F240 HydrophobicContact CE2-CD2 3.65Å; Y115-F240 AromaticContact CE2-CE2 4Å; Y115-F240 HydrophobicContact CE2-CE2 4Å; Y115-F240 HydrophobicContact CG-CD2 4.32Å; Y115-F240 AromaticContact CZ-CD2 3.88Å; H238-F240 VanDerWaalsContact C-N 3.3Å; H238-F240 PolarHBondContact O-N 3.21Å; F240-G243 PolarHBondContact O-N 2.85Å; F240-G243 VanDerWaalsContact O-N 3.16Å; F240-M244 HydrophobicContact CE1-SD 3.98Å; F240-M244 HydrophobicContact CE2-CG 4.38Å; F240-M244 HydrophobicContact CZ-CG 4.37Å; F240-M244 HydrophobicContact CZ-SD 4Å; F240-M244 PolarHBondContact O-N 3.31Å; F240-V276 HydrophobicContact CE1-CG1 4.42Å
241R95.8Very high96.2Very high40 Ų4025 Ų2515%0.15114%0.135CC..Hα-helixtrans-67.1-39.1179.7-175.8166.159.9120-2.9112.4H238 G243 M244 Y245 E272 V276 M279H238-R241 PolarHBondContact CE1-NH2 2.9Å; H238-R241 PolarHBondContact O-N 2.96Å; R241-G243 VanDerWaalsContact C-N 3.26Å; R241-G243 PolarHBondContact O-N 3.31Å; R241-M244 WeakPolarHBondContact O-CB 3.23Å; R241-M244 PolarHBondContact O-N 3.4Å; R241-Y245 HydrophobicContact CG-CD2 4.35Å; R241-Y245 HydrophobicContact CG-CE2 3.8Å; R241-Y245 WeakPolarHBondContact O-CD2 3.47Å; R241-Y245 PolarHBondContact O-N 3.24Å; R241-E272 IonicContact CZ-OE1 3.79Å; R241-E272 IonicContact CZ-OE2 3.01Å; R241-E272 VanDerWaalsContact CZ-OE2 3.27Å; R241-E272 IonicContact NE-OE1 3.96Å; R241-E272 IonicContact NE-OE2 3.65Å; R241-E272 PolarHBondContact NE-OE2 2.86Å; R241-E272 VanDerWaalsContact NH2-CD 3.27Å; R241-E272 IonicContact NH2-OE1 2.82Å; R241-E272 PolarHBondContact NH2-OE1 2.93Å; R241-E272 IonicContact NH2-OE2 2.71Å; R241-E272 PolarHBondContact NH2-OE2 3.42Å; R241-V276 HydrophobicContact CB-CG2 4.06Å; R241-V276 HydrophobicContact CG-CG2 4.12Å; R241-M279 HydrophobicContact CG-SD 4.24Å
242A96.5Very high96Very high0 Ų035 Ų350%018%0.179CC..Hα-helixtrans-60.8-37.6172.700000111.9L130 T209 M213 F232 H238 Y245 A246L130-A242 HydrophobicContact CD1-CB 3.69Å; T209-A242 HydrophobicContact CG2-CB 4.36Å; M213-A242 HydrophobicContact CE-CB 4.21Å; M213-A242 WeakPolarHBondContact CE-O 3.32Å; F232-A242 HydrophobicContact CD2-CB 4.23Å; F232-A242 HydrophobicContact CE2-CB 3.46Å; F232-A242 VanDerWaalsContact CE2-CB 3.46Å; F232-A242 HydrophobicContact CZ-CB 3.9Å; H238-A242 WeakPolarHBondContact O-CB 3.29Å; H238-A242 PolarHBondContact O-N 2.84Å; A242-Y245 PolarHBondContact O-N 3.48Å; A242-A246 PolarHBondContact O-N 3.1Å
243G96Very high95.9Very high8 Ų836 Ų368%0.08218%0.183CC..Hα-helixtrans-62.5-39.7173.200000113I239 F240 R241 Y245 A246 E247I239-G243 PolarHBondContact O-N 2.95Å; F240-G243 PolarHBondContact O-N 2.85Å; F240-G243 VanDerWaalsContact O-N 3.16Å; R241-G243 VanDerWaalsContact C-N 3.26Å; R241-G243 PolarHBondContact O-N 3.31Å; G243-Y245 VanDerWaalsContact C-N 3.33Å; G243-Y245 PolarHBondContact O-N 3.46Å; G243-A246 WeakPolarHBondContact O-CB 3.38Å; G243-A246 PolarHBondContact O-N 3.11Å; G243-E247 PolarHBondContact O-N 2.93Å
244M95.7Very high95.7Very high37 Ų3740.4 Ų40.418%0.18221%0.207CC..Hα-helixtrans-59.8-43.2173.3-62.8174.468.100111.5F240 R241 A246 E247 D248 V276 M279F240-M244 HydrophobicContact CE1-SD 3.98Å; F240-M244 HydrophobicContact CE2-CG 4.38Å; F240-M244 HydrophobicContact CZ-CG 4.37Å; F240-M244 HydrophobicContact CZ-SD 4Å; F240-M244 PolarHBondContact O-N 3.31Å; R241-M244 WeakPolarHBondContact O-CB 3.23Å; R241-M244 PolarHBondContact O-N 3.4Å; M244-A246 VanDerWaalsContact C-N 3.34Å; M244-A246 PolarHBondContact O-N 3.43Å; M244-E247 PolarHBondContact O-N 3.32Å; M244-D248 VanDerWaalsContact O-CG 3.29Å; M244-D248 PolarHBondContact O-N 3.36Å; M244-V276 HydrophobicContact CE-CG1 4.4Å; M244-V276 HydrophobicContact SD-CG1 4.13Å; M244-V276 HydrophobicContact SD-CG2 4.11Å; M244-M279 HydrophobicContact CB-CE 4.34Å; M244-M279 HydrophobicContact CE-CE 3.73Å; M244-M279 HydrophobicContact CE-SD 4.22Å; M244-M279 HydrophobicContact SD-CE 4.46Å
245Y97.3Very high95.6Very high40 Ų4040.6 Ų40.616%0.15721%0.209CC..Hα-helixtrans-67.6-32.9176.5-67-47.9000113.3T209 L210 R241 A242 G243 D248 V249 M279T209-Y245 HydrophobicContact CG2-CD2 3.64Å; T209-Y245 HydrophobicContact CG2-CE2 4.28Å; L210-Y245 HydrophobicContact CB-CD1 4.04Å; L210-Y245 HydrophobicContact CB-CE1 4.44Å; L210-Y245 HydrophobicContact CB-CG 4.38Å; L210-Y245 HydrophobicContact CD1-CD1 3.95Å; L210-Y245 HydrophobicContact CD1-CG 4.49Å; R241-Y245 HydrophobicContact CG-CD2 4.35Å; R241-Y245 HydrophobicContact CG-CE2 3.8Å; R241-Y245 WeakPolarHBondContact O-CD2 3.47Å; R241-Y245 PolarHBondContact O-N 3.24Å; A242-Y245 PolarHBondContact O-N 3.48Å; G243-Y245 VanDerWaalsContact C-N 3.33Å; G243-Y245 PolarHBondContact O-N 3.46Å; Y245-D248 PolarHBondContact O-N 2.97Å; Y245-V249 PolarHBondContact O-N 3.13Å; Y245-M279 HydrophobicContact CD1-CE 4.31Å; Y245-M279 HydrophobicContact CE1-CE 3.78Å; Y245-M279 HydrophobicContact CE1-SD 4.34Å
246A97.5Very high95.6Very high0 Ų040.8 Ų40.80%021%0.21CC..Hα-helixtrans-62.6-45.9172.100000110.5M213 A242 G243 M244 D248 V249 G250 L251 I253M213-A246 HydrophobicContact CE-CB 4.17Å; M213-A246 HydrophobicContact CG-CB 4.35Å; M213-A246 HydrophobicContact SD-CB 4.12Å; A242-A246 PolarHBondContact O-N 3.1Å; G243-A246 WeakPolarHBondContact O-CB 3.38Å; G243-A246 PolarHBondContact O-N 3.11Å; M244-A246 VanDerWaalsContact C-N 3.34Å; M244-A246 PolarHBondContact O-N 3.43Å; A246-D248 PolarHBondContact O-N 3.42Å; A246-V249 VanDerWaalsContact O-CG2 3.26Å; A246-V249 WeakPolarHBondContact O-CG2 3.39Å; A246-V249 PolarHBondContact O-N 3.34Å; A246-G250 PolarHBondContact O-N 3.27Å; A246-L251 CarbonylContact C-O 3.57Å; A246-L251 HydrophobicContact CB-CB 4.07Å; A246-L251 WeakPolarHBondContact O-CA 3.48Å; A246-L251 WeakPolarHBondContact O-CB 3.48Å; A246-L251 PolarHBondContact O-N 2.62Å; A246-I253 HydrophobicContact CB-CD1 4.25Å; A246-I253 HydrophobicContact CB-CG1 3.87Å
247E96.3Very high95.6Very high143 Ų14340.9 Ų40.967%0.66822%0.216SC*.Hα-helixtrans-61.5-42.8176.3-171.4171.2-169.700112.2G243 M244 V249 G250G243-E247 PolarHBondContact O-N 2.93Å; M244-E247 PolarHBondContact O-N 3.32Å; E247-V249 PolarHBondContact O-N 3.43Å; E247-G250 WeakPolarHBondContact O-CA 3.16Å; E247-G250 PolarHBondContact O-N 2.99Å
248D96.1Very high95.6Very high108 Ų10840.7 Ų40.758%0.57822%0.215SC*.Hα-helixtrans-57.8-33.7178-74.2-19.9000112.9L210 M244 Y245 A246L210-D248 HydrophobicContact CD1-CB 4.04Å; M244-D248 VanDerWaalsContact O-CG 3.29Å; M244-D248 PolarHBondContact O-N 3.36Å; Y245-D248 PolarHBondContact O-N 2.97Å; A246-D248 PolarHBondContact O-N 3.42Å
249V97.6Very high95.5Very high26 Ų2649 Ų4916%0.15825%0.252CS..THydrogen-bonded Turntrans-92.73.6176.8-54.70000113.1L210 M213 K214 K217 Y245 A246 E247 L251L210-V249 HydrophobicContact CD1-CG1 3.64Å; L210-V249 HydrophobicContact CG-CG1 4.43Å; M213-V249 HydrophobicContact CB-CG1 4.48Å; M213-V249 HydrophobicContact CB-CG2 3.74Å; K214-V249 HydrophobicContact CB-CG1 4Å; K217-V249 WeakPolarHBondContact CD-O 3.48Å; K217-V249 PolarHBondContact NZ-O 3.44Å; Y245-V249 PolarHBondContact O-N 3.13Å; A246-V249 VanDerWaalsContact O-CG2 3.26Å; A246-V249 WeakPolarHBondContact O-CG2 3.39Å; A246-V249 PolarHBondContact O-N 3.34Å; E247-V249 PolarHBondContact O-N 3.43Å; V249-L251 HydrophobicContact CG2-CB 4.14Å; V249-L251 HydrophobicContact CG2-CD1 3.92Å; V249-L251 HydrophobicContact CG2-CG 3.91Å
250G96.9Very high95.2Very high49 Ų4949.7 Ų49.751%0.50526%0.256SS..THydrogen-bonded Turntrans74.722.6-17900000114.5A246 E247A246-G250 PolarHBondContact O-N 3.27Å; E247-G250 WeakPolarHBondContact O-CA 3.16Å; E247-G250 PolarHBondContact O-N 2.99Å
251L95.6Very high94.9Very high7 Ų750.6 Ų50.64%0.03727%0.268CS..  trans-86.1110.6168.5-78.9175.1000109.8I128 M213 K217 M220 Y228 A246 V249 I253I128-L251 HydrophobicContact CD1-CD1 4.43Å; M213-L251 HydrophobicContact CB-CD1 4.22Å; M213-L251 WeakPolarHBondContact O-CD1 3.33Å; M213-L251 HydrophobicContact SD-CD1 4.33Å; K217-L251 HydrophobicContact CB-CD1 3.92Å; K217-L251 HydrophobicContact CB-CD2 3.85Å; K217-L251 HydrophobicContact CB-CG 3.89Å; K217-L251 HydrophobicContact CD-CD2 4.14Å; K217-L251 HydrophobicContact CD-CG 4.05Å; K217-L251 HydrophobicContact CG-CD2 3.82Å; K217-L251 HydrophobicContact CG-CG 4.12Å; M220-L251 HydrophobicContact CE-CD1 4.3Å; M220-L251 HydrophobicContact CE-CD2 3.68Å; Y228-L251 HydrophobicContact CE2-CD2 4.14Å; Y228-L251 WeakPolarHBondContact OH-CD2 3.49Å; A246-L251 CarbonylContact C-O 3.57Å; A246-L251 HydrophobicContact CB-CB 4.07Å; A246-L251 WeakPolarHBondContact O-CA 3.48Å; A246-L251 WeakPolarHBondContact O-CB 3.48Å; A246-L251 PolarHBondContact O-N 2.62Å; V249-L251 HydrophobicContact CG2-CB 4.14Å; V249-L251 HydrophobicContact CG2-CD1 3.92Å; V249-L251 HydrophobicContact CG2-CG 3.91Å; L251-I253 VanDerWaalsContact C-N 3.31Å; L251-I253 HydrophobicContact CB-CD1 4.22Å; L251-I253 HydrophobicContact CB-CG1 4.07Å; L251-I253 HydrophobicContact CB-CG2 4.38Å; L251-I253 HydrophobicContact CD1-CD1 4.05Å; L251-I253 HydrophobicContact CD2-CG2 4.49Å; L251-I253 PolarHBondContact O-N 3.37Å; L251-I253 VanDerWaalsContact O-N 3.14Å
252K92.1Very high94.7Very high213 Ų21359.4 Ų59.493%0.92630%0.301SS*.  trans-87.672.3173.4-65.3-175-179.3-179.80110.3
253I95Very high94.4Very high20 Ų2062.7 Ų62.710%0.10331%0.314CS..  trans-125.4146.2-175.963.2173.7000110.8I128 M213 A230 F232 A246 L251I128-I253 HydrophobicContact CD1-CD1 3.82Å; M213-I253 HydrophobicContact SD-CD1 4.28Å; A230-I253 HydrophobicContact CB-CG2 3.86Å; A230-I253 VanDerWaalsContact O-CB 3.32Å; A230-I253 WeakPolarHBondContact O-CB 3.29Å; A230-I253 WeakPolarHBondContact O-CG2 3.43Å; F232-I253 HydrophobicContact CB-CD1 4.19Å; F232-I253 HydrophobicContact CD1-CD1 3.75Å; F232-I253 HydrophobicContact CD1-CG1 3.88Å; F232-I253 HydrophobicContact CE1-CG1 4.43Å; F232-I253 HydrophobicContact CG-CD1 4.42Å; A246-I253 HydrophobicContact CB-CD1 4.25Å; A246-I253 HydrophobicContact CB-CG1 3.87Å; L251-I253 VanDerWaalsContact C-N 3.31Å; L251-I253 HydrophobicContact CB-CD1 4.22Å; L251-I253 HydrophobicContact CB-CG1 4.07Å; L251-I253 HydrophobicContact CB-CG2 4.38Å; L251-I253 HydrophobicContact CD1-CD1 4.05Å; L251-I253 HydrophobicContact CD2-CG2 4.49Å; L251-I253 PolarHBondContact O-N 3.37Å; L251-I253 VanDerWaalsContact O-N 3.14Å
254D93.3Very high94.1Very high94 Ų9463 Ų6350%0.50331%0.313SS..EExtended strand (participates in β ladder)trans-87.5164.6173-64.4-46000111.5N118 I231 F232N118-D254 WeakPolarHBondContact ND2-CB 3.32Å; I231-D254 HydrophobicContact CG1-CB 4.47Å; I231-D254 WeakPolarHBondContact CG1-O 3.4Å; F232-D254 WeakPolarHBondContact CD1-O 3.4Å; F232-D254 VanDerWaalsContact CE1-C 3.46Å; F232-D254 WeakPolarHBondContact CE1-O 3.34Å; F232-D254 PolarHBondContact N-O 3.39Å
255G95.5Very high94Very high3 Ų363 Ų633%0.03131%0.314CS..EExtended strand (participates in β ladder)trans-110.1149173.400000113N118 F232N118-G255 PolarHBondContact ND2-O 2.96Å; N118-G255 VanDerWaalsContact ND2-O 3.1Å; F232-G255 VanDerWaalsContact CZ-CA 3.44Å; F232-G255 CarbonylContact O-C 3.38Å; F232-G255 VanDerWaalsContact O-CA 3.32Å; F232-G255 WeakPolarHBondContact O-CA 3.22Å
256I95.7Very high93.9Very high4 Ų462.5 Ų62.52%0.02132%0.315CS..EExtended strand (participates in β ladder)trans-116.9118.9165.145.7173.9000111.7P120 R150 F154 I231 F232 T233 S234 I239P120-I256 HydrophobicContact CG-CG2 3.66Å; R150-I256 HydrophobicContact CG-CD1 4.28Å; R150-I256 HydrophobicContact CG-CG1 4.47Å; F154-I256 HydrophobicContact CB-CD1 3.79Å; F154-I256 HydrophobicContact CD2-CD1 4.11Å; F154-I256 HydrophobicContact CG-CD1 4Å; I231-I256 HydrophobicContact CD1-CB 4.38Å; I231-I256 HydrophobicContact CD1-CD1 4.25Å; I231-I256 HydrophobicContact CD1-CG1 4.02Å; I231-I256 HydrophobicContact CD1-CG2 3.68Å; I231-I256 HydrophobicContact CG1-CG1 4.49Å; F232-I256 WeakPolarHBondContact O-CG1 3.46Å; F232-I256 PolarHBondContact O-N 2.96Å; T233-I256 WeakPolarHBondContact CA-O 3.45Å; T233-I256 HydrophobicContact CG2-CD1 3.51Å; T233-I256 HydrophobicContact CG2-CG1 3.47Å; T233-I256 VanDerWaalsContact CG2-CG1 3.47Å; S234-I256 PolarHBondContact N-O 3.46Å; I239-I256 VanDerWaalsContact CD1-C 3.48Å; I239-I256 WeakPolarHBondContact CD1-O 3.35Å
257G94.6Very high93.7Very high24 Ų2462.5 Ų62.525%0.24732%0.315CS..EExtended strand (participates in β ladder)trans-75.5133.1178.700000113.1S234S234-G257 CarbonylContact O-C 3.51Å
258S94.2Very high93.6Very high3 Ų355.7 Ų55.72%0.02128%0.283CS..EExtended strand (participates in β ladder)trans-86.4153163.862.20000111K146 S234 N235 N236K146-S258 WeakPolarHBondContact O-CB 3.46Å; S234-S258 WeakPolarHBondContact O-CB 3.22Å; S234-S258 PolarHBondContact O-N 2.98Å; S234-S258 PolarHBondContact O-OG 3.49Å; N235-S258 WeakPolarHBondContact CA-OG 3.39Å; N235-S258 PolarHBondContact ND2-OG 3.26Å; N235-S258 VanDerWaalsContact ND2-OG 3.12Å; N236-S258 VanDerWaalsContact CB-O 3.32Å; N236-S258 WeakPolarHBondContact CB-O 3.35Å; N236-S258 PolarHBondContact N-O 3.47Å
259K91.8Very high93.5Very high183 Ų18351.4 Ų51.480%0.79626%0.26SS*.PPolyproline II helixtrans-67.4134.8179.8-68.7-177.5-179.9174.60110.7
260T89.8Confident93.4Very high15 Ų1551 Ų519%0.09226%0.256CS..  trans-111.8149.2173.4-56.20000109.9L143 N236 Y237 R262 Y264 L265L143-T260 HydrophobicContact CD2-CG2 4.12Å; N236-T260 VanDerWaalsContact OD1-CB 3.26Å; N236-T260 WeakPolarHBondContact OD1-CB 3.44Å; N236-T260 PolarHBondContact OD1-OG1 3.41Å; Y237-T260 HydrophobicContact CD1-CG2 3.82Å; Y237-T260 WeakPolarHBondContact CD1-OG1 3.39Å; Y237-T260 HydrophobicContact CE1-CG2 3.67Å; T260-R262 PolarHBondContact O-N 2.91Å; T260-Y264 HydrophobicContact CG2-CD1 3.8Å; T260-L265 HydrophobicContact CG2-CD2 4.02Å; T260-L265 HydrophobicContact CG2-CG 4.48Å
261A89.3Confident93.3Very high46 Ų4652.4 Ų52.438%0.3825%0.247SC..  trans-56.8128.6174.200000111.2Y263 Y264 L265A261-Y263 VanDerWaalsContact C-N 3.26Å; A261-Y263 HydrophobicContact CB-CD1 3.77Å; A261-Y263 HydrophobicContact CB-CE1 3.48Å; A261-Y263 VanDerWaalsContact CB-CE1 3.48Å; A261-Y263 PolarHBondContact O-N 3.49Å; A261-Y264 PolarHBondContact O-N 3.1Å; A261-L265 PolarHBondContact O-N 2.71Å
262R91Very high93.4Very high224 Ų22452.1 Ų52.185%0.84525%0.245SC*.THydrogen-bonded Turntrans-59-35.5-172.6-67.6-179-178.9169.6-0.9113.2T260 Y264 L265T260-R262 PolarHBondContact O-N 2.91Å; R262-Y264 PolarHBondContact O-N 3Å; R262-L265 PolarHBondContact O-N 3.33Å
263Y90.8Very high93.6Very high69 Ų6942.9 Ų42.927%0.27121%0.205SC..THydrogen-bonded Turntrans-65.1-28.4178.876.7-96.2000112.6N45 I48 V49 H52 E53 A261N45-Y263 PolarHBondContact ND2-O 3.39Å; I48-Y263 HydrophobicContact CG2-CD2 4.23Å; I48-Y263 HydrophobicContact CG2-CG 4.13Å; V49-Y263 HydrophobicContact CG2-CD2 4.2Å; H52-Y263 HydrophobicContact CB-CE2 3.86Å; E53-Y263 HydrophobicContact CG-CE2 4.25Å; E53-Y263 PolarHBondContact OE1-OH 3.4Å; A261-Y263 VanDerWaalsContact C-N 3.26Å; A261-Y263 HydrophobicContact CB-CD1 3.77Å; A261-Y263 HydrophobicContact CB-CE1 3.48Å; A261-Y263 VanDerWaalsContact CB-CE1 3.48Å; A261-Y263 PolarHBondContact O-N 3.49Å
264Y91Very high93.6Very high15 Ų1545.1 Ų45.16%0.05922%0.216CC..THydrogen-bonded Turntrans-86-22.4-177.2-173.4-113.5000112.5E53 L143 Y237 T260 A261 R262 N267 A268E53-Y264 HydrophobicContact CG-CD2 4.32Å; E53-Y264 HydrophobicContact CG-CE2 4.5Å; L143-Y264 HydrophobicContact CD1-CE1 4.29Å; Y237-Y264 HydrophobicContact CE1-CD1 4.27Å; Y237-Y264 HydrophobicContact CE1-CE1 4.05Å; T260-Y264 HydrophobicContact CG2-CD1 3.8Å; A261-Y264 PolarHBondContact O-N 3.1Å; R262-Y264 PolarHBondContact O-N 3Å; Y264-N267 PolarHBondContact O-N 2.85Å; Y264-A268 HydrophobicContact CD1-CB 3.85Å; Y264-A268 HydrophobicContact CE1-CB 3.72Å; Y264-A268 WeakPolarHBondContact O-CB 3.36Å; Y264-A268 PolarHBondContact O-N 3.37Å
265L93.2Very high93.8Very high37 Ų3741.7 Ų41.719%0.19420%0.201CC..Hα-helixtrans-54.3-47.1-175.4-74.8175.7000114.5Y237 T260 A261 R262 N267 A268 F269Y237-L265 HydrophobicContact CD1-CD2 4.35Å; T260-L265 HydrophobicContact CG2-CD2 4.02Å; T260-L265 HydrophobicContact CG2-CG 4.48Å; A261-L265 PolarHBondContact O-N 2.71Å; R262-L265 PolarHBondContact O-N 3.33Å; L265-N267 PolarHBondContact O-N 2.99Å; L265-A268 PolarHBondContact O-N 2.87Å; L265-F269 HydrophobicContact CB-CD2 4.37Å; L265-F269 HydrophobicContact CB-CE2 4.49Å; L265-F269 HydrophobicContact CD2-CD2 4.47Å; L265-F269 HydrophobicContact CD2-CE2 3.98Å; L265-F269 VanDerWaalsContact O-CD2 3.3Å; L265-F269 WeakPolarHBondContact O-CD2 3.18Å; L265-F269 PolarHBondContact O-N 3.29Å
266P93.6Very high93.8Very high29 Ų2942.4 Ų42.419%0.18821%0.205CC..Hα-helixtrans-61-45.6-177.4-24.636.4000112.1F41 T62 L270F41-P266 HydrophobicContact CE1-CB 4.06Å; F41-P266 HydrophobicContact CE1-CG 4.09Å; F41-P266 HydrophobicContact CZ-CB 4.07Å; F41-P266 HydrophobicContact CZ-CG 3.58Å; T62-P266 HydrophobicContact CG2-CB 4.31Å; P266-L270 WeakPolarHBondContact O-CB 3.3Å; P266-L270 PolarHBondContact O-N 2.92Å
267N93.7Very high93.8Very high0 Ų042.9 Ų42.90%021%0.209CC..Hα-helixtrans-67.1-39.6177.4-172.976.6000111.9V49 P58 L61 T62 Y264 L265 L270 R271V49-N267 HydrophobicContact CG2-CB 4.34Å; P58-N267 PolarHBondContact O-ND2 3.16Å; P58-N267 PolarHBondContact O-OD1 3.02Å; L61-N267 PolarHBondContact N-OD1 3.44Å; T62-N267 HydrophobicContact CG2-CB 3.94Å; Y264-N267 PolarHBondContact O-N 2.85Å; L265-N267 PolarHBondContact O-N 2.99Å; N267-L270 PolarHBondContact O-N 2.87Å; N267-R271 WeakPolarHBondContact O-CB 3.37Å; N267-R271 PolarHBondContact O-N 3.36Å
268A93.8Very high93.8Very high0 Ų047 Ų470%023%0.225CC..Hα-helixtrans-62.5-48.8176.500000112.1Y237 Y264 L265 L270 R271 E272Y237-A268 HydrophobicContact CD1-CB 3.63Å; Y237-A268 HydrophobicContact CD2-CB 3.88Å; Y237-A268 HydrophobicContact CE1-CB 3.9Å; Y237-A268 HydrophobicContact CE2-CB 4.18Å; Y237-A268 HydrophobicContact CG-CB 3.61Å; Y264-A268 HydrophobicContact CD1-CB 3.85Å; Y264-A268 HydrophobicContact CE1-CB 3.72Å; Y264-A268 WeakPolarHBondContact O-CB 3.36Å; Y264-A268 PolarHBondContact O-N 3.37Å; L265-A268 PolarHBondContact O-N 2.87Å; A268-L270 VanDerWaalsContact C-N 3.32Å; A268-L270 PolarHBondContact O-N 2.94Å; A268-R271 WeakPolarHBondContact O-CB 3.19Å; A268-R271 PolarHBondContact O-N 3.39Å; A268-E272 WeakPolarHBondContact O-CG 3.42Å; A268-E272 PolarHBondContact O-N 3.02Å
269F95.4Very high93.8Very high18 Ų1850 Ų508%0.07924%0.24CC..Hα-helixtrans-63.1-37.1177.1-84.4-66.2000112.6F108 L109 L265 R271 E272 F273F108-F269 HydrophobicContact CE1-CD1 4.06Å; F108-F269 HydrophobicContact CZ-CD1 4.41Å; L109-F269 HydrophobicContact CD1-CD1 4.19Å; L109-F269 HydrophobicContact CD1-CE1 4.38Å; L109-F269 HydrophobicContact CD1-CG 4.3Å; L265-F269 HydrophobicContact CB-CD2 4.37Å; L265-F269 HydrophobicContact CB-CE2 4.49Å; L265-F269 HydrophobicContact CD2-CD2 4.47Å; L265-F269 HydrophobicContact CD2-CE2 3.98Å; L265-F269 VanDerWaalsContact O-CD2 3.3Å; L265-F269 WeakPolarHBondContact O-CD2 3.18Å; L265-F269 PolarHBondContact O-N 3.29Å; F269-R271 VanDerWaalsContact C-N 3.34Å; F269-E272 PolarHBondContact O-N 3.06Å; F269-F273 VanDerWaalsContact O-CB 3.32Å; F269-F273 WeakPolarHBondContact O-CB 3.33Å; F269-F273 PolarHBondContact O-N 3.45Å
270L95.3Very high93.9Very high17 Ų1744.9 Ų44.99%0.08922%0.221CC..Hα-helixtrans-64.8-40.4175-175.256.5000111.5L61 T62 L65 P266 N267 A268 F273 I274L61-L270 VanDerWaalsContact C-CD2 3.48Å; L61-L270 HydrophobicContact CB-CD2 3.56Å; L61-L270 HydrophobicContact CB-CG 3.99Å; L61-L270 WeakPolarHBondContact O-CD2 3.36Å; T62-L270 HydrophobicContact CG2-CD2 4.33Å; L65-L270 HydrophobicContact CB-CD2 4.12Å; L65-L270 HydrophobicContact CD2-CD1 4.14Å; L65-L270 HydrophobicContact CD2-CD2 3.89Å; P266-L270 WeakPolarHBondContact O-CB 3.3Å; P266-L270 PolarHBondContact O-N 2.92Å; N267-L270 PolarHBondContact O-N 2.87Å; A268-L270 VanDerWaalsContact C-N 3.32Å; A268-L270 PolarHBondContact O-N 2.94Å; L270-F273 HydrophobicContact CD1-CD1 4.24Å; L270-F273 PolarHBondContact O-N 2.83Å; L270-I274 HydrophobicContact CG-CD1 4.37Å; L270-I274 VanDerWaalsContact O-CG1 3.3Å; L270-I274 WeakPolarHBondContact O-CG1 3.4Å; L270-I274 PolarHBondContact O-N 3.32Å
271R95.7Very high94.2Very high79 Ų7950 Ų5030%0.29824%0.242SC..Hα-helixtrans-62.3-45.2174.3-171177.666.8161.10.2112L61 N267 A268 F269 I274 A275L61-R271 HydrophobicContact CD1-CB 3.63Å; L61-R271 HydrophobicContact CD1-CG 4.1Å; N267-R271 WeakPolarHBondContact O-CB 3.37Å; N267-R271 PolarHBondContact O-N 3.36Å; A268-R271 WeakPolarHBondContact O-CB 3.19Å; A268-R271 PolarHBondContact O-N 3.39Å; F269-R271 VanDerWaalsContact C-N 3.34Å; R271-I274 PolarHBondContact O-N 3.26Å; R271-A275 PolarHBondContact O-N 3.02Å
272E96Very high94.6Very high2 Ų257.7 Ų57.71%0.00926%0.261CS..Hα-helixtrans-65.2-40.8177.4-65.7-59.6125.800111.8F108 Y237 H238 R241 A268 F269 I274 A275 V276F108-E272 HydrophobicContact CE2-CB 4.4Å; F108-E272 HydrophobicContact CZ-CB 3.67Å; Y237-E272 HydrophobicContact CD2-CG 3.66Å; Y237-E272 HydrophobicContact CE2-CG 4.39Å; Y237-E272 WeakPolarHBondContact O-CG 3.39Å; H238-E272 IonicContact CE1-OE2 3.5Å; H238-E272 IonicContact CG-OE2 2.68Å; H238-E272 IonicContact ND1-OE1 3.86Å; H238-E272 PolarHBondContact ND1-OE1 3.41Å; H238-E272 IonicContact ND1-OE2 3.27Å; H238-E272 PolarHBondContact ND1-OE2 3.09Å; R241-E272 IonicContact CZ-OE1 3.79Å; R241-E272 IonicContact CZ-OE2 3.01Å; R241-E272 VanDerWaalsContact CZ-OE2 3.27Å; R241-E272 IonicContact NE-OE1 3.96Å; R241-E272 IonicContact NE-OE2 3.65Å; R241-E272 PolarHBondContact NE-OE2 2.86Å; R241-E272 VanDerWaalsContact NH2-CD 3.27Å; R241-E272 IonicContact NH2-OE1 2.82Å; R241-E272 PolarHBondContact NH2-OE1 2.93Å; R241-E272 IonicContact NH2-OE2 2.71Å; R241-E272 PolarHBondContact NH2-OE2 3.42Å; A268-E272 WeakPolarHBondContact O-CG 3.42Å; A268-E272 PolarHBondContact O-N 3.02Å; F269-E272 PolarHBondContact O-N 3.06Å; E272-I274 PolarHBondContact O-N 3.1Å; E272-A275 WeakPolarHBondContact O-CB 3.25Å; E272-A275 PolarHBondContact O-N 2.99Å; E272-V276 WeakPolarHBondContact O-CG2 3.46Å; E272-V276 PolarHBondContact O-N 3.03Å
273F96.8Very high94.9Very high19 Ų1951.8 Ų51.88%0.08325%0.246CC..Hα-helixtrans-57.9-48.1174.4169.2-111.7000111.8F101 V104 F105 F108 F269 L270 A275 V276 A277F101-F273 HydrophobicContact CB-CZ 4.46Å; F101-F273 HydrophobicContact CD1-CE1 4.43Å; F101-F273 AromaticContact CD1-CZ 3.92Å; F101-F273 HydrophobicContact CD1-CZ 3.92Å; V104-F273 HydrophobicContact CB-CE2 4.22Å; V104-F273 HydrophobicContact CB-CZ 4.48Å; V104-F273 HydrophobicContact CG1-CE2 3.88Å; V104-F273 HydrophobicContact CG1-CZ 4.46Å; F105-F273 VanDerWaalsContact CA-CE2 3.45Å; F105-F273 HydrophobicContact CB-CD2 4.16Å; F105-F273 HydrophobicContact CB-CE1 4.27Å; F105-F273 HydrophobicContact CB-CE2 3.81Å; F105-F273 HydrophobicContact CB-CZ 3.84Å; F105-F273 HydrophobicContact CD2-CB 3.83Å; F105-F273 AromaticContact CD2-CD1 3.89Å; F105-F273 HydrophobicContact CD2-CD1 3.89Å; F105-F273 AromaticContact CD2-CD2 3.84Å; F105-F273 HydrophobicContact CD2-CD2 3.84Å; F105-F273 HydrophobicContact CD2-CE1 4.37Å; F105-F273 HydrophobicContact CD2-CE2 4.32Å; F105-F273 AromaticContact CD2-CG 3.57Å; F105-F273 HydrophobicContact CD2-CG 3.57Å; F105-F273 HydrophobicContact CE2-CB 4.11Å; F105-F273 HydrophobicContact CE2-CG 4.34Å; F108-F273 HydrophobicContact CB-CD2 4.03Å; F108-F273 HydrophobicContact CD1-CB 3.86Å; F108-F273 HydrophobicContact CD1-CD2 4.07Å; F108-F273 HydrophobicContact CD1-CG 4.43Å; F108-F273 HydrophobicContact CE1-CB 3.83Å; F108-F273 HydrophobicContact CG-CB 4.4Å; F108-F273 AromaticContact CG-CD2 4Å; F108-F273 HydrophobicContact CG-CD2 4Å; F108-F273 HydrophobicContact CZ-CB 4.33Å; F269-F273 VanDerWaalsContact O-CB 3.32Å; F269-F273 WeakPolarHBondContact O-CB 3.33Å; F269-F273 PolarHBondContact O-N 3.45Å; L270-F273 HydrophobicContact CD1-CD1 4.24Å; L270-F273 PolarHBondContact O-N 2.83Å; F273-A275 VanDerWaalsContact C-N 3.28Å; F273-A275 PolarHBondContact O-N 3.45Å; F273-V276 PolarHBondContact O-N 3.3Å; F273-A277 WeakPolarHBondContact O-CB 3.47Å; F273-A277 PolarHBondContact O-N 3.11Å
274I96.3Very high95.2Very high66 Ų6649.4 Ų49.434%0.33824%0.237SC..Hα-helixtrans-59.6-43.2177.4-69167.1000110.1L61 L270 R271 E272 A277 L278L61-I274 HydrophobicContact CD1-CD1 4Å; L61-I274 HydrophobicContact CD2-CD1 3.79Å; L61-I274 HydrophobicContact CG-CD1 4.42Å; L270-I274 HydrophobicContact CG-CD1 4.37Å; L270-I274 VanDerWaalsContact O-CG1 3.3Å; L270-I274 WeakPolarHBondContact O-CG1 3.4Å; L270-I274 PolarHBondContact O-N 3.32Å; R271-I274 PolarHBondContact O-N 3.26Å; E272-I274 PolarHBondContact O-N 3.1Å; I274-A277 PolarHBondContact O-N 2.73Å; I274-L278 HydrophobicContact CG2-CD1 3.88Å; I274-L278 HydrophobicContact CG2-CG 4.35Å; I274-L278 WeakPolarHBondContact O-CB 3.33Å; I274-L278 VanDerWaalsContact O-CG 3.22Å; I274-L278 WeakPolarHBondContact O-CG 3.36Å; I274-L278 PolarHBondContact O-N 2.86Å
275A95.7Very high95.5Very high22 Ų2254.6 Ų54.618%0.18227%0.265CS..Hα-helixtrans-61.6-47.1177.900000112.2R271 E272 F273 L278 M279R271-A275 PolarHBondContact O-N 3.02Å; E272-A275 WeakPolarHBondContact O-CB 3.25Å; E272-A275 PolarHBondContact O-N 2.99Å; F273-A275 VanDerWaalsContact C-N 3.28Å; F273-A275 PolarHBondContact O-N 3.45Å; A275-L278 PolarHBondContact O-N 2.97Å; A275-M279 WeakPolarHBondContact O-CG 3.47Å; A275-M279 PolarHBondContact O-N 3.19Å
276V95.9Very high95.7Very high18 Ų1857.8 Ų57.811%0.10928%0.282CS..Hα-helixtrans-65.5-39.3177.8173.90000111.8F108 F240 R241 M244 E272 F273 L278 M279 N280F108-V276 HydrophobicContact CD2-CB 4.32Å; F108-V276 HydrophobicContact CD2-CG1 4.41Å; F108-V276 HydrophobicContact CD2-CG2 4.25Å; F108-V276 HydrophobicContact CE2-CB 4.32Å; F108-V276 HydrophobicContact CE2-CG2 3.85Å; F240-V276 HydrophobicContact CE1-CG1 4.42Å; R241-V276 HydrophobicContact CB-CG2 4.06Å; R241-V276 HydrophobicContact CG-CG2 4.12Å; M244-V276 HydrophobicContact CE-CG1 4.4Å; M244-V276 HydrophobicContact SD-CG1 4.13Å; M244-V276 HydrophobicContact SD-CG2 4.11Å; E272-V276 WeakPolarHBondContact O-CG2 3.46Å; E272-V276 PolarHBondContact O-N 3.03Å; F273-V276 PolarHBondContact O-N 3.3Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 2.74Å; V276-M279 WeakPolarHBondContact O-CB 3.32Å; V276-M279 PolarHBondContact O-N 3.43Å; V276-N280 PolarHBondContact O-N 3.19Å; V276-N280 PolarHBondContact O-ND2 3.48Å
277A95.7Very high95.9Very high14 Ų1458.2 Ų58.212%0.11628%0.283CS..Hα-helixtrans-62.6-4017400000111.1F273 I274 M279 N280 K281 H284F273-A277 WeakPolarHBondContact O-CB 3.47Å; F273-A277 PolarHBondContact O-N 3.11Å; I274-A277 PolarHBondContact O-N 2.73Å; A277-M279 VanDerWaalsContact C-N 3.33Å; A277-M279 PolarHBondContact O-N 2.92Å; A277-N280 CarbonylContact O-C 3.54Å; A277-N280 VanDerWaalsContact O-C 3.28Å; A277-N280 PolarHBondContact O-N 3.18Å; A277-N280 VanDerWaalsContact O-N 3.11Å; A277-K281 PolarHBondContact O-N 3.06Å; A277-K281 VanDerWaalsContact O-N 3.1Å; A277-H284 PolarHBondContact O-CD2 2.88Å
278L96Very high96.1Very high110 Ų11059.3 Ų59.358%0.57629%0.291SS*.Hα-helixtrans-67.5-30.8177.2-73.1172.2000113.2I274 A275 V276 N280 K281I274-L278 HydrophobicContact CG2-CD1 3.88Å; I274-L278 HydrophobicContact CG2-CG 4.35Å; I274-L278 WeakPolarHBondContact O-CB 3.33Å; I274-L278 VanDerWaalsContact O-CG 3.22Å; I274-L278 WeakPolarHBondContact O-CG 3.36Å; I274-L278 PolarHBondContact O-N 2.86Å; A275-L278 PolarHBondContact O-N 2.97Å; V276-L278 VanDerWaalsContact C-N 3.31Å; V276-L278 PolarHBondContact O-N 2.74Å; L278-N280 PolarHBondContact O-N 2.86Å; L278-K281 WeakPolarHBondContact O-CB 3.33Å; L278-K281 PolarHBondContact O-N 2.91Å
279M93.9Very high96.3Very high67 Ų6761 Ų6133%0.3331%0.309SS..Hα-helixtrans-59.9-34.4171.6-66.7169.271.500111.2R241 M244 Y245 A275 V276 A277R241-M279 HydrophobicContact CG-SD 4.24Å; M244-M279 HydrophobicContact CB-CE 4.34Å; M244-M279 HydrophobicContact CE-CE 3.73Å; M244-M279 HydrophobicContact CE-SD 4.22Å; M244-M279 HydrophobicContact SD-CE 4.46Å; Y245-M279 HydrophobicContact CD1-CE 4.31Å; Y245-M279 HydrophobicContact CE1-CE 3.78Å; Y245-M279 HydrophobicContact CE1-SD 4.34Å; A275-M279 WeakPolarHBondContact O-CG 3.47Å; A275-M279 PolarHBondContact O-N 3.19Å; V276-M279 WeakPolarHBondContact O-CB 3.32Å; V276-M279 PolarHBondContact O-N 3.43Å; A277-M279 VanDerWaalsContact C-N 3.33Å; A277-M279 PolarHBondContact O-N 2.92Å
280N93.3Very high96.5Very high76 Ų7665.5 Ų65.541%0.40633%0.333SS..THydrogen-bonded Turntrans-105.826.5179.3-65.2-76.6000113.2V276 A277 L278 R282 L283 H284V276-N280 PolarHBondContact O-N 3.19Å; V276-N280 PolarHBondContact O-ND2 3.48Å; A277-N280 CarbonylContact O-C 3.54Å; A277-N280 VanDerWaalsContact O-C 3.28Å; A277-N280 PolarHBondContact O-N 3.18Å; A277-N280 VanDerWaalsContact O-N 3.11Å; L278-N280 PolarHBondContact O-N 2.86Å; N280-R282 PolarHBondContact O-N 3.12Å; N280-L283 WeakPolarHBondContact O-CB 3.25Å; N280-L283 PolarHBondContact O-N 2.94Å; N280-H284 PolarHBondContact O-CD2 2.98Å; N280-H284 VanDerWaalsContact O-CD2 3.32Å; N280-H284 PolarHBondContact O-N 3.29Å
281K96.3Very high96.6Very high123 Ų12366.2 Ų66.254%0.53534%0.336SS..Hα-helixtrans-51.9-35.2-171.564.3-173.4178.5-174.60114.7A277 L278 L283 H284 L285A277-K281 PolarHBondContact O-N 3.06Å; A277-K281 VanDerWaalsContact O-N 3.1Å; L278-K281 WeakPolarHBondContact O-CB 3.33Å; L278-K281 PolarHBondContact O-N 2.91Å; K281-L283 PolarHBondContact O-N 2.96Å; K281-H284 PolarHBondContact O-N 3.45Å; K281-L285 WeakPolarHBondContact O-CB 3.48Å; K281-L285 WeakPolarHBondContact O-CG 3.15Å; K281-L285 PolarHBondContact O-N 3.03Å
282R97Very high96.7Very high207 Ų20765 Ų6578%0.78134%0.338SS*.Hα-helixtrans-61.5-45.2-179.8-68.5-176.9-179.3173.91.2111.3N280 L285 I286N280-R282 PolarHBondContact O-N 3.12Å; R282-L285 PolarHBondContact O-N 3.43Å; R282-I286 WeakPolarHBondContact O-CD1 3.33Å; R282-I286 VanDerWaalsContact O-CG1 3.25Å; R282-I286 WeakPolarHBondContact O-CG1 3.3Å; R282-I286 PolarHBondContact O-N 3.43Å
283L96.7Very high96.8Very high99 Ų9972 Ų7252%0.51837%0.369SS..Hα-helixtrans-61.3-49.2177.4176.463.9000110.7N280 K281 L285 I286 V287N280-L283 WeakPolarHBondContact O-CB 3.25Å; N280-L283 PolarHBondContact O-N 2.94Å; K281-L283 PolarHBondContact O-N 2.96Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 2.88Å; L283-I286 PolarHBondContact O-N 3.48Å; L283-V287 HydrophobicContact CD1-CG2 4.35Å; L283-V287 WeakPolarHBondContact O-CG2 3.35Å; L283-V287 PolarHBondContact O-N 3.22Å
284H97.2Very high96.8Very high19 Ų1972.6 Ų72.69%0.08838%0.38CS..Hα-helixtrans-65.2-37.5-178.8-59.9-56.2000112.5Y100 F101 A277 N280 K281 V287 C288Y100-H284 AromaticContact CE1-ND1 3.8Å; Y100-H284 AromaticContact CZ-ND1 3.7Å; Y100-H284 PolarHBondContact OH-ND1 3.23Å; F101-H284 HydrophobicContact CE1-CB 4.36Å; F101-H284 HydrophobicContact CZ-CB 4.21Å; A277-H284 PolarHBondContact O-CD2 2.88Å; N280-H284 PolarHBondContact O-CD2 2.98Å; N280-H284 VanDerWaalsContact O-CD2 3.32Å; N280-H284 PolarHBondContact O-N 3.29Å; K281-H284 PolarHBondContact O-N 3.45Å; H284-V287 PolarHBondContact O-N 3.07Å; H284-C288 WeakPolarHBondContact O-CB 3.49Å; H284-C288 PolarHBondContact O-N 3.24Å; H284-C288 PolarHBondContact O-SG 3.43Å
285L97.6Very high96.8Very high124 Ų12471.4 Ų71.465%0.64937%0.373SS*.Hα-helixtrans-63.4-41.8174.3-74.7171.5000111.8K281 R282 L283 G289K281-L285 WeakPolarHBondContact O-CB 3.48Å; K281-L285 WeakPolarHBondContact O-CG 3.15Å; K281-L285 PolarHBondContact O-N 3.03Å; R282-L285 PolarHBondContact O-N 3.43Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 2.88Å; L285-G289 PolarHBondContact O-N 3.46Å
286I98.2Very high96.8Very high105 Ų10573.1 Ų73.154%0.53838%0.381SS..Hα-helixtrans-62.8-49.6176.2-69164.1000110.3R282 L283 C288 G289 L290R282-I286 WeakPolarHBondContact O-CD1 3.33Å; R282-I286 VanDerWaalsContact O-CG1 3.25Å; R282-I286 WeakPolarHBondContact O-CG1 3.3Å; R282-I286 PolarHBondContact O-N 3.43Å; L283-I286 PolarHBondContact O-N 3.48Å; I286-C288 PolarHBondContact O-N 2.72Å; I286-G289 PolarHBondContact O-N 2.82Å; I286-L290 HydrophobicContact CG2-CD1 4.03Å; I286-L290 HydrophobicContact CG2-CG 4.43Å; I286-L290 WeakPolarHBondContact O-CG 3.44Å; I286-L290 PolarHBondContact O-N 3.37Å
287V97.8Very high96.8Very high37 Ų3774 Ų7422%0.22439%0.39CS..Hα-helixtrans-62.7-45.1-179.4176.40000111.4Y100 L283 H284 G289 L290 I291Y100-V287 HydrophobicContact CD1-CG1 4.32Å; Y100-V287 HydrophobicContact CD2-CG1 3.98Å; Y100-V287 HydrophobicContact CE1-CB 4.38Å; Y100-V287 HydrophobicContact CE1-CG1 4.08Å; Y100-V287 HydrophobicContact CE2-CB 4.43Å; Y100-V287 HydrophobicContact CE2-CG1 3.72Å; Y100-V287 HydrophobicContact CG-CG1 4.26Å; L283-V287 HydrophobicContact CD1-CG2 4.35Å; L283-V287 WeakPolarHBondContact O-CG2 3.35Å; L283-V287 PolarHBondContact O-N 3.22Å; H284-V287 PolarHBondContact O-N 3.07Å; V287-G289 VanDerWaalsContact C-N 3.3Å; V287-G289 PolarHBondContact O-N 2.94Å; V287-L290 PolarHBondContact O-N 3.23Å; V287-I291 HydrophobicContact CG1-CD1 3.91Å; V287-I291 WeakPolarHBondContact O-CG1 3.46Å; V287-I291 PolarHBondContact O-N 3.15Å
288C97.9Very high96.7Very high23 Ų2377.8 Ų77.816%0.15541%0.408CS..Hα-helixtrans-62.9-38.5175.8-66.20000111.8I97 H284 I286 T292I97-C288 HydrophobicContact CD1-CB 4.29Å; H284-C288 WeakPolarHBondContact O-CB 3.49Å; H284-C288 PolarHBondContact O-N 3.24Å; H284-C288 PolarHBondContact O-SG 3.43Å; I286-C288 PolarHBondContact O-N 2.72Å; C288-T292 WeakPolarHBondContact O-CB 3.48Å; C288-T292 PolarHBondContact O-N 2.96Å; C288-T292 PolarHBondContact O-OG1 3.26Å
289G98Very high96.6Very high37 Ų3772.8 Ų72.838%0.38138%0.382SS..Hα-helixtrans-61.9-45.2174.700000112.2L285 I286 V287 T292 F293L285-G289 PolarHBondContact O-N 3.46Å; I286-G289 PolarHBondContact O-N 2.82Å; V287-G289 VanDerWaalsContact C-N 3.3Å; V287-G289 PolarHBondContact O-N 2.94Å; G289-T292 PolarHBondContact O-N 3.36Å; G289-F293 VanDerWaalsContact O-CB 3.25Å; G289-F293 WeakPolarHBondContact O-CB 3.28Å; G289-F293 PolarHBondContact O-N 3.46Å
290L98.3Very high96.5Very high112 Ų11274 Ų7459%0.58639%0.388SS*.Hα-helixtrans-64.9-43.6177.2-70172.3000112.3I286 V287 F293 G294I286-L290 HydrophobicContact CG2-CD1 4.03Å; I286-L290 HydrophobicContact CG2-CG 4.43Å; I286-L290 WeakPolarHBondContact O-CG 3.44Å; I286-L290 PolarHBondContact O-N 3.37Å; V287-L290 PolarHBondContact O-N 3.23Å; L290-F293 PolarHBondContact O-N 3.03Å; L290-G294 PolarHBondContact O-N 3.44Å
291I97.8Very high96.5Very high31 Ų3174.6 Ų74.616%0.15939%0.391CS..Hα-helixtrans-58.7-50174.6-69.5165.2000109.9T96 I97 V287 G294 F295T96-I291 HydrophobicContact CG2-CD1 4.3Å; T96-I291 HydrophobicContact CG2-CG1 4.43Å; T96-I291 HydrophobicContact CG2-CG2 3.84Å; I97-I291 HydrophobicContact CG1-CD1 4.34Å; I97-I291 HydrophobicContact CG1-CG2 4.04Å; V287-I291 HydrophobicContact CG1-CD1 3.91Å; V287-I291 WeakPolarHBondContact O-CG1 3.46Å; V287-I291 PolarHBondContact O-N 3.15Å; I291-G294 PolarHBondContact O-N 3.37Å; I291-F295 HydrophobicContact CG2-CD2 3.86Å; I291-F295 HydrophobicContact CG2-CE2 3.91Å; I291-F295 VanDerWaalsContact O-CD2 3.3Å; I291-F295 WeakPolarHBondContact O-CD2 3.32Å; I291-F295 PolarHBondContact O-N 3.11Å; I291-F295 VanDerWaalsContact O-N 3.11Å
292T97.8Very high96.2Very high54 Ų5470.6 Ų70.633%0.33138%0.376SS..Hα-helixtrans-61.2-48.6-179.3-57.10000110.9I93 C288 G289 G294 F295 V296I93-T292 HydrophobicContact CD1-CG2 4.31Å; C288-T292 WeakPolarHBondContact O-CB 3.48Å; C288-T292 PolarHBondContact O-N 2.96Å; C288-T292 PolarHBondContact O-OG1 3.26Å; G289-T292 PolarHBondContact O-N 3.36Å; T292-G294 PolarHBondContact O-N 2.9Å; T292-F295 PolarHBondContact O-N 2.87Å; T292-V296 HydrophobicContact CG2-CG2 4.34Å; T292-V296 WeakPolarHBondContact O-CB 3.26Å; T292-V296 VanDerWaalsContact O-CG2 3.26Å; T292-V296 WeakPolarHBondContact O-CG2 3.25Å; T292-V296 PolarHBondContact O-N 3.23Å
293F97.9Very high95.8Very high150 Ų15065.4 Ų65.466%0.65836%0.359SS*.Hα-helixtrans-58.2-46.2177.8177.2-99.1000111.9G289 L290 F295 V296 A297G289-F293 VanDerWaalsContact O-CB 3.25Å; G289-F293 WeakPolarHBondContact O-CB 3.28Å; G289-F293 PolarHBondContact O-N 3.46Å; L290-F293 PolarHBondContact O-N 3.03Å; F293-F295 PolarHBondContact O-N 3.22Å; F293-V296 PolarHBondContact O-N 2.9Å; F293-A297 WeakPolarHBondContact O-CB 3.36Å; F293-A297 PolarHBondContact O-N 3.45Å
294G97Very high95.6Very high31 Ų3165.9 Ų65.932%0.3236%0.362SS..Hα-helixtrans-58.8-47.4178.700000112.8L290 I291 T292 A297 L298L290-G294 PolarHBondContact O-N 3.44Å; I291-G294 PolarHBondContact O-N 3.37Å; T292-G294 PolarHBondContact O-N 2.9Å; G294-A297 PolarHBondContact O-N 3.09Å; G294-L298 WeakPolarHBondContact O-CG 3.43Å; G294-L298 PolarHBondContact O-N 2.86Å
295F96.5Very high95.1Very high41 Ų4172.6 Ų72.618%0.1839%0.391CS..Hα-helixtrans-70.1-35.3177.8-80.4-66.4000113.6I89 I93 T96 I291 T292 F293 L298 A299I89-F295 HydrophobicContact CG2-CD1 3.8Å; I93-F295 HydrophobicContact CD1-CB 3.89Å; I93-F295 HydrophobicContact CG1-CB 3.41Å; I93-F295 VanDerWaalsContact CG1-CB 3.41Å; I93-F295 HydrophobicContact CG1-CD2 3.82Å; I93-F295 HydrophobicContact CG1-CG 3.83Å; T96-F295 HydrophobicContact CG2-CE2 4Å; T96-F295 VanDerWaalsContact OG1-CE2 3.25Å; T96-F295 WeakPolarHBondContact OG1-CE2 3.2Å; T96-F295 WeakPolarHBondContact OG1-CZ 3.25Å; I291-F295 HydrophobicContact CG2-CD2 3.86Å; I291-F295 HydrophobicContact CG2-CE2 3.91Å; I291-F295 VanDerWaalsContact O-CD2 3.3Å; I291-F295 WeakPolarHBondContact O-CD2 3.32Å; I291-F295 PolarHBondContact O-N 3.11Å; I291-F295 VanDerWaalsContact O-N 3.11Å; T292-F295 PolarHBondContact O-N 2.87Å; F293-F295 PolarHBondContact O-N 3.22Å; F295-L298 HydrophobicContact CD1-CD1 4.34Å; F295-L298 PolarHBondContact O-N 3.39Å; F295-A299 WeakPolarHBondContact O-CB 3.34Å; F295-A299 PolarHBondContact O-N 3.47Å
296V95.9Very high93.9Very high58 Ų5871.3 Ų71.335%0.35239%0.388SS..Hα-helixtrans-64.3-44.5174.4169.50000110.5L90 I93 T292 F293 L298 A299 I300L90-V296 HydrophobicContact CD2-CG2 4.05Å; I93-V296 HydrophobicContact CD1-CG2 4.34Å; T292-V296 HydrophobicContact CG2-CG2 4.34Å; T292-V296 WeakPolarHBondContact O-CB 3.26Å; T292-V296 VanDerWaalsContact O-CG2 3.26Å; T292-V296 WeakPolarHBondContact O-CG2 3.25Å; T292-V296 PolarHBondContact O-N 3.23Å; F293-V296 PolarHBondContact O-N 2.9Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.97Å; V296-A299 PolarHBondContact O-N 3.38Å; V296-I300 HydrophobicContact CG1-CD1 3.97Å; V296-I300 WeakPolarHBondContact O-CG1 3.35Å; V296-I300 PolarHBondContact O-N 3.48Å
297A95.4Very high92Very high36 Ų3680 Ų8030%0.29841%0.414SS..Hα-helixtrans-60-44175.300000111.7F293 G294 A299 I300 L301F293-A297 WeakPolarHBondContact O-CB 3.36Å; F293-A297 PolarHBondContact O-N 3.45Å; G294-A297 PolarHBondContact O-N 3.09Å; A297-A299 PolarHBondContact O-N 2.89Å; A297-I300 PolarHBondContact O-N 2.96Å; A297-L301 WeakPolarHBondContact O-CG 3.2Å; A297-L301 PolarHBondContact O-N 3.27Å
298L93.8Very high91.7Very high94 Ų9482.2 Ų82.249%0.49242%0.423SS..Hα-helixtrans-61.5-41.1174.9-74171000112.6I89 G294 F295 V296 L301 N302I89-L298 HydrophobicContact CG2-CB 4.18Å; G294-L298 WeakPolarHBondContact O-CG 3.43Å; G294-L298 PolarHBondContact O-N 2.86Å; F295-L298 HydrophobicContact CD1-CD1 4.34Å; F295-L298 PolarHBondContact O-N 3.39Å; V296-L298 VanDerWaalsContact C-N 3.34Å; V296-L298 PolarHBondContact O-N 2.97Å; L298-L301 PolarHBondContact O-N 2.9Å; L298-N302 WeakPolarHBondContact O-CB 3.25Å; L298-N302 PolarHBondContact O-N 3.32Å
299A93.3Very high91.4Very high4 Ų485.3 Ų85.33%0.03344%0.438CS..Hα-helixtrans-65-39.8177.300000112I89 L90 F295 V296 A297 N302 F303I89-A299 HydrophobicContact CB-CB 4.46Å; L90-A299 HydrophobicContact CD2-CB 3.61Å; L90-A299 HydrophobicContact CG-CB 3.96Å; F295-A299 WeakPolarHBondContact O-CB 3.34Å; F295-A299 PolarHBondContact O-N 3.47Å; V296-A299 PolarHBondContact O-N 3.38Å; A297-A299 PolarHBondContact O-N 2.89Å; A299-N302 PolarHBondContact O-N 3.42Å; A299-F303 WeakPolarHBondContact O-CB 3.36Å; A299-F303 PolarHBondContact O-N 2.97Å
300I93.3Very high91Very high92 Ų9287.9 Ų87.947%0.47244%0.441SS..Hα-helixtrans-63.3-46.7174.8-67.7166.2000110.4V296 A297 N302 F303 L304V296-I300 HydrophobicContact CG1-CD1 3.97Å; V296-I300 WeakPolarHBondContact O-CG1 3.35Å; V296-I300 PolarHBondContact O-N 3.48Å; A297-I300 PolarHBondContact O-N 2.96Å; I300-N302 VanDerWaalsContact C-N 3.33Å; I300-N302 PolarHBondContact O-N 3.39Å; I300-F303 PolarHBondContact O-N 3Å; I300-L304 HydrophobicContact CG2-CD1 3.88Å; I300-L304 HydrophobicContact CG2-CG 4.39Å; I300-L304 VanDerWaalsContact O-CG 3.3Å; I300-L304 WeakPolarHBondContact O-CG 3.41Å; I300-L304 PolarHBondContact O-N 3.42Å
301L92.1Very high90.6Very high89 Ų8986.5 Ų86.547%0.46643%0.432SS..Hα-helixtrans-60.2-44.2176.6-69.9172.1000111.4A297 L298 F303 L304 F305A297-L301 WeakPolarHBondContact O-CG 3.2Å; A297-L301 PolarHBondContact O-N 3.27Å; L298-L301 PolarHBondContact O-N 2.9Å; L301-F303 VanDerWaalsContact C-N 3.33Å; L301-F303 PolarHBondContact O-N 3.31Å; L301-L304 PolarHBondContact O-N 2.99Å; L301-F305 HydrophobicContact CB-CD2 4.48Å; L301-F305 HydrophobicContact CD2-CD2 4.13Å; L301-F305 HydrophobicContact CD2-CE2 3.76Å; L301-F305 WeakPolarHBondContact O-CB 3.3Å; L301-F305 VanDerWaalsContact O-CD2 3.29Å; L301-F305 WeakPolarHBondContact O-CD2 3.42Å; L301-F305 PolarHBondContact O-N 2.97Å
302N89.8Confident90.1Very high39 Ų3990 Ų9021%0.20945%0.449CS..Hα-helixtrans-60-44.2177.5-163.925.5000111.5I89 L298 A299 I300 L304 V306I89-N302 HydrophobicContact CD1-CB 3.75Å; I89-N302 VanDerWaalsContact CD1-ND2 3.32Å; I89-N302 WeakPolarHBondContact CD1-ND2 3.37Å; L298-N302 WeakPolarHBondContact O-CB 3.25Å; L298-N302 PolarHBondContact O-N 3.32Å; A299-N302 PolarHBondContact O-N 3.42Å; I300-N302 VanDerWaalsContact C-N 3.33Å; I300-N302 PolarHBondContact O-N 3.39Å; N302-L304 VanDerWaalsContact C-N 3.33Å; N302-L304 PolarHBondContact O-N 3.45Å; N302-V306 WeakPolarHBondContact O-CB 3.5Å; N302-V306 PolarHBondContact O-N 3.21Å; N302-V306 WeakPolarHBondContact OD1-CB 3.29Å; N302-V306 VanDerWaalsContact OD1-CG2 3.25Å; N302-V306 WeakPolarHBondContact OD1-CG2 3.46Å
303F90Very high89.6Confident99 Ų9992.4 Ų92.443%0.43446%0.457SS..Hα-helixtrans-61.9-38.1176.3179.3-100.3000113.4W86 A299 I300 L301W86-F303 HydrophobicContact CB-CB 3.99Å; W86-F303 HydrophobicContact CB-CD2 4.23Å; W86-F303 AromaticContact CD1-CD2 3.78Å; W86-F303 HydrophobicContact CD2-CB 4.47Å; W86-F303 HydrophobicContact CD2-CD2 4.01Å; W86-F303 HydrophobicContact CG-CB 4.24Å; W86-F303 AromaticContact CG-CD2 3.75Å; W86-F303 HydrophobicContact CG-CD2 3.75Å; W86-F303 HydrophobicContact CG-CG 4.47Å; A299-F303 WeakPolarHBondContact O-CB 3.36Å; A299-F303 PolarHBondContact O-N 2.97Å; I300-F303 PolarHBondContact O-N 3Å; L301-F303 VanDerWaalsContact C-N 3.33Å; L301-F303 PolarHBondContact O-N 3.31Å
304L91.3Very high89Confident109 Ų10988.3 Ų88.357%0.57144%0.443SS*.Hα-helixtrans-78.4-34.8-177.4-68.7175.3000113.2I300 L301 N302I300-L304 HydrophobicContact CG2-CD1 3.88Å; I300-L304 HydrophobicContact CG2-CG 4.39Å; I300-L304 VanDerWaalsContact O-CG 3.3Å; I300-L304 WeakPolarHBondContact O-CG 3.41Å; I300-L304 PolarHBondContact O-N 3.42Å; L301-L304 PolarHBondContact O-N 2.99Å; N302-L304 VanDerWaalsContact C-N 3.33Å; N302-L304 PolarHBondContact O-N 3.45Å
305F86.7Confident88.4Confident160 Ų16092.7 Ų92.770%0.70245%0.452SS*.Hα-helixtrans-112.4-15.8-167.9-67.5-74.2000115.4L301L301-F305 HydrophobicContact CB-CD2 4.48Å; L301-F305 HydrophobicContact CD2-CD2 4.13Å; L301-F305 HydrophobicContact CD2-CE2 3.76Å; L301-F305 WeakPolarHBondContact O-CB 3.3Å; L301-F305 VanDerWaalsContact O-CD2 3.29Å; L301-F305 WeakPolarHBondContact O-CD2 3.42Å; L301-F305 PolarHBondContact O-N 2.97Å
306V73.7Confident87.8Confident97 Ų9797 Ų9759%0.58848%0.475SS*.  trans-123.238.6-171.1-163.50000111.2N302N302-V306 WeakPolarHBondContact O-CB 3.5Å; N302-V306 PolarHBondContact O-N 3.21Å; N302-V306 WeakPolarHBondContact OD1-CB 3.29Å; N302-V306 VanDerWaalsContact OD1-CG2 3.25Å; N302-V306 WeakPolarHBondContact OD1-CG2 3.46Å
307R57.9Low87Confident287 Ų287100.5 Ų100.5100%1.08349%0.486SS*.  trans-54.90169.2-89.3-169.8179-174.10.8111.9

Retrieved 307 of 307 residues in 189.4 ms (Link to these results)

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