A0A096MGE4_POEFO Loading...

Fibrinogen silencer binding protein

AlphaFold DB , UniProt , Accession A0A096MGE4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 310 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
1M39.3Very low65.7Low244 Ų244127.4 Ų127.4100%1.20271%0.708SS**  0115.30-69.7160.47000108.2G3M1-G3 PolarHBondContact O-N 2.81Å
2V45.3Very low68Low148 Ų148125.4 Ų125.490%0.89769%0.694SS**  trans-80.9109.7177.9-1790000108.5K4V2-K4 PolarHBondContact O-N 3.17Å
3G46.6Very low70Confident64 Ų64120.4 Ų120.466%0.6667%0.673SS**  trans-62.1131.8174.400000110.3M1 A5M1-G3 PolarHBondContact O-N 2.81Å; G3-A5 VanDerWaalsContact C-N 3.34Å; G3-A5 PolarHBondContact O-N 3.41Å
4K55.8Low71.7Confident214 Ų214112.4 Ų112.493%0.9363%0.628SS**  trans-66.394.7173.4-73.1173.7179.4173.40108.5V2 R6V2-K4 PolarHBondContact O-N 3.17Å; K4-R6 PolarHBondContact O-N 3.49Å
5A58.2Low73.3Confident93 Ų93109.3 Ų109.377%0.76961%0.605SS**  trans-52.4135.2176.500000109.9G3 S7G3-A5 VanDerWaalsContact C-N 3.34Å; G3-A5 PolarHBondContact O-N 3.41Å; A5-S7 PolarHBondContact O-N 3.23Å
6R64.7Low74.8Confident232 Ų232105.6 Ų105.688%0.87558%0.583SS**  trans-60114.2178.5-174.9178.1-176.1176.61.7108.1K4 S8K4-R6 PolarHBondContact O-N 3.49Å; R6-S8 PolarHBondContact O-N 3.26Å
7S63.5Low76Confident86 Ų86100.6 Ų100.660%0.60156%0.556SS**PPolyproline II helixtrans-54.8131.8-178.961.90000110.2A5A5-S7 PolarHBondContact O-N 3.23Å
8S77.6Confident77.1Confident74 Ų7495.1 Ų95.152%0.51753%0.525SS..PPolyproline II helixtrans-53.5147.7178.2-1690000111.5R6 R63R6-S8 PolarHBondContact O-N 3.26Å; S8-R63 PolarHBondContact O-NH1 2.88Å; S8-R63 PolarHBondContact O-NH2 2.71Å
9N88.5Confident78.2Confident133 Ų13390.1 Ų90.171%0.71150%0.497SS*.PPolyproline II helixtrans-61.1153.8174.4-71.6-58.7000110.6
10F90.9Very high79.1Confident41 Ų4191.4 Ų91.418%0.1850%0.498CS..PPolyproline II helixtrans-81.1121.6175.1-67.5-85.8000110.5E14 K15 R63 L68 L71F10-E14 WeakPolarHBondContact CA-OE2 3.33Å; F10-E14 HydrophobicContact CB-CB 4.47Å; F10-E14 HydrophobicContact CD1-CB 4.15Å; F10-K15 HydrophobicContact CB-CG 4.28Å; F10-K15 VanDerWaalsContact O-CE 3.27Å; F10-K15 WeakPolarHBondContact O-CE 3.45Å; F10-R63 HydrophobicContact CE1-CG 3.88Å; F10-R63 HydrophobicContact CZ-CG 4.28Å; F10-L68 HydrophobicContact CE1-CD2 4.01Å; F10-L68 HydrophobicContact CZ-CD2 4.28Å; F10-L71 HydrophobicContact CB-CD1 4.25Å; F10-L71 HydrophobicContact CB-CD2 3.96Å; F10-L71 HydrophobicContact CD1-CD2 3.51Å; F10-L71 HydrophobicContact CD2-CB 4.44Å; F10-L71 HydrophobicContact CD2-CD1 3.87Å; F10-L71 HydrophobicContact CD2-CD2 3.76Å; F10-L71 HydrophobicContact CD2-CG 4.24Å; F10-L71 HydrophobicContact CE1-CD2 3.76Å; F10-L71 HydrophobicContact CE2-CB 4.16Å; F10-L71 HydrophobicContact CE2-CD1 4.42Å; F10-L71 HydrophobicContact CE2-CD2 4.02Å; F10-L71 HydrophobicContact CE2-CG 4.44Å; F10-L71 HydrophobicContact CG-CD1 4.15Å; F10-L71 HydrophobicContact CG-CD2 3.48Å; F10-L71 VanDerWaalsContact CG-CD2 3.48Å; F10-L71 HydrophobicContact CG-CG 4.38Å; F10-L71 HydrophobicContact CZ-CB 4.4Å; F10-L71 HydrophobicContact CZ-CD2 4Å
11T92.6Very high80Confident72 Ų7288.7 Ų88.744%0.44248%0.483SS..PPolyproline II helixtrans-64169.617159.20000112S13 E14 K15T11-S13 PolarHBondContact OG1-OG 3.45Å; T11-E14 WeakPolarHBondContact CB-OE2 3.46Å; T11-E14 WeakPolarHBondContact CG2-OE2 3.49Å; T11-E14 PolarHBondContact N-OE2 3.29Å; T11-E14 WeakPolarHBondContact OG1-CB 3.31Å; T11-E14 WeakPolarHBondContact OG1-CG 3.25Å; T11-E14 PolarHBondContact OG1-N 2.91Å; T11-E14 PolarHBondContact OG1-OE2 2.95Å; T11-K15 VanDerWaalsContact O-CG 3.3Å; T11-K15 WeakPolarHBondContact O-CG 3.45Å; T11-K15 PolarHBondContact O-N 3.36Å
12L93.3Very high82.7Confident104 Ų10477.1 Ų77.155%0.54543%0.426SS..Hα-helixtrans-64.9-41.9177.1-179.558.9000112.2K15 L16 P100L12-K15 PolarHBondContact O-N 3.32Å; L12-L16 HydrophobicContact CD1-CD1 4.42Å; L12-L16 HydrophobicContact CD1-CG 4.44Å; L12-L16 HydrophobicContact CG-CD1 4.26Å; L12-L16 WeakPolarHBondContact O-CG 3.23Å; L12-L16 PolarHBondContact O-N 3.43Å; L12-L16 VanDerWaalsContact O-N 3.08Å; L12-P100 HydrophobicContact CD1-CG 3.52Å
13S93.5Very high85.1Confident60 Ų6074.2 Ų74.242%0.4240%0.399SS..Hα-helixtrans-61.5-48.3176.845.30000111.6T11 K15 L16 D17T11-S13 PolarHBondContact OG1-OG 3.45Å; S13-K15 VanDerWaalsContact C-N 3.28Å; S13-K15 PolarHBondContact O-N 2.94Å; S13-L16 PolarHBondContact O-N 2.98Å; S13-L16 VanDerWaalsContact O-N 3.09Å; S13-D17 WeakPolarHBondContact O-CB 3.46Å; S13-D17 VanDerWaalsContact O-CG 3.23Å; S13-D17 PolarHBondContact O-N 3.34Å
14E94.2Very high87.5Confident8 Ų875.9 Ų75.94%0.03740%0.398CS..Hα-helixtrans-55.2-40175.1-77.4175.6103.800113F10 T11 L18 Y53 R63F10-E14 WeakPolarHBondContact CA-OE2 3.33Å; F10-E14 HydrophobicContact CB-CB 4.47Å; F10-E14 HydrophobicContact CD1-CB 4.15Å; T11-E14 WeakPolarHBondContact CB-OE2 3.46Å; T11-E14 WeakPolarHBondContact CG2-OE2 3.49Å; T11-E14 PolarHBondContact N-OE2 3.29Å; T11-E14 WeakPolarHBondContact OG1-CB 3.31Å; T11-E14 WeakPolarHBondContact OG1-CG 3.25Å; T11-E14 PolarHBondContact OG1-N 2.91Å; T11-E14 PolarHBondContact OG1-OE2 2.95Å; E14-L18 PolarHBondContact O-N 3.34Å; E14-Y53 VanDerWaalsContact CB-OH 3.24Å; E14-Y53 WeakPolarHBondContact CB-OH 3.49Å; E14-Y53 WeakPolarHBondContact CG-OH 3.2Å; E14-Y53 PolarHBondContact OE1-OH 3.21Å; E14-R63 IonicContact OE1-CZ 2.6Å; E14-R63 IonicContact OE1-NE 3.13Å; E14-R63 IonicContact OE1-NH2 2.81Å; E14-R63 PolarHBondContact OE1-NH2 3.41Å; E14-R63 IonicContact OE2-NH2 3.83Å
15K95.8Very high89.4Confident67 Ų6768 Ų6829%0.29136%0.364SS..Hα-helixtrans-65.4-43.7176.1-68.7165-178.1172.70111.8F10 T11 L12 S13 L19 L71 L75F10-K15 HydrophobicContact CB-CG 4.28Å; F10-K15 VanDerWaalsContact O-CE 3.27Å; F10-K15 WeakPolarHBondContact O-CE 3.45Å; T11-K15 VanDerWaalsContact O-CG 3.3Å; T11-K15 WeakPolarHBondContact O-CG 3.45Å; T11-K15 PolarHBondContact O-N 3.36Å; L12-K15 PolarHBondContact O-N 3.32Å; S13-K15 VanDerWaalsContact C-N 3.28Å; S13-K15 PolarHBondContact O-N 2.94Å; K15-L19 WeakPolarHBondContact O-CG 3.13Å; K15-L19 PolarHBondContact O-N 2.91Å; K15-L19 VanDerWaalsContact O-N 3.14Å; K15-L71 HydrophobicContact CG-CD1 4.36Å; K15-L71 HydrophobicContact CG-CD2 4.36Å; K15-L75 HydrophobicContact CB-CD1 4.18Å; K15-L75 HydrophobicContact CB-CD2 4.22Å; K15-L75 HydrophobicContact CD-CD2 3.97Å; K15-L75 HydrophobicContact CG-CD1 4.37Å; K15-L75 HydrophobicContact CG-CD2 3.99Å
16L96.6Very high91.1Very high49 Ų4964.7 Ų64.726%0.25733%0.334SS..Hα-helixtrans-69.1-39.1178.9-66.9174.2000111.6L12 S13 L19 K20 E99 P100L12-L16 HydrophobicContact CD1-CD1 4.42Å; L12-L16 HydrophobicContact CD1-CG 4.44Å; L12-L16 HydrophobicContact CG-CD1 4.26Å; L12-L16 WeakPolarHBondContact O-CG 3.23Å; L12-L16 PolarHBondContact O-N 3.43Å; L12-L16 VanDerWaalsContact O-N 3.08Å; S13-L16 PolarHBondContact O-N 2.98Å; S13-L16 VanDerWaalsContact O-N 3.09Å; L16-L19 PolarHBondContact O-N 2.72Å; L16-K20 WeakPolarHBondContact O-CG 3.39Å; L16-K20 PolarHBondContact O-N 2.82Å; L16-E99 HydrophobicContact CD2-CB 4.16Å; L16-P100 HydrophobicContact CD2-CG 4.09Å
17D95.6Very high92.5Very high22 Ų2264.6 Ų64.612%0.11833%0.333CS..Hα-helixtrans-63.1-43.9175.8-67.9-21.8000111.3S13 L19 K20 L21 L56 R60S13-D17 WeakPolarHBondContact O-CB 3.46Å; S13-D17 VanDerWaalsContact O-CG 3.23Å; S13-D17 PolarHBondContact O-N 3.34Å; D17-L19 VanDerWaalsContact C-N 3.33Å; D17-L19 PolarHBondContact O-N 2.91Å; D17-K20 WeakPolarHBondContact O-CB 3.36Å; D17-K20 PolarHBondContact O-N 3.39Å; D17-K20 IonicContact OD1-NZ 2.72Å; D17-K20 PolarHBondContact OD1-NZ 2.92Å; D17-L21 WeakPolarHBondContact O-CG 3.33Å; D17-L21 PolarHBondContact O-N 2.89Å; D17-L56 HydrophobicContact CB-CD1 3.82Å; D17-R60 IonicContact OD2-CZ 3.37Å; D17-R60 IonicContact OD2-NH1 2.82Å; D17-R60 PolarHBondContact OD2-NH1 2.88Å; D17-R60 IonicContact OD2-NH2 2.94Å; D17-R60 PolarHBondContact OD2-NH2 3.13Å
18L96.7Very high94Very high0 Ų063.4 Ų63.40%032%0.32CS..Hα-helixtrans-57.9-44.1171.9178.361.4000111.9E14 K20 L21 V22 W46 V49 Y53 L68 L71E14-L18 PolarHBondContact O-N 3.34Å; L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 2.94Å; L18-L21 PolarHBondContact O-N 3.25Å; L18-V22 HydrophobicContact CD1-CG2 3.75Å; L18-V22 HydrophobicContact CG-CG2 4.14Å; L18-V22 WeakPolarHBondContact O-CB 3.45Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.39Å; L18-W46 HydrophobicContact CD1-CZ3 4.34Å; L18-V49 HydrophobicContact CD1-CG1 3.71Å; L18-Y53 HydrophobicContact CB-CD2 4.45Å; L18-Y53 HydrophobicContact CB-CE2 4.37Å; L18-L68 HydrophobicContact CD1-CB 3.99Å; L18-L68 HydrophobicContact CD1-CD1 4.33Å; L18-L68 HydrophobicContact CD1-CD2 4.29Å; L18-L68 HydrophobicContact CD1-CG 4.43Å; L18-L68 HydrophobicContact CD2-CB 4.35Å; L18-L68 HydrophobicContact CD2-CD2 4.4Å; L18-L71 HydrophobicContact CD2-CB 4Å; L18-L71 HydrophobicContact CD2-CD2 3.67Å; L18-L71 HydrophobicContact CD2-CG 3.88Å
19L97.4Very high94.7Very high0 Ų060.8 Ų60.80%030%0.299CS..Hα-helixtrans-66.3-30.9178.6-69173000112.7K15 L16 D17 R23 Y72 L75 P100 R103 I104 M107K15-L19 WeakPolarHBondContact O-CG 3.13Å; K15-L19 PolarHBondContact O-N 2.91Å; K15-L19 VanDerWaalsContact O-N 3.14Å; L16-L19 PolarHBondContact O-N 2.72Å; D17-L19 VanDerWaalsContact C-N 3.33Å; D17-L19 PolarHBondContact O-N 2.91Å; L19-R23 PolarHBondContact O-N 3.33Å; L19-Y72 HydrophobicContact CD2-CD2 4.07Å; L19-Y72 HydrophobicContact CD2-CE2 4.16Å; L19-L75 HydrophobicContact CD1-CD1 4.41Å; L19-L75 HydrophobicContact CD2-CD1 4.34Å; L19-L75 HydrophobicContact CG-CD1 4.23Å; L19-P100 HydrophobicContact CD1-CB 4.1Å; L19-R103 HydrophobicContact CB-CG 4.11Å; L19-R103 HydrophobicContact CD1-CB 4.16Å; L19-R103 HydrophobicContact CD1-CG 4.34Å; L19-I104 HydrophobicContact CD1-CD1 4.37Å; L19-I104 HydrophobicContact CD1-CG1 4.12Å; L19-I104 HydrophobicContact CD2-CD1 4.11Å; L19-I104 HydrophobicContact CD2-CG1 3.7Å; L19-M107 HydrophobicContact CB-SD 4.31Å; L19-M107 HydrophobicContact CD2-CE 4.16Å; L19-M107 WeakPolarHBondContact O-CE 3.21Å
20K96.8Very high95Very high117 Ų11755.2 Ų55.251%0.50927%0.269SS..Hα-helixtrans-64.1-49.1170.4-65.2166.9-162.3161.60110.9L16 D17 L18 R23L16-K20 WeakPolarHBondContact O-CG 3.39Å; L16-K20 PolarHBondContact O-N 2.82Å; D17-K20 WeakPolarHBondContact O-CB 3.36Å; D17-K20 PolarHBondContact O-N 3.39Å; D17-K20 IonicContact OD1-NZ 2.72Å; D17-K20 PolarHBondContact OD1-NZ 2.92Å; L18-K20 VanDerWaalsContact C-N 3.31Å; L18-K20 PolarHBondContact O-N 2.94Å; K20-R23 WeakPolarHBondContact O-CB 3.4Å; K20-R23 PolarHBondContact O-N 3.4Å
21L96.9Very high95.1Very high35 Ų3556.9 Ų56.918%0.18328%0.278CS..Hα-helixtrans-67.5-36.3-178.2-67.5175.4000113.2D17 L18 R23 P24 H25 V49 Q52 Y53 L56D17-L21 WeakPolarHBondContact O-CG 3.33Å; D17-L21 PolarHBondContact O-N 2.89Å; L18-L21 PolarHBondContact O-N 3.25Å; L21-R23 VanDerWaalsContact C-N 3.32Å; L21-R23 PolarHBondContact O-N 3.41Å; L21-P24 WeakPolarHBondContact O-CD 3.44Å; L21-P24 WeakPolarHBondContact O-CG 3.48Å; L21-H25 PolarHBondContact O-CD2 3.49Å; L21-V49 HydrophobicContact CB-CG1 4.22Å; L21-Q52 HydrophobicContact CD1-CB 4.14Å; L21-Q52 HydrophobicContact CD2-CB 3.84Å; L21-Y53 HydrophobicContact CD1-CD2 4.32Å; L21-L56 HydrophobicContact CD1-CD1 4.13Å
22V96.9Very high95Very high0 Ų061.7 Ų61.70%030%0.295CS..Hα-helixtrans-71.5-26.3177.7167.30000112.3L18 H25 I26 L29 W46 V49 Y72 M107L18-V22 HydrophobicContact CD1-CG2 3.75Å; L18-V22 HydrophobicContact CG-CG2 4.14Å; L18-V22 WeakPolarHBondContact O-CB 3.45Å; L18-V22 VanDerWaalsContact O-CG2 3.3Å; L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.39Å; V22-H25 PolarHBondContact O-N 3.04Å; V22-I26 PolarHBondContact O-N 2.95Å; V22-L29 HydrophobicContact CG1-CD1 3.84Å; V22-W46 HydrophobicContact CG2-CH2 3.86Å; V22-W46 HydrophobicContact CG2-CZ3 3.91Å; V22-V49 HydrophobicContact CG2-CG1 4.19Å; V22-Y72 HydrophobicContact CG1-CD2 4.06Å; V22-Y72 HydrophobicContact CG1-CE1 4.39Å; V22-Y72 HydrophobicContact CG1-CE2 3.58Å; V22-M107 HydrophobicContact CB-CE 4.45Å; V22-M107 HydrophobicContact CG1-CE 4.14Å
23R95.6Very high94.9Very high88 Ų8858.9 Ų58.933%0.33228%0.282SS..G310 helixtrans-51.7-49-175.1-171.9174.7179110.8-11.4115.7L19 K20 L21 H25 I26 E106 M107L19-R23 PolarHBondContact O-N 3.33Å; K20-R23 WeakPolarHBondContact O-CB 3.4Å; K20-R23 PolarHBondContact O-N 3.4Å; L21-R23 VanDerWaalsContact C-N 3.32Å; L21-R23 PolarHBondContact O-N 3.41Å; R23-H25 PolarHBondContact O-N 3.38Å; R23-I26 HydrophobicContact CB-CD1 4.46Å; R23-I26 HydrophobicContact CG-CD1 4.15Å; R23-I26 WeakPolarHBondContact O-CD1 3.4Å; R23-I26 VanDerWaalsContact O-CG1 3.28Å; R23-I26 WeakPolarHBondContact O-CG1 3.44Å; R23-E106 IonicContact NH1-OE2 3Å; R23-M107 HydrophobicContact CB-CE 4.22Å; R23-M107 HydrophobicContact CB-SD 4.16Å; R23-M107 HydrophobicContact CG-CG 4.18Å; R23-M107 HydrophobicContact CG-SD 4.34Å
24P95.8Very high94.9Very high98 Ų9862.9 Ų62.964%0.63630%0.299SS*.G310 helixtrans-62.7-26.5175.522.2-33.7000113.8L21L21-P24 WeakPolarHBondContact O-CD 3.44Å; L21-P24 WeakPolarHBondContact O-CG 3.48Å
25H95.6Very high94.9Very high48 Ų4869.1 Ų69.122%0.22233%0.326CS..G310 helixtrans-95.1-0.8-173.7-57.2-72000114.6L21 V22 R23 R27 I28 L29 C45L21-H25 PolarHBondContact O-CD2 3.49Å; V22-H25 PolarHBondContact O-N 3.04Å; R23-H25 PolarHBondContact O-N 3.38Å; H25-R27 VanDerWaalsContact C-N 3.26Å; H25-R27 PolarHBondContact O-N 2.93Å; H25-R27 VanDerWaalsContact O-N 3.12Å; H25-I28 PolarHBondContact O-N 2.98Å; H25-I28 VanDerWaalsContact O-N 3.1Å; H25-L29 HydrophobicContact CB-CD1 3.7Å; H25-L29 HydrophobicContact CB-CG 4.07Å; H25-L29 WeakPolarHBondContact O-CG 3.24Å; H25-L29 PolarHBondContact O-N 3.34Å; H25-C45 HydrophobicContact CB-CB 4.33Å
26I94.9Very high95Very high25 Ų2572.8 Ų72.813%0.12834%0.344CS..Hα-helixtrans-49.3-44.3-174.8-65.3161.7000112.5V22 R23 I28 L29 E30 M107 I108V22-I26 PolarHBondContact O-N 2.95Å; R23-I26 HydrophobicContact CB-CD1 4.46Å; R23-I26 HydrophobicContact CG-CD1 4.15Å; R23-I26 WeakPolarHBondContact O-CD1 3.4Å; R23-I26 VanDerWaalsContact O-CG1 3.28Å; R23-I26 WeakPolarHBondContact O-CG1 3.44Å; I26-I28 VanDerWaalsContact C-N 3.29Å; I26-I28 PolarHBondContact O-N 2.91Å; I26-L29 PolarHBondContact O-N 3.41Å; I26-E30 HydrophobicContact CG2-CB 4.45Å; I26-E30 HydrophobicContact CG2-CG 3.78Å; I26-E30 WeakPolarHBondContact O-CB 3.11Å; I26-E30 PolarHBondContact O-N 2.89Å; I26-M107 HydrophobicContact CD1-CB 3.56Å; I26-M107 HydrophobicContact CD1-CE 3.84Å; I26-M107 HydrophobicContact CD1-CG 3.72Å; I26-M107 HydrophobicContact CG1-CE 4.06Å; I26-I108 HydrophobicContact CG2-CG1 4.39Å
27R93.7Very high94.9Very high229 Ų22973.5 Ų73.586%0.86436%0.357SS*.Hα-helixtrans-56.9-41.8-176.3-67.7-176178.5-179.8-0.6112.5H25H25-R27 VanDerWaalsContact C-N 3.26Å; H25-R27 PolarHBondContact O-N 2.93Å; H25-R27 VanDerWaalsContact O-N 3.12Å
28I94.5Very high94.9Very high62 Ų6273.2 Ų73.232%0.31836%0.356SS..Hα-helixtrans-77.8-43.1178.6-59.8170.1000109.8H25 I26 E31 D41 K42H25-I28 PolarHBondContact O-N 2.98Å; H25-I28 VanDerWaalsContact O-N 3.1Å; I26-I28 VanDerWaalsContact C-N 3.29Å; I26-I28 PolarHBondContact O-N 2.91Å; I28-E31 PolarHBondContact O-N 3.08Å; I28-D41 HydrophobicContact CG2-CB 4.07Å; I28-K42 HydrophobicContact CG2-CG 3.92Å; I28-K42 WeakPolarHBondContact O-CE 3.34Å; I28-K42 WeakPolarHBondContact O-CG 3.39Å
29L94Very high94.8Very high18 Ų1876 Ų769%0.09437%0.37CS..Hα-helixtrans-69.9-34.4-174.1-67.7177000113.7V22 H25 I26 K42 C45 W46V22-L29 HydrophobicContact CG1-CD1 3.84Å; H25-L29 HydrophobicContact CB-CD1 3.7Å; H25-L29 HydrophobicContact CB-CG 4.07Å; H25-L29 WeakPolarHBondContact O-CG 3.24Å; H25-L29 PolarHBondContact O-N 3.34Å; I26-L29 PolarHBondContact O-N 3.41Å; L29-K42 HydrophobicContact CD2-CB 4.47Å; L29-K42 HydrophobicContact CD2-CG 4.34Å; L29-C45 HydrophobicContact CD2-CB 4.09Å; L29-W46 HydrophobicContact CD1-CH2 4.37Å; L29-W46 HydrophobicContact CD1-CZ2 4.02Å; L29-W46 HydrophobicContact CD2-CD2 4.42Å; L29-W46 HydrophobicContact CD2-CG 4.47Å; L29-W46 HydrophobicContact CD2-CZ2 4.05Å; L29-W46 VanDerWaalsContact CD2-NE1 3.33Å
30E93.7Very high94.8Very high16 Ų1679.4 Ų79.48%0.07539%0.39CS..THydrogen-bonded Turntrans-93.66.5177.9-57.5-57.9130.400113.7I26 H32 Y72 K76 I108I26-E30 HydrophobicContact CG2-CB 4.45Å; I26-E30 HydrophobicContact CG2-CG 3.78Å; I26-E30 WeakPolarHBondContact O-CB 3.11Å; I26-E30 PolarHBondContact O-N 2.89Å; E30-H32 PolarHBondContact O-CE1 2.92Å; E30-H32 VanDerWaalsContact O-CE1 3.26Å; E30-H32 PolarHBondContact O-N 3.28Å; E30-H32 PolarHBondContact O-ND1 3.48Å; E30-Y72 WeakPolarHBondContact OE1-CE1 3.11Å; E30-Y72 VanDerWaalsContact OE1-CZ 3.29Å; E30-Y72 PolarHBondContact OE1-OH 3.2Å; E30-K76 IonicContact OE1-NZ 3.84Å; E30-K76 PolarHBondContact OE1-NZ 3.05Å; E30-K76 IonicContact OE2-NZ 3.62Å; E30-K76 PolarHBondContact OE2-NZ 3.05Å; E30-I108 HydrophobicContact CG-CD1 4.27Å; E30-I108 HydrophobicContact CG-CG2 4.28Å
31E92.8Very high94.8Very high77 Ų7777.5 Ų77.536%0.3639%0.386SS..  trans-71.3116.1175.8-169-177.4171.600110.8I28 T33 V38 K42I28-E31 PolarHBondContact O-N 3.08Å; E31-T33 VanDerWaalsContact C-N 3.31Å; E31-T33 HydrophobicContact CG-CG2 3.91Å; E31-T33 PolarHBondContact O-N 3.46Å; E31-T33 WeakPolarHBondContact OE1-CG2 3.45Å; E31-V38 HydrophobicContact CB-CG1 4.34Å; E31-V38 WeakPolarHBondContact OE2-CG1 3.39Å; E31-K42 PolarHBondContact O-NZ 3.3Å
32H90.5Very high94.8Very high172 Ų17277.3 Ų77.380%0.79638%0.384SS*.  trans-88.164.1-176.1-70.176.2000112.1E30E30-H32 PolarHBondContact O-CE1 2.92Å; E30-H32 VanDerWaalsContact O-CE1 3.26Å; E30-H32 PolarHBondContact O-N 3.28Å; E30-H32 PolarHBondContact O-ND1 3.48Å
33T91.7Very high94.7Very high46 Ų4680.5 Ų80.528%0.28240%0.4SS..  trans-128.2155.9177-164.70000113.1E31 K35 V38E31-T33 VanDerWaalsContact C-N 3.31Å; E31-T33 HydrophobicContact CG-CG2 3.91Å; E31-T33 PolarHBondContact O-N 3.46Å; E31-T33 WeakPolarHBondContact OE1-CG2 3.45Å; T33-K35 HydrophobicContact CG2-CB 4.28Å; T33-V38 HydrophobicContact CG2-CB 3.73Å; T33-V38 HydrophobicContact CG2-CG1 3.7Å; T33-V38 HydrophobicContact CG2-CG2 3.73Å
34N92.4Very high94.8Very high144 Ų14483.1 Ų83.177%0.7741%0.414SS*.  trans-106.916.7178.3-160.420.5000112.8H36N34-H36 PolarHBondContact O-N 3.31Å
35K95.8Very high94.9Very high138 Ų13879 Ų7960%0.639%0.388SS*.  trans-65.2128.4173.4-70174.6-179.8176.80109.8T33 A37 V38 I39T33-K35 HydrophobicContact CG2-CB 4.28Å; K35-A37 VanDerWaalsContact C-N 3.3Å; K35-A37 PolarHBondContact O-N 2.87Å; K35-V38 HydrophobicContact CB-CG2 4.24Å; K35-V38 PolarHBondContact O-N 3.34Å; K35-I39 PolarHBondContact O-N 2.75Å
36H97Very high95Very high145 Ų14577.3 Ų77.367%0.67138%0.379SS*.Hα-helixtrans-54.5-42.6-177.1-177.472.9000113.1N34 V38 I39 V40N34-H36 PolarHBondContact O-N 3.31Å; H36-V38 VanDerWaalsContact C-N 3.34Å; H36-V38 PolarHBondContact O-N 3.04Å; H36-I39 WeakPolarHBondContact O-CB 3.49Å; H36-I39 PolarHBondContact O-N 3.4Å; H36-V40 PolarHBondContact O-N 2.81Å
37A95.6Very high95.1Very high64 Ų6480 Ų8053%0.52939%0.394SS..Hα-helixtrans-54.3-46.717600000112.6K35 I39 V40 D41K35-A37 VanDerWaalsContact C-N 3.3Å; K35-A37 PolarHBondContact O-N 2.87Å; A37-I39 VanDerWaalsContact C-N 3.29Å; A37-I39 PolarHBondContact O-N 3.21Å; A37-V40 WeakPolarHBondContact O-CB 3.44Å; A37-V40 PolarHBondContact O-N 3.2Å; A37-V40 VanDerWaalsContact O-N 3.13Å; A37-D41 PolarHBondContact O-N 2.9Å
38V94.8Very high95.3Very high16 Ų1671.5 Ų71.510%0.09737%0.368CS..Hα-helixtrans-67.7-29.9178.8179.20000111.9E31 T33 K35 H36 K42E31-V38 HydrophobicContact CB-CG1 4.34Å; E31-V38 WeakPolarHBondContact OE2-CG1 3.39Å; T33-V38 HydrophobicContact CG2-CB 3.73Å; T33-V38 HydrophobicContact CG2-CG1 3.7Å; T33-V38 HydrophobicContact CG2-CG2 3.73Å; K35-V38 HydrophobicContact CB-CG2 4.24Å; K35-V38 PolarHBondContact O-N 3.34Å; H36-V38 VanDerWaalsContact C-N 3.34Å; H36-V38 PolarHBondContact O-N 3.04Å; V38-K42 HydrophobicContact CG1-CD 4.23Å; V38-K42 HydrophobicContact CG1-CG 4.42Å; V38-K42 VanDerWaalsContact O-CB 3.31Å; V38-K42 WeakPolarHBondContact O-CB 3.37Å; V38-K42 WeakPolarHBondContact O-CG 3.33Å; V38-K42 PolarHBondContact O-N 2.79Å
39I95.3Very high95.4Very high59 Ų5968.6 Ų68.630%0.30335%0.353SS..Hα-helixtrans-66.9-42.5172.8-61.5170.9000110.4K35 H36 A37 N43K35-I39 PolarHBondContact O-N 2.75Å; H36-I39 WeakPolarHBondContact O-CB 3.49Å; H36-I39 PolarHBondContact O-N 3.4Å; A37-I39 VanDerWaalsContact C-N 3.29Å; A37-I39 PolarHBondContact O-N 3.21Å; I39-N43 VanDerWaalsContact O-CG 3.23Å; I39-N43 PolarHBondContact O-N 3.27Å; I39-N43 PolarHBondContact O-ND2 2.8Å
40V96.4Very high95.6Very high71 Ų7168.1 Ų68.143%0.4335%0.352SS..Hα-helixtrans-63.6-48175.2175.10000110.8H36 A37 K42 N43 K44H36-V40 PolarHBondContact O-N 2.81Å; A37-V40 WeakPolarHBondContact O-CB 3.44Å; A37-V40 PolarHBondContact O-N 3.2Å; A37-V40 VanDerWaalsContact O-N 3.13Å; V40-K42 VanDerWaalsContact C-N 3.34Å; V40-K42 PolarHBondContact O-N 3.08Å; V40-N43 PolarHBondContact O-N 3.22Å; V40-N43 VanDerWaalsContact O-N 3.14Å; V40-K44 PolarHBondContact O-N 3.02Å
41D96.3Very high95.7Very high77 Ų7773.5 Ų73.541%0.41238%0.377SS..Hα-helixtrans-61.3-40.3178.4-71.1-30.2000112.4I28 A37 K44 C45I28-D41 HydrophobicContact CG2-CB 4.07Å; A37-D41 PolarHBondContact O-N 2.9Å; D41-K44 PolarHBondContact O-N 2.82Å; D41-C45 WeakPolarHBondContact O-CB 3.39Å; D41-C45 PolarHBondContact O-N 3.24Å; D41-C45 PolarHBondContact O-SG 3.14Å
42K96.6Very high95.8Very high31 Ų3174.7 Ų74.714%0.13538%0.382CS..Hα-helixtrans-62.1-43.1173.3-79.6173175.2178.20112.5I28 L29 E31 V38 V40 C45 W46I28-K42 HydrophobicContact CG2-CG 3.92Å; I28-K42 WeakPolarHBondContact O-CE 3.34Å; I28-K42 WeakPolarHBondContact O-CG 3.39Å; L29-K42 HydrophobicContact CD2-CB 4.47Å; L29-K42 HydrophobicContact CD2-CG 4.34Å; E31-K42 PolarHBondContact O-NZ 3.3Å; V38-K42 HydrophobicContact CG1-CD 4.23Å; V38-K42 HydrophobicContact CG1-CG 4.42Å; V38-K42 VanDerWaalsContact O-CB 3.31Å; V38-K42 WeakPolarHBondContact O-CB 3.37Å; V38-K42 WeakPolarHBondContact O-CG 3.33Å; V38-K42 PolarHBondContact O-N 2.79Å; V40-K42 VanDerWaalsContact C-N 3.34Å; V40-K42 PolarHBondContact O-N 3.08Å; K42-C45 PolarHBondContact O-N 3.4Å; K42-W46 PolarHBondContact O-N 3.18Å
43N96.6Very high96.1Very high66 Ų6666.6 Ų66.635%0.35335%0.345SS..Hα-helixtrans-64.4-48.2178.3-69.3-16.2000109.9I39 V40 C45 W46 D47 R69I39-N43 VanDerWaalsContact O-CG 3.23Å; I39-N43 PolarHBondContact O-N 3.27Å; I39-N43 PolarHBondContact O-ND2 2.8Å; V40-N43 PolarHBondContact O-N 3.22Å; V40-N43 VanDerWaalsContact O-N 3.14Å; N43-C45 VanDerWaalsContact C-N 3.3Å; N43-C45 PolarHBondContact O-N 3.22Å; N43-W46 CarbonylContact O-C 3.55Å; N43-W46 WeakPolarHBondContact O-CA 3.3Å; N43-W46 WeakPolarHBondContact O-CB 3.39Å; N43-W46 PolarHBondContact O-N 3.05Å; N43-D47 PolarHBondContact O-N 2.97Å; N43-R69 PolarHBondContact OD1-NH1 3.36Å; N43-R69 VanDerWaalsContact OD1-NH1 3.09Å
44K97.2Very high96.2Very high143 Ų14366.7 Ų66.762%0.62234%0.343SS*.Hα-helixtrans-54.8-42.3174-173.2177.9-179.3-179.90112.7V40 D41 W46 D47 T48V40-K44 PolarHBondContact O-N 3.02Å; D41-K44 PolarHBondContact O-N 2.82Å; K44-W46 PolarHBondContact O-N 3.09Å; K44-D47 PolarHBondContact O-N 3.32Å; K44-T48 PolarHBondContact O-N 3.01Å; K44-T48 PolarHBondContact O-OG1 2.87Å; K44-T48 VanDerWaalsContact O-OG1 3.08Å
45C97.4Very high96.3Very high12 Ų1263.6 Ų63.68%0.08134%0.338CS..Hα-helixtrans-61.4-40.8173.4-69.30000112.5H25 L29 D41 K42 N43 V49H25-C45 HydrophobicContact CB-CB 4.33Å; L29-C45 HydrophobicContact CD2-CB 4.09Å; D41-C45 WeakPolarHBondContact O-CB 3.39Å; D41-C45 PolarHBondContact O-N 3.24Å; D41-C45 PolarHBondContact O-SG 3.14Å; K42-C45 PolarHBondContact O-N 3.4Å; N43-C45 VanDerWaalsContact C-N 3.3Å; N43-C45 PolarHBondContact O-N 3.22Å; C45-V49 WeakPolarHBondContact O-CB 3.42Å; C45-V49 VanDerWaalsContact O-CG2 3.23Å; C45-V49 WeakPolarHBondContact O-CG2 3.2Å; C45-V49 PolarHBondContact O-N 3.42Å
46W97.9Very high95.9Very high12 Ų1261 Ų615%0.04533%0.33CS..Hα-helixtrans-68.9-34.2176.9-78.7115000113.2L18 V22 L29 K42 N43 K44 V49 A50 A65 L68 R69 Y72L18-W46 HydrophobicContact CD1-CZ3 4.34Å; V22-W46 HydrophobicContact CG2-CH2 3.86Å; V22-W46 HydrophobicContact CG2-CZ3 3.91Å; L29-W46 HydrophobicContact CD1-CH2 4.37Å; L29-W46 HydrophobicContact CD1-CZ2 4.02Å; L29-W46 HydrophobicContact CD2-CD2 4.42Å; L29-W46 HydrophobicContact CD2-CG 4.47Å; L29-W46 HydrophobicContact CD2-CZ2 4.05Å; L29-W46 VanDerWaalsContact CD2-NE1 3.33Å; K42-W46 PolarHBondContact O-N 3.18Å; N43-W46 CarbonylContact O-C 3.55Å; N43-W46 WeakPolarHBondContact O-CA 3.3Å; N43-W46 WeakPolarHBondContact O-CB 3.39Å; N43-W46 PolarHBondContact O-N 3.05Å; K44-W46 PolarHBondContact O-N 3.09Å; W46-V49 HydrophobicContact CE3-CG1 4.29Å; W46-V49 HydrophobicContact CZ3-CG1 4.24Å; W46-A50 WeakPolarHBondContact O-CB 3.28Å; W46-A50 PolarHBondContact O-N 3.23Å; W46-A65 HydrophobicContact CB-CB 4.05Å; W46-L68 HydrophobicContact CE3-CB 4.37Å; W46-L68 HydrophobicContact CZ3-CB 4.25Å; W46-R69 HydrophobicContact CD2-CB 3.75Å; W46-R69 HydrophobicContact CD2-CG 4.17Å; W46-R69 HydrophobicContact CE3-CB 4.05Å; W46-R69 HydrophobicContact CG-CB 4.25Å; W46-R69 HydrophobicContact CH2-CB 4.42Å; W46-R69 HydrophobicContact CZ2-CB 4.11Å; W46-R69 HydrophobicContact CZ2-CG 4.04Å; W46-R69 HydrophobicContact CZ3-CB 4.37Å; W46-Y72 AromaticContact CH2-CD1 3.63Å; W46-Y72 HydrophobicContact CH2-CD1 3.63Å; W46-Y72 HydrophobicContact CH2-CE1 4.43Å; W46-Y72 AromaticContact CH2-CG 3.74Å; W46-Y72 HydrophobicContact CH2-CG 3.74Å; W46-Y72 AromaticContact CZ2-CD1 3.7Å; W46-Y72 HydrophobicContact CZ2-CD1 3.7Å; W46-Y72 HydrophobicContact CZ2-CE1 4.31Å; W46-Y72 HydrophobicContact CZ2-CG 4.29Å
47D97.7Very high94.6Very high83 Ų8356 Ų5644%0.44432%0.317SS..Hα-helixtrans-67.2-49.1175.3-61.3-37.6000110.3N43 K44 V49 A50 E51 A65N43-D47 PolarHBondContact O-N 2.97Å; K44-D47 PolarHBondContact O-N 3.32Å; D47-V49 VanDerWaalsContact C-N 3.35Å; D47-V49 PolarHBondContact O-N 2.89Å; D47-A50 WeakPolarHBondContact O-CB 3.39Å; D47-A50 PolarHBondContact O-N 2.7Å; D47-E51 WeakPolarHBondContact O-CG 3.48Å; D47-E51 PolarHBondContact O-N 3.34Å; D47-A65 WeakPolarHBondContact OD1-CB 3.45Å
48T97.5Very high93.8Very high49 Ų4956.3 Ų56.330%0.30133%0.327SS..Hα-helixtrans-58-43.8173-55.50000112.1K44 A50 E51 Q52K44-T48 PolarHBondContact O-N 3.01Å; K44-T48 PolarHBondContact O-OG1 2.87Å; K44-T48 VanDerWaalsContact O-OG1 3.08Å; T48-A50 VanDerWaalsContact C-N 3.28Å; T48-A50 PolarHBondContact O-N 2.88Å; T48-E51 PolarHBondContact O-N 3.42Å; T48-Q52 HydrophobicContact CG2-CG 4.41Å; T48-Q52 WeakPolarHBondContact O-CB 3.46Å; T48-Q52 VanDerWaalsContact O-CG 3.25Å; T48-Q52 WeakPolarHBondContact O-CG 3.41Å; T48-Q52 PolarHBondContact O-N 3.31Å
49V97.3Very high93Very high1 Ų163.9 Ų63.91%0.00637%0.367CS..Hα-helixtrans-63.2-34.3176165.50000111.7L18 L21 V22 C45 W46 D47 Y53 L68L18-V49 HydrophobicContact CD1-CG1 3.71Å; L21-V49 HydrophobicContact CB-CG1 4.22Å; V22-V49 HydrophobicContact CG2-CG1 4.19Å; C45-V49 WeakPolarHBondContact O-CB 3.42Å; C45-V49 VanDerWaalsContact O-CG2 3.23Å; C45-V49 WeakPolarHBondContact O-CG2 3.2Å; C45-V49 PolarHBondContact O-N 3.42Å; W46-V49 HydrophobicContact CE3-CG1 4.29Å; W46-V49 HydrophobicContact CZ3-CG1 4.24Å; D47-V49 VanDerWaalsContact C-N 3.35Å; D47-V49 PolarHBondContact O-N 2.89Å; V49-Y53 WeakPolarHBondContact O-CB 3.27Å; V49-Y53 PolarHBondContact O-N 3.26Å; V49-L68 HydrophobicContact CG1-CD1 4.34Å
50A96.4Very high92.6Very high9 Ų965.1 Ų65.17%0.07437%0.368CS..Hα-helixtrans-71.1-44.5176.400000112.5W46 D47 T48 Y53 N54 A65 L68W46-A50 WeakPolarHBondContact O-CB 3.28Å; W46-A50 PolarHBondContact O-N 3.23Å; D47-A50 WeakPolarHBondContact O-CB 3.39Å; D47-A50 PolarHBondContact O-N 2.7Å; T48-A50 VanDerWaalsContact C-N 3.28Å; T48-A50 PolarHBondContact O-N 2.88Å; A50-Y53 PolarHBondContact O-N 2.95Å; A50-N54 WeakPolarHBondContact O-CB 3.3Å; A50-N54 PolarHBondContact O-N 3.1Å; A50-N54 PolarHBondContact O-ND2 2.92Å; A50-A65 HydrophobicContact CB-CB 4.06Å; A50-L68 HydrophobicContact CB-CD1 4.04Å
51E96.1Very high92.1Very high129 Ų12964.6 Ų64.660%0.60337%0.366SS*.Hα-helixtrans-55.6-52.7173.1-70.8170.6176.500110.8D47 T48 Y53 N54 A55D47-E51 WeakPolarHBondContact O-CG 3.48Å; D47-E51 PolarHBondContact O-N 3.34Å; T48-E51 PolarHBondContact O-N 3.42Å; E51-Y53 PolarHBondContact O-N 3.29Å; E51-N54 PolarHBondContact O-N 3.12Å; E51-A55 VanDerWaalsContact O-CB 3.31Å; E51-A55 WeakPolarHBondContact O-CB 3.34Å; E51-A55 PolarHBondContact O-N 3.15Å
52Q96.2Very high91.8Very high102 Ų10268 Ų6848%0.47738%0.379SS..Hα-helixtrans-61.8-41.5178.6-66.1-63.4-37.100112.3L21 T48 A55 L56L21-Q52 HydrophobicContact CD1-CB 4.14Å; L21-Q52 HydrophobicContact CD2-CB 3.84Å; T48-Q52 HydrophobicContact CG2-CG 4.41Å; T48-Q52 WeakPolarHBondContact O-CB 3.46Å; T48-Q52 VanDerWaalsContact O-CG 3.25Å; T48-Q52 WeakPolarHBondContact O-CG 3.41Å; T48-Q52 PolarHBondContact O-N 3.31Å; Q52-A55 PolarHBondContact O-N 3.05Å; Q52-L56 WeakPolarHBondContact O-CG 3.37Å; Q52-L56 PolarHBondContact O-N 3.14Å
53Y95.6Very high91.6Very high2 Ų267 Ų671%0.00837%0.374CS..Hα-helixtrans-62.9-43.6178.1180-80.2000112.3E14 L18 L21 V49 A50 E51 A55 L56 R63 L68E14-Y53 VanDerWaalsContact CB-OH 3.24Å; E14-Y53 WeakPolarHBondContact CB-OH 3.49Å; E14-Y53 WeakPolarHBondContact CG-OH 3.2Å; E14-Y53 PolarHBondContact OE1-OH 3.21Å; L18-Y53 HydrophobicContact CB-CD2 4.45Å; L18-Y53 HydrophobicContact CB-CE2 4.37Å; L21-Y53 HydrophobicContact CD1-CD2 4.32Å; V49-Y53 WeakPolarHBondContact O-CB 3.27Å; V49-Y53 PolarHBondContact O-N 3.26Å; A50-Y53 PolarHBondContact O-N 2.95Å; E51-Y53 PolarHBondContact O-N 3.29Å; Y53-A55 VanDerWaalsContact C-N 3.33Å; Y53-L56 WeakPolarHBondContact O-CB 3.35Å; Y53-L56 PolarHBondContact O-N 3.02Å; Y53-R63 HydrophobicContact CD1-CB 4.14Å; Y53-R63 HydrophobicContact CD1-CG 4Å; Y53-R63 HydrophobicContact CE1-CB 4.01Å; Y53-R63 HydrophobicContact CE1-CG 3.36Å; Y53-L68 HydrophobicContact CD1-CD1 4.2Å; Y53-L68 HydrophobicContact CD1-CD2 4.18Å; Y53-L68 HydrophobicContact CD2-CD1 4.23Å; Y53-L68 HydrophobicContact CD2-CD2 3.99Å; Y53-L68 HydrophobicContact CE1-CD2 4.2Å; Y53-L68 HydrophobicContact CE2-CD2 3.94Å; Y53-L68 HydrophobicContact CG-CD1 3.79Å; Y53-L68 HydrophobicContact CG-CD2 4.09Å
54N94.1Very high91.5Very high47 Ų4768 Ų6825%0.25138%0.383SS..Hα-helixtrans-72.8-28.4178.4-65.9-46.2000111.5A50 E51 L56 H62 R63A50-N54 WeakPolarHBondContact O-CB 3.3Å; A50-N54 PolarHBondContact O-N 3.1Å; A50-N54 PolarHBondContact O-ND2 2.92Å; E51-N54 PolarHBondContact O-N 3.12Å; N54-L56 VanDerWaalsContact C-N 3.28Å; N54-L56 PolarHBondContact O-N 3.05Å; N54-H62 PolarHBondContact ND2-CD2 3.06Å; N54-H62 PolarHBondContact ND2-NE2 3.36Å; N54-R63 PolarHBondContact ND2-O 2.9Å; N54-R63 PolarHBondContact OD1-N 3.24Å
55A93.8Very high91.5Very high79 Ų7962 Ų6265%0.65336%0.36SS*.Hα-helixtrans-70.9-14.9173.800000114.5E51 Q52 Y53 G57E51-A55 VanDerWaalsContact O-CB 3.31Å; E51-A55 WeakPolarHBondContact O-CB 3.34Å; E51-A55 PolarHBondContact O-N 3.15Å; Q52-A55 PolarHBondContact O-N 3.05Å; Y53-A55 VanDerWaalsContact C-N 3.33Å; A55-G57 PolarHBondContact O-N 3.42Å; A55-G57 VanDerWaalsContact O-N 3.17Å
56L89.2Confident91.4Very high85 Ų8567.3 Ų67.345%0.44538%0.383SS..THydrogen-bonded Turntrans-64-15174.7-67.5175000113.8D17 L21 Q52 Y53 N54D17-L56 HydrophobicContact CB-CD1 3.82Å; L21-L56 HydrophobicContact CD1-CD1 4.13Å; Q52-L56 WeakPolarHBondContact O-CG 3.37Å; Q52-L56 PolarHBondContact O-N 3.14Å; Y53-L56 WeakPolarHBondContact O-CB 3.35Å; Y53-L56 PolarHBondContact O-N 3.02Å; N54-L56 VanDerWaalsContact C-N 3.28Å; N54-L56 PolarHBondContact O-N 3.05Å
57G69.5Low91.3Very high38 Ų3867.9 Ų67.939%0.39239%0.393SS..  trans76.3178168.800000117A55A55-G57 PolarHBondContact O-N 3.42Å; A55-G57 VanDerWaalsContact O-N 3.17Å
58G77.8Confident91.3Very high71 Ų7164 Ų6473%0.73237%0.372SS*.SBendtrans90.2-178.9-175.300000114R60G58-R60 PolarHBondContact O-N 3.4Å
59D78.5Confident91.2Very high176 Ų17666 Ų6694%0.94138%0.375SS*.SBendtrans-70.126.2179.8-61.5-45.7000114.2
60R85.9Confident91.2Very high85 Ų8568.5 Ų68.532%0.32139%0.39SS..PPolyproline II helixtrans-74.4130.3-179.1-61.7-175.4-175.2-1613.2109.2D17 G58 H62D17-R60 IonicContact OD2-CZ 3.37Å; D17-R60 IonicContact OD2-NH1 2.82Å; D17-R60 PolarHBondContact OD2-NH1 2.88Å; D17-R60 IonicContact OD2-NH2 2.94Å; D17-R60 PolarHBondContact OD2-NH2 3.13Å; G58-R60 PolarHBondContact O-N 3.4Å; R60-H62 PolarHBondContact O-N 2.95Å
61P87Confident91.2Very high59 Ų5968.7 Ų68.738%0.38339%0.39SS..PPolyproline II helixtrans-60.2131.7173.6-23.834.1000111.1R63P61-R63 WeakPolarHBondContact O-CD 3.48Å; P61-R63 WeakPolarHBondContact O-CG 3.43Å; P61-R63 PolarHBondContact O-N 3Å; P61-R63 PolarHBondContact O-NE 3.36Å
62H89.9Confident91.3Very high148 Ų14862.9 Ų62.969%0.68536%0.362SS*.PPolyproline II helixtrans-52.8130.5177.7-178.9-87.5000111.7N54 R60N54-H62 PolarHBondContact ND2-CD2 3.06Å; N54-H62 PolarHBondContact ND2-NE2 3.36Å; R60-H62 PolarHBondContact O-N 2.95Å
63R92.4Very high91.3Very high12 Ų1265.7 Ų65.75%0.04537%0.373CS..  trans-112.3140.6-176.9-52.4-58.9-171.8159.86.5110.9S8 F10 E14 Y53 N54 P61 L68S8-R63 PolarHBondContact O-NH1 2.88Å; S8-R63 PolarHBondContact O-NH2 2.71Å; F10-R63 HydrophobicContact CE1-CG 3.88Å; F10-R63 HydrophobicContact CZ-CG 4.28Å; E14-R63 IonicContact OE1-CZ 2.6Å; E14-R63 IonicContact OE1-NE 3.13Å; E14-R63 IonicContact OE1-NH2 2.81Å; E14-R63 PolarHBondContact OE1-NH2 3.41Å; E14-R63 IonicContact OE2-NH2 3.83Å; Y53-R63 HydrophobicContact CD1-CB 4.14Å; Y53-R63 HydrophobicContact CD1-CG 4Å; Y53-R63 HydrophobicContact CE1-CB 4.01Å; Y53-R63 HydrophobicContact CE1-CG 3.36Å; N54-R63 PolarHBondContact ND2-O 2.9Å; N54-R63 PolarHBondContact OD1-N 3.24Å; P61-R63 WeakPolarHBondContact O-CD 3.48Å; P61-R63 WeakPolarHBondContact O-CG 3.43Å; P61-R63 PolarHBondContact O-N 3Å; P61-R63 PolarHBondContact O-NE 3.36Å; R63-L68 HydrophobicContact CB-CD1 4.48Å; R63-L68 HydrophobicContact CB-CD2 3.85Å; R63-L68 HydrophobicContact CB-CG 4.06Å; R63-L68 HydrophobicContact CG-CD2 4.21Å
64T95Very high91.3Very high87 Ų8774 Ų7453%0.53440%0.404SS..  trans-87.6153.3173.960.90000111.1Q66 G67 L68T64-Q66 PolarHBondContact O-N 3.4Å; T64-G67 WeakPolarHBondContact O-CA 3.35Å; T64-G67 PolarHBondContact O-N 2.93Å; T64-G67 PolarHBondContact OG1-N 2.84Å; T64-L68 PolarHBondContact O-N 3.42Å
65A96.4Very high91.5Very high17 Ų1772.4 Ų72.414%0.1440%0.395CS..Hα-helixtrans-46.7-46.5171.500000112.6W46 D47 A50 G67 L68 R69W46-A65 HydrophobicContact CB-CB 4.05Å; D47-A65 WeakPolarHBondContact OD1-CB 3.45Å; A50-A65 HydrophobicContact CB-CB 4.06Å; A65-G67 VanDerWaalsContact C-N 3.34Å; A65-G67 PolarHBondContact O-N 2.81Å; A65-L68 PolarHBondContact O-N 3.15Å; A65-R69 WeakPolarHBondContact O-CB 3.47Å; A65-R69 PolarHBondContact O-N 3.07Å
66Q96.2Very high91.6Very high122 Ų12270.4 Ų70.457%0.5737%0.372SS*.Hα-helixtrans-65.1-33.8176.7-175.264.4-7.700113.2T64 T70T64-Q66 PolarHBondContact O-N 3.4Å; Q66-T70 WeakPolarHBondContact O-CB 3.34Å; Q66-T70 PolarHBondContact O-N 3.32Å; Q66-T70 PolarHBondContact O-OG1 2.7Å
67G95.1Very high91.9Very high25 Ų2570.5 Ų70.526%0.25837%0.37SS..Hα-helixtrans-66.6-44.3174.400000112.3T64 A65 T70 L71T64-G67 WeakPolarHBondContact O-CA 3.35Å; T64-G67 PolarHBondContact O-N 2.93Å; T64-G67 PolarHBondContact OG1-N 2.84Å; A65-G67 VanDerWaalsContact C-N 3.34Å; A65-G67 PolarHBondContact O-N 2.81Å; G67-T70 WeakPolarHBondContact O-CB 3.2Å; G67-T70 PolarHBondContact O-N 2.99Å; G67-L71 PolarHBondContact O-N 3.22Å
68L96.6Very high93.1Very high0 Ų071.5 Ų71.50%037%0.371CS..Hα-helixtrans-68.6-42.1177-61.9179.9000112F10 L18 W46 V49 A50 Y53 R63 T64 A65 T70 L71 Y72F10-L68 HydrophobicContact CE1-CD2 4.01Å; F10-L68 HydrophobicContact CZ-CD2 4.28Å; L18-L68 HydrophobicContact CD1-CB 3.99Å; L18-L68 HydrophobicContact CD1-CD1 4.33Å; L18-L68 HydrophobicContact CD1-CD2 4.29Å; L18-L68 HydrophobicContact CD1-CG 4.43Å; L18-L68 HydrophobicContact CD2-CB 4.35Å; L18-L68 HydrophobicContact CD2-CD2 4.4Å; W46-L68 HydrophobicContact CE3-CB 4.37Å; W46-L68 HydrophobicContact CZ3-CB 4.25Å; V49-L68 HydrophobicContact CG1-CD1 4.34Å; A50-L68 HydrophobicContact CB-CD1 4.04Å; Y53-L68 HydrophobicContact CD1-CD1 4.2Å; Y53-L68 HydrophobicContact CD1-CD2 4.18Å; Y53-L68 HydrophobicContact CD2-CD1 4.23Å; Y53-L68 HydrophobicContact CD2-CD2 3.99Å; Y53-L68 HydrophobicContact CE1-CD2 4.2Å; Y53-L68 HydrophobicContact CE2-CD2 3.94Å; Y53-L68 HydrophobicContact CG-CD1 3.79Å; Y53-L68 HydrophobicContact CG-CD2 4.09Å; R63-L68 HydrophobicContact CB-CD1 4.48Å; R63-L68 HydrophobicContact CB-CD2 3.85Å; R63-L68 HydrophobicContact CB-CG 4.06Å; R63-L68 HydrophobicContact CG-CD2 4.21Å; T64-L68 PolarHBondContact O-N 3.42Å; A65-L68 PolarHBondContact O-N 3.15Å; L68-T70 VanDerWaalsContact C-N 3.27Å; L68-T70 PolarHBondContact O-N 3.03Å; L68-L71 PolarHBondContact O-N 3.3Å; L68-L71 VanDerWaalsContact O-N 3.15Å; L68-Y72 WeakPolarHBondContact O-CB 3.46Å; L68-Y72 PolarHBondContact O-N 2.85Å
69R97.2Very high93.9Very high93 Ų9368.1 Ų68.135%0.35134%0.336SS..Hα-helixtrans-55.5-42.6170.2-175.5174.8-176.8162.3-0111.9N43 W46 A65 K73N43-R69 PolarHBondContact OD1-NH1 3.36Å; N43-R69 VanDerWaalsContact OD1-NH1 3.09Å; W46-R69 HydrophobicContact CD2-CB 3.75Å; W46-R69 HydrophobicContact CD2-CG 4.17Å; W46-R69 HydrophobicContact CE3-CB 4.05Å; W46-R69 HydrophobicContact CG-CB 4.25Å; W46-R69 HydrophobicContact CH2-CB 4.42Å; W46-R69 HydrophobicContact CZ2-CB 4.11Å; W46-R69 HydrophobicContact CZ2-CG 4.04Å; W46-R69 HydrophobicContact CZ3-CB 4.37Å; A65-R69 WeakPolarHBondContact O-CB 3.47Å; A65-R69 PolarHBondContact O-N 3.07Å; R69-K73 PolarHBondContact O-N 2.92Å
70T96.6Very high94.5Very high52 Ų5263.7 Ų63.732%0.31931%0.309SS..Hα-helixtrans-66.2-42.9175.9-57.20000112Q66 G67 L68 K73 R74Q66-T70 WeakPolarHBondContact O-CB 3.34Å; Q66-T70 PolarHBondContact O-N 3.32Å; Q66-T70 PolarHBondContact O-OG1 2.7Å; G67-T70 WeakPolarHBondContact O-CB 3.2Å; G67-T70 PolarHBondContact O-N 2.99Å; L68-T70 VanDerWaalsContact C-N 3.27Å; L68-T70 PolarHBondContact O-N 3.03Å; T70-K73 PolarHBondContact O-N 3.29Å; T70-R74 WeakPolarHBondContact O-CG 3.31Å; T70-R74 PolarHBondContact O-N 3.4Å; T70-R74 VanDerWaalsContact O-N 3.07Å
71L96Very high94.8Very high14 Ų1464.1 Ų64.17%0.07331%0.314CS..Hα-helixtrans-60.9-48.7175.2178.261000111.1F10 K15 L18 G67 L68 K73 R74 L75F10-L71 HydrophobicContact CB-CD1 4.25Å; F10-L71 HydrophobicContact CB-CD2 3.96Å; F10-L71 HydrophobicContact CD1-CD2 3.51Å; F10-L71 HydrophobicContact CD2-CB 4.44Å; F10-L71 HydrophobicContact CD2-CD1 3.87Å; F10-L71 HydrophobicContact CD2-CD2 3.76Å; F10-L71 HydrophobicContact CD2-CG 4.24Å; F10-L71 HydrophobicContact CE1-CD2 3.76Å; F10-L71 HydrophobicContact CE2-CB 4.16Å; F10-L71 HydrophobicContact CE2-CD1 4.42Å; F10-L71 HydrophobicContact CE2-CD2 4.02Å; F10-L71 HydrophobicContact CE2-CG 4.44Å; F10-L71 HydrophobicContact CG-CD1 4.15Å; F10-L71 HydrophobicContact CG-CD2 3.48Å; F10-L71 VanDerWaalsContact CG-CD2 3.48Å; F10-L71 HydrophobicContact CG-CG 4.38Å; F10-L71 HydrophobicContact CZ-CB 4.4Å; F10-L71 HydrophobicContact CZ-CD2 4Å; K15-L71 HydrophobicContact CG-CD1 4.36Å; K15-L71 HydrophobicContact CG-CD2 4.36Å; L18-L71 HydrophobicContact CD2-CB 4Å; L18-L71 HydrophobicContact CD2-CD2 3.67Å; L18-L71 HydrophobicContact CD2-CG 3.88Å; G67-L71 PolarHBondContact O-N 3.22Å; L68-L71 PolarHBondContact O-N 3.3Å; L68-L71 VanDerWaalsContact O-N 3.15Å; L71-K73 PolarHBondContact O-N 3.09Å; L71-R74 CarbonylContact O-C 3.59Å; L71-R74 WeakPolarHBondContact O-CA 3.37Å; L71-R74 WeakPolarHBondContact O-CB 3.19Å; L71-R74 PolarHBondContact O-N 3.45Å; L71-R74 VanDerWaalsContact O-N 3.07Å; L71-L75 HydrophobicContact CD1-CD1 4.35Å; L71-L75 HydrophobicContact CD1-CG 4.14Å; L71-L75 HydrophobicContact CG-CD1 3.99Å; L71-L75 HydrophobicContact CG-CG 4.24Å; L71-L75 WeakPolarHBondContact O-CG 3.37Å; L71-L75 PolarHBondContact O-N 2.62Å
72Y97.4Very high95.1Very high7 Ų763.3 Ų63.33%0.02731%0.305CS..Hα-helixtrans-59-44.2178.6176.4-113.3000112.6L19 V22 E30 W46 L68 R74 L75 K76 I108L19-Y72 HydrophobicContact CD2-CD2 4.07Å; L19-Y72 HydrophobicContact CD2-CE2 4.16Å; V22-Y72 HydrophobicContact CG1-CD2 4.06Å; V22-Y72 HydrophobicContact CG1-CE1 4.39Å; V22-Y72 HydrophobicContact CG1-CE2 3.58Å; E30-Y72 WeakPolarHBondContact OE1-CE1 3.11Å; E30-Y72 VanDerWaalsContact OE1-CZ 3.29Å; E30-Y72 PolarHBondContact OE1-OH 3.2Å; W46-Y72 AromaticContact CH2-CD1 3.63Å; W46-Y72 HydrophobicContact CH2-CD1 3.63Å; W46-Y72 HydrophobicContact CH2-CE1 4.43Å; W46-Y72 AromaticContact CH2-CG 3.74Å; W46-Y72 HydrophobicContact CH2-CG 3.74Å; W46-Y72 AromaticContact CZ2-CD1 3.7Å; W46-Y72 HydrophobicContact CZ2-CD1 3.7Å; W46-Y72 HydrophobicContact CZ2-CE1 4.31Å; W46-Y72 HydrophobicContact CZ2-CG 4.29Å; L68-Y72 WeakPolarHBondContact O-CB 3.46Å; L68-Y72 PolarHBondContact O-N 2.85Å; Y72-R74 VanDerWaalsContact C-N 3.31Å; Y72-R74 PolarHBondContact O-N 3.19Å; Y72-L75 PolarHBondContact O-N 3.39Å; Y72-K76 HydrophobicContact CE1-CD 3.93Å; Y72-K76 HydrophobicContact CE1-CG 4.46Å; Y72-K76 HydrophobicContact CE2-CD 4.29Å; Y72-K76 HydrophobicContact CE2-CG 4.18Å; Y72-K76 PolarHBondContact O-N 3.15Å; Y72-I108 HydrophobicContact CE2-CD1 4.43Å; Y72-I108 WeakPolarHBondContact OH-CD1 3.47Å
73K96.8Very high95Very high160 Ų16056.6 Ų56.670%0.69628%0.275SS*.Hα-helixtrans-56.6-44.8172.5-177.1-179.9175.6-178.70111.5R69 T70 L71 K76 E77R69-K73 PolarHBondContact O-N 2.92Å; T70-K73 PolarHBondContact O-N 3.29Å; L71-K73 PolarHBondContact O-N 3.09Å; K73-K76 PolarHBondContact O-N 2.87Å; K73-E77 PolarHBondContact O-N 2.64Å; K73-E77 VanDerWaalsContact O-N 3.12Å
74R96.8Very high94.7Very high178 Ų17860 Ų6067%0.67229%0.292SS*.Hα-helixtrans-66.2-37.1176.8-71174.6-177.2179.22112.7T70 L71 Y72 E77 S78T70-R74 WeakPolarHBondContact O-CG 3.31Å; T70-R74 PolarHBondContact O-N 3.4Å; T70-R74 VanDerWaalsContact O-N 3.07Å; L71-R74 CarbonylContact O-C 3.59Å; L71-R74 WeakPolarHBondContact O-CA 3.37Å; L71-R74 WeakPolarHBondContact O-CB 3.19Å; L71-R74 PolarHBondContact O-N 3.45Å; L71-R74 VanDerWaalsContact O-N 3.07Å; Y72-R74 VanDerWaalsContact C-N 3.31Å; Y72-R74 PolarHBondContact O-N 3.19Å; R74-E77 PolarHBondContact O-N 3.05Å; R74-S78 VanDerWaalsContact O-CB 3.26Å; R74-S78 WeakPolarHBondContact O-CB 3.19Å; R74-S78 PolarHBondContact O-N 3.44Å
75L97Very high94.3Very high13 Ų1362.1 Ų62.17%0.06830%0.296CS..Hα-helixtrans-66.2-44.4176.4-68.8172.4000111K15 L19 L71 Y72 E77 S78 A79 P100 I104K15-L75 HydrophobicContact CB-CD1 4.18Å; K15-L75 HydrophobicContact CB-CD2 4.22Å; K15-L75 HydrophobicContact CD-CD2 3.97Å; K15-L75 HydrophobicContact CG-CD1 4.37Å; K15-L75 HydrophobicContact CG-CD2 3.99Å; L19-L75 HydrophobicContact CD1-CD1 4.41Å; L19-L75 HydrophobicContact CD2-CD1 4.34Å; L19-L75 HydrophobicContact CG-CD1 4.23Å; L71-L75 HydrophobicContact CD1-CD1 4.35Å; L71-L75 HydrophobicContact CD1-CG 4.14Å; L71-L75 HydrophobicContact CG-CD1 3.99Å; L71-L75 HydrophobicContact CG-CG 4.24Å; L71-L75 WeakPolarHBondContact O-CG 3.37Å; L71-L75 PolarHBondContact O-N 2.62Å; Y72-L75 PolarHBondContact O-N 3.39Å; L75-E77 VanDerWaalsContact C-N 3.29Å; L75-E77 PolarHBondContact O-N 2.72Å; L75-S78 PolarHBondContact O-N 2.66Å; L75-A79 VanDerWaalsContact O-CB 3.3Å; L75-A79 WeakPolarHBondContact O-CB 3.39Å; L75-A79 PolarHBondContact O-N 3.47Å; L75-P100 HydrophobicContact CD2-CB 4.29Å; L75-I104 HydrophobicContact CB-CD1 3.62Å; L75-I104 WeakPolarHBondContact O-CD1 2.87Å
76K96Very high93.7Very high37 Ų3764.1 Ų64.116%0.16130%0.3CS..Hα-helixtrans-58.4-41.1173.7-70.8-160.8-56.2-173.40112.4E30 Y72 K73 K80 I104 I108 L111E30-K76 IonicContact OE1-NZ 3.84Å; E30-K76 PolarHBondContact OE1-NZ 3.05Å; E30-K76 IonicContact OE2-NZ 3.62Å; E30-K76 PolarHBondContact OE2-NZ 3.05Å; Y72-K76 HydrophobicContact CE1-CD 3.93Å; Y72-K76 HydrophobicContact CE1-CG 4.46Å; Y72-K76 HydrophobicContact CE2-CD 4.29Å; Y72-K76 HydrophobicContact CE2-CG 4.18Å; Y72-K76 PolarHBondContact O-N 3.15Å; K73-K76 PolarHBondContact O-N 2.87Å; K76-K80 PolarHBondContact O-N 2.95Å; K76-I104 HydrophobicContact CG-CG2 4.45Å; K76-I108 HydrophobicContact CD-CD1 3.55Å; K76-I108 HydrophobicContact CG-CD1 4.17Å; K76-L111 HydrophobicContact CB-CD2 4.01Å; K76-L111 HydrophobicContact CD-CD2 4.17Å; K76-L111 HydrophobicContact CG-CD2 4.16Å
77E95.7Very high92.8Very high86 Ų8663.4 Ų63.440%0.40229%0.292SS..Hα-helixtrans-71.3-45.5178.7-173.753.8-147.600112.1K73 R74 L75 A79 K80 Q81K73-E77 PolarHBondContact O-N 2.64Å; K73-E77 VanDerWaalsContact O-N 3.12Å; R74-E77 PolarHBondContact O-N 3.05Å; L75-E77 VanDerWaalsContact C-N 3.29Å; L75-E77 PolarHBondContact O-N 2.72Å; E77-A79 PolarHBondContact O-N 3.39Å; E77-K80 WeakPolarHBondContact O-CB 3.38Å; E77-K80 PolarHBondContact O-N 3.19Å; E77-K80 VanDerWaalsContact O-N 3.16Å; E77-Q81 WeakPolarHBondContact O-CG 3.46Å; E77-Q81 PolarHBondContact O-N 3.47Å; E77-Q81 PolarHBondContact OE1-NE2 3.4Å
78S94.3Very high92.1Very high59 Ų5968.4 Ų68.441%0.41331%0.308SS..Hα-helixtrans-56.6-39173.3-171.10000111.9R74 L75 Q81 E82R74-S78 VanDerWaalsContact O-CB 3.26Å; R74-S78 WeakPolarHBondContact O-CB 3.19Å; R74-S78 PolarHBondContact O-N 3.44Å; L75-S78 PolarHBondContact O-N 2.66Å; S78-Q81 PolarHBondContact O-N 2.89Å; S78-E82 VanDerWaalsContact O-CB 3.29Å; S78-E82 WeakPolarHBondContact O-CB 3.39Å; S78-E82 PolarHBondContact O-N 3.39Å
79A94.3Very high91.3Very high0 Ų070 Ų700%032%0.321CS..Hα-helixtrans-65-42.6177.500000112.4L75 E77 V83 T101 I104 F112L75-A79 VanDerWaalsContact O-CB 3.3Å; L75-A79 WeakPolarHBondContact O-CB 3.39Å; L75-A79 PolarHBondContact O-N 3.47Å; E77-A79 PolarHBondContact O-N 3.39Å; A79-V83 WeakPolarHBondContact O-CB 3.47Å; A79-V83 VanDerWaalsContact O-CG2 3.3Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.48Å; A79-V83 VanDerWaalsContact O-N 3.11Å; A79-T101 WeakPolarHBondContact CA-OG1 3.29Å; A79-T101 HydrophobicContact CB-CG2 3.81Å; A79-I104 HydrophobicContact CB-CB 4.26Å; A79-I104 HydrophobicContact CB-CD1 4.07Å; A79-I104 HydrophobicContact CB-CG2 4.1Å; A79-F112 HydrophobicContact CB-CE1 4.31Å; A79-F112 HydrophobicContact CB-CZ 3.97Å
80K92.8Very high90.1Very high84 Ų8471.5 Ų71.537%0.36533%0.333SS..Hα-helixtrans-61.5-46.2172.3-70.1177.8180-178.30111.7K76 E77 V83 M84 L111K76-K80 PolarHBondContact O-N 2.95Å; E77-K80 WeakPolarHBondContact O-CB 3.38Å; E77-K80 PolarHBondContact O-N 3.19Å; E77-K80 VanDerWaalsContact O-N 3.16Å; K80-V83 PolarHBondContact O-N 3.39Å; K80-M84 WeakPolarHBondContact O-CB 3.41Å; K80-M84 PolarHBondContact O-N 3.12Å; K80-L111 HydrophobicContact CG-CG 4.38Å
81Q92.3Very high88.9Confident93 Ų9372 Ų7244%0.43534%0.336SS..Hα-helixtrans-64.6-42.8-178.2-70.2176.57.800111.7E77 S78 M84 Q85E77-Q81 WeakPolarHBondContact O-CG 3.46Å; E77-Q81 PolarHBondContact O-N 3.47Å; E77-Q81 PolarHBondContact OE1-NE2 3.4Å; S78-Q81 PolarHBondContact O-N 2.89Å; Q81-M84 PolarHBondContact O-N 3.47Å; Q81-Q85 WeakPolarHBondContact O-CB 3.3Å; Q81-Q85 WeakPolarHBondContact O-CG 3.37Å; Q81-Q85 PolarHBondContact O-N 2.98Å
82E91.9Very high87.9Confident43 Ų4378.6 Ų78.620%0.20137%0.367CS..Hα-helixtrans-63.3-46.4176.9-174178.8175.400111.8S78 M84 Q85 R86 I97 S98 T101S78-E82 VanDerWaalsContact O-CB 3.29Å; S78-E82 WeakPolarHBondContact O-CB 3.39Å; S78-E82 PolarHBondContact O-N 3.39Å; E82-M84 VanDerWaalsContact C-N 3.33Å; E82-M84 PolarHBondContact O-N 3.24Å; E82-Q85 PolarHBondContact O-N 2.84Å; E82-R86 WeakPolarHBondContact O-CB 3.26Å; E82-R86 PolarHBondContact O-N 3.47Å; E82-I97 HydrophobicContact CG-CG1 4.5Å; E82-I97 WeakPolarHBondContact OE1-CA 3.39Å; E82-S98 WeakPolarHBondContact OE1-CB 3.29Å; E82-S98 PolarHBondContact OE1-N 3.16Å; E82-S98 PolarHBondContact OE1-OG 3.23Å; E82-S98 WeakPolarHBondContact OE2-CB 3.48Å; E82-S98 PolarHBondContact OE2-OG 3.29Å; E82-T101 HydrophobicContact CB-CG2 4.49Å; E82-T101 WeakPolarHBondContact OE2-CB 3.43Å; E82-T101 PolarHBondContact OE2-OG1 2.82Å
83V88.4Confident86.4Confident7 Ų787.1 Ų87.14%0.04240%0.4CS..Hα-helixtrans-61.7-41.3175.3170.90000111.2A79 K80 R87 I97 T101 M105 F112 V115 L124A79-V83 WeakPolarHBondContact O-CB 3.47Å; A79-V83 VanDerWaalsContact O-CG2 3.3Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.48Å; A79-V83 VanDerWaalsContact O-N 3.11Å; K80-V83 PolarHBondContact O-N 3.39Å; V83-R87 PolarHBondContact O-N 3.07Å; V83-I97 HydrophobicContact CG2-CD1 3.81Å; V83-T101 HydrophobicContact CG2-CG2 4.1Å; V83-M105 HydrophobicContact CG2-SD 4.08Å; V83-F112 HydrophobicContact CB-CD1 4.41Å; V83-F112 HydrophobicContact CB-CE1 4.46Å; V83-F112 HydrophobicContact CG1-CD1 4.41Å; V83-F112 HydrophobicContact CG2-CD1 4.12Å; V83-F112 HydrophobicContact CG2-CE1 3.94Å; V83-V115 HydrophobicContact CG1-CG1 3.98Å; V83-V115 HydrophobicContact CG1-CG2 4.48Å; V83-L124 HydrophobicContact CG1-CD2 4.44Å
84M86.3Confident85.5Confident83 Ų8381.5 Ų81.541%0.40938%0.375SS..Hα-helixtrans-66.6-46177.2-171.164.375.500111.9K80 Q81 E82 R86 R87 H88K80-M84 WeakPolarHBondContact O-CB 3.41Å; K80-M84 PolarHBondContact O-N 3.12Å; Q81-M84 PolarHBondContact O-N 3.47Å; E82-M84 VanDerWaalsContact C-N 3.33Å; E82-M84 PolarHBondContact O-N 3.24Å; M84-R86 PolarHBondContact O-N 3.16Å; M84-R87 WeakPolarHBondContact O-CB 3.47Å; M84-R87 PolarHBondContact O-N 3.38Å; M84-H88 PolarHBondContact O-CD2 3.17Å; M84-H88 PolarHBondContact O-N 3.32Å
85Q85.8Confident84.4Confident131 Ų13175.5 Ų75.561%0.61237%0.368SS*.Hα-helixtrans-60.6-45.2176.9-73.416920.400111.1Q81 E82 R87 H88 A89Q81-Q85 WeakPolarHBondContact O-CB 3.3Å; Q81-Q85 WeakPolarHBondContact O-CG 3.37Å; Q81-Q85 PolarHBondContact O-N 2.98Å; E82-Q85 PolarHBondContact O-N 2.84Å; Q85-R87 VanDerWaalsContact C-N 3.29Å; Q85-R87 PolarHBondContact O-N 3.42Å; Q85-H88 PolarHBondContact O-N 3.09Å; Q85-H88 VanDerWaalsContact O-N 3.08Å; Q85-A89 PolarHBondContact O-N 2.99Å
86R83.7Confident83.7Confident59 Ų5980.1 Ų80.122%0.22340%0.402CS..Hα-helixtrans-61.7-32.6176.1-178.8178.4159.6121.70.2113E82 M84 H88 R94 G95 D121E82-R86 WeakPolarHBondContact O-CB 3.26Å; E82-R86 PolarHBondContact O-N 3.47Å; M84-R86 PolarHBondContact O-N 3.16Å; R86-H88 VanDerWaalsContact C-N 3.33Å; R86-R94 HydrophobicContact CG-CB 4.21Å; R86-R94 HydrophobicContact CG-CG 4.07Å; R86-R94 PolarHBondContact O-NE 3.28Å; R86-G95 PolarHBondContact NH1-O 2.58Å; R86-D121 IonicContact CZ-OD1 2.9Å; R86-D121 IonicContact NE-OD1 2.88Å; R86-D121 IonicContact NH2-OD1 3.94Å; R86-D121 PolarHBondContact NH2-OD1 3.1Å
87R77.7Confident83.3Confident107 Ų10779.2 Ų79.240%0.40440%0.399SS..Hα-helixtrans-61.2-42.4172.6177.5-173.2177.9-102.1-1.3111.6V83 M84 Q85 R94V83-R87 PolarHBondContact O-N 3.07Å; M84-R87 WeakPolarHBondContact O-CB 3.47Å; M84-R87 PolarHBondContact O-N 3.38Å; Q85-R87 VanDerWaalsContact C-N 3.29Å; Q85-R87 PolarHBondContact O-N 3.42Å; R87-R94 PolarHBondContact O-NH2 3.49Å
88H79.8Confident83.2Confident130 Ų13077.3 Ų77.360%0.60239%0.394SS*.Hα-helixtrans-82.9-16.5-177.4-72.4-73.2000114.3M84 Q85 R86M84-H88 PolarHBondContact O-CD2 3.17Å; M84-H88 PolarHBondContact O-N 3.32Å; Q85-H88 PolarHBondContact O-N 3.09Å; Q85-H88 VanDerWaalsContact O-N 3.08Å; R86-H88 VanDerWaalsContact C-N 3.33Å
89A80.8Confident83.2Confident33 Ų3378.8 Ų78.827%0.27340%0.395SS..SBendtrans-70.4142.3171.700000111.6Q85 R94Q85-A89 PolarHBondContact O-N 2.99Å; A89-R94 HydrophobicContact CB-CG 4.31Å; A89-R94 PolarHBondContact O-NE 3.15Å
90Q71.3Confident83.2Confident126 Ų12679.3 Ų79.359%0.58940%0.398SS*.  trans-57147.8171.6-59.9-66.3-6.200110.2E92 Y93 R94Q90-E92 PolarHBondContact O-N 2.62Å; Q90-E92 VanDerWaalsContact O-N 3.07Å; Q90-Y93 HydrophobicContact CB-CD2 3.93Å; Q90-Y93 HydrophobicContact CG-CD2 4.34Å; Q90-Y93 CarbonylContact O-C 3.58Å; Q90-Y93 PolarHBondContact O-N 2.7Å; Q90-R94 PolarHBondContact O-N 3.26Å
91P71.3Confident83.3Confident61 Ų6175.4 Ų75.440%0.39638%0.381SS..G310 helixtrans-50.8-38-174.2-26.434000114.3Y93 R94P91-Y93 VanDerWaalsContact C-N 3.33Å; P91-Y93 PolarHBondContact O-N 3.02Å; P91-R94 WeakPolarHBondContact O-CB 3.36Å; P91-R94 PolarHBondContact O-N 2.75Å
92E75.7Confident83.4Confident153 Ų15375.1 Ų75.172%0.71538%0.376SS*.G310 helixtrans-73-24.5-177.6-56.967.7-143.900112.4Q90Q90-E92 PolarHBondContact O-N 2.62Å; Q90-E92 VanDerWaalsContact O-N 3.07Å
93Y66.7Low83.6Confident187 Ų18776.6 Ų76.673%0.73338%0.38SS*.G310 helixtrans-10111.6177.8-58.8-56.9000113.1Q90 P91 G95Q90-Y93 HydrophobicContact CB-CD2 3.93Å; Q90-Y93 HydrophobicContact CG-CD2 4.34Å; Q90-Y93 CarbonylContact O-C 3.58Å; Q90-Y93 PolarHBondContact O-N 2.7Å; P91-Y93 VanDerWaalsContact C-N 3.33Å; P91-Y93 PolarHBondContact O-N 3.02Å; Y93-G95 VanDerWaalsContact C-N 3.32Å; Y93-G95 PolarHBondContact O-N 2.73Å
94R77.5Confident83.9Confident42 Ų4276.3 Ų76.316%0.15838%0.378CS..  trans-76.280.5175-70.8179.6176.5-164.6-12.7111.7R86 R87 A89 Q90 P91 D121R86-R94 HydrophobicContact CG-CB 4.21Å; R86-R94 HydrophobicContact CG-CG 4.07Å; R86-R94 PolarHBondContact O-NE 3.28Å; R87-R94 PolarHBondContact O-NH2 3.49Å; A89-R94 HydrophobicContact CB-CG 4.31Å; A89-R94 PolarHBondContact O-NE 3.15Å; Q90-R94 PolarHBondContact O-N 3.26Å; P91-R94 WeakPolarHBondContact O-CB 3.36Å; P91-R94 PolarHBondContact O-N 2.75Å; R94-D121 IonicContact CZ-OD2 3.21Å; R94-D121 IonicContact NH1-OD1 3.56Å; R94-D121 IonicContact NH1-OD2 2.71Å; R94-D121 PolarHBondContact NH1-OD2 3.02Å
95G73.4Confident84.2Confident52 Ų5272.4 Ų72.454%0.53636%0.359SS..PPolyproline II helixtrans-51.6155.4171.600000113.5R86 Y93 I97R86-G95 PolarHBondContact NH1-O 2.58Å; Y93-G95 VanDerWaalsContact C-N 3.32Å; Y93-G95 PolarHBondContact O-N 2.73Å; G95-I97 PolarHBondContact O-N 3.11Å
96S81.8Confident84.5Confident110 Ų11068.6 Ų68.677%0.76934%0.341SS*.PPolyproline II helixtrans-56.8135.9176.954.60000111.5
97I88.2Confident84.9Confident18 Ų1866.5 Ų66.59%0.09233%0.334CS..PPolyproline II helixtrans-67.1139.7174.6-156.4162.4000110.6E82 V83 G95 T101 R102 M105 L124E82-I97 HydrophobicContact CG-CG1 4.5Å; E82-I97 WeakPolarHBondContact OE1-CA 3.39Å; V83-I97 HydrophobicContact CG2-CD1 3.81Å; G95-I97 PolarHBondContact O-N 3.11Å; I97-T101 HydrophobicContact CD1-CG2 3.54Å; I97-T101 HydrophobicContact CG1-CG2 3.53Å; I97-R102 HydrophobicContact CG2-CB 4.39Å; I97-M105 HydrophobicContact CD1-SD 3.53Å; I97-M105 VanDerWaalsContact CD1-SD 3.53Å; I97-L124 HydrophobicContact CD1-CD1 3.95Å
98S92.8Very high85.7Confident45 Ų4561.4 Ų61.432%0.31532%0.315SS..PPolyproline II helixtrans-68.9145.9-17877.40000111.6E82 T101 R102E82-S98 WeakPolarHBondContact OE1-CB 3.29Å; E82-S98 PolarHBondContact OE1-N 3.16Å; E82-S98 PolarHBondContact OE1-OG 3.23Å; E82-S98 WeakPolarHBondContact OE2-CB 3.48Å; E82-S98 PolarHBondContact OE2-OG 3.29Å; S98-T101 WeakPolarHBondContact O-CB 3.19Å; S98-T101 PolarHBondContact O-N 3.29Å; S98-T101 WeakPolarHBondContact OG-CB 3.33Å; S98-T101 PolarHBondContact OG-OG1 2.86Å; S98-R102 PolarHBondContact O-N 3.42Å
99E95.3Very high86.2Confident90 Ų9056.4 Ų56.442%0.42129%0.294SS..Hα-helixtrans-59.8-37.6-178.6-68.5-53.6133.500114.7L16 T101 R102 R103L16-E99 HydrophobicContact CD2-CB 4.16Å; E99-T101 VanDerWaalsContact C-N 3.3Å; E99-T101 PolarHBondContact O-N 3.36Å; E99-R102 VanDerWaalsContact CD-NE 3.27Å; E99-R102 PolarHBondContact O-N 2.96Å; E99-R102 IonicContact OE1-CZ 3.8Å; E99-R102 IonicContact OE1-NE 3.61Å; E99-R102 PolarHBondContact OE1-NE 3.5Å; E99-R102 IonicContact OE1-NH2 3.47Å; E99-R102 PolarHBondContact OE1-NH2 3.05Å; E99-R102 WeakPolarHBondContact OE2-CD 3.49Å; E99-R102 IonicContact OE2-CZ 2.79Å; E99-R102 IonicContact OE2-NE 2.66Å; E99-R102 PolarHBondContact OE2-NE 3.15Å; E99-R103 WeakPolarHBondContact O-CB 3.37Å; E99-R103 PolarHBondContact O-N 2.97Å
100P94.8Very high86.5Confident11 Ų1158.8 Ų58.87%0.07130%0.3CS..Hα-helixtrans-60-39.6171.8-24.335.8000112.6L12 L16 L19 L75 R103 I104L12-P100 HydrophobicContact CD1-CG 3.52Å; L16-P100 HydrophobicContact CD2-CG 4.09Å; L19-P100 HydrophobicContact CD1-CB 4.1Å; L75-P100 HydrophobicContact CD2-CB 4.29Å; P100-R103 PolarHBondContact O-N 2.87Å; P100-I104 WeakPolarHBondContact O-CG1 3.15Å; P100-I104 PolarHBondContact O-N 2.89Å
101T94.7Very high87.3Confident2 Ų254.4 Ų54.41%0.01228%0.28CS..Hα-helixtrans-69-46.9177.3-66.70000111.3A79 E82 V83 I97 S98 E99 R103 I104 M105A79-T101 WeakPolarHBondContact CA-OG1 3.29Å; A79-T101 HydrophobicContact CB-CG2 3.81Å; E82-T101 HydrophobicContact CB-CG2 4.49Å; E82-T101 WeakPolarHBondContact OE2-CB 3.43Å; E82-T101 PolarHBondContact OE2-OG1 2.82Å; V83-T101 HydrophobicContact CG2-CG2 4.1Å; I97-T101 HydrophobicContact CD1-CG2 3.54Å; I97-T101 HydrophobicContact CG1-CG2 3.53Å; S98-T101 WeakPolarHBondContact O-CB 3.19Å; S98-T101 PolarHBondContact O-N 3.29Å; S98-T101 WeakPolarHBondContact OG-CB 3.33Å; S98-T101 PolarHBondContact OG-OG1 2.86Å; E99-T101 VanDerWaalsContact C-N 3.3Å; E99-T101 PolarHBondContact O-N 3.36Å; T101-R103 VanDerWaalsContact C-N 3.26Å; T101-R103 PolarHBondContact O-N 3.12Å; T101-I104 PolarHBondContact O-N 2.93Å; T101-I104 VanDerWaalsContact O-N 3.16Å; T101-M105 HydrophobicContact CG2-SD 4.24Å; T101-M105 WeakPolarHBondContact O-CG 3.43Å; T101-M105 PolarHBondContact O-N 3.47Å
102R93.9Very high88Confident88 Ų8851.5 Ų51.533%0.33226%0.261SS..Hα-helixtrans-51.7-47.5172.6-171.6-161.9-56.5-80.9-0.4110.9I97 S98 E99 I104 M105 E106 L127I97-R102 HydrophobicContact CG2-CB 4.39Å; S98-R102 PolarHBondContact O-N 3.42Å; E99-R102 VanDerWaalsContact CD-NE 3.27Å; E99-R102 PolarHBondContact O-N 2.96Å; E99-R102 IonicContact OE1-CZ 3.8Å; E99-R102 IonicContact OE1-NE 3.61Å; E99-R102 PolarHBondContact OE1-NE 3.5Å; E99-R102 IonicContact OE1-NH2 3.47Å; E99-R102 PolarHBondContact OE1-NH2 3.05Å; E99-R102 WeakPolarHBondContact OE2-CD 3.49Å; E99-R102 IonicContact OE2-CZ 2.79Å; E99-R102 IonicContact OE2-NE 2.66Å; E99-R102 PolarHBondContact OE2-NE 3.15Å; R102-I104 PolarHBondContact O-N 3.39Å; R102-M105 WeakPolarHBondContact O-CB 3.48Å; R102-M105 PolarHBondContact O-N 3.4Å; R102-E106 PolarHBondContact O-N 3.06Å; R102-E106 VanDerWaalsContact O-N 3.1Å; R102-L127 HydrophobicContact CG-CD2 3.98Å
103R95.1Very high88.1Confident74 Ų7449.6 Ų49.628%0.27925%0.252SS..Hα-helixtrans-68.2-33.8-177.6-169.253164.1-159.3-10.5113.1L19 E99 P100 T101 E106 M107L19-R103 HydrophobicContact CB-CG 4.11Å; L19-R103 HydrophobicContact CD1-CB 4.16Å; L19-R103 HydrophobicContact CD1-CG 4.34Å; E99-R103 WeakPolarHBondContact O-CB 3.37Å; E99-R103 PolarHBondContact O-N 2.97Å; P100-R103 PolarHBondContact O-N 2.87Å; T101-R103 VanDerWaalsContact C-N 3.26Å; T101-R103 PolarHBondContact O-N 3.12Å; R103-E106 WeakPolarHBondContact CD-OE2 3.41Å; R103-E106 IonicContact CZ-OE2 3.53Å; R103-E106 IonicContact NE-OE2 2.7Å; R103-E106 IonicContact NH1-OE2 3.58Å; R103-E106 PolarHBondContact NH1-OE2 3.07Å; R103-M107 HydrophobicContact CG-SD 3.86Å; R103-M107 WeakPolarHBondContact O-CB 3.3Å; R103-M107 WeakPolarHBondContact O-CG 3.36Å; R103-M107 PolarHBondContact O-N 3.21Å
104I95.1Very high88.1Confident1 Ų149.1 Ų49.11%0.00526%0.256CS..Hα-helixtrans-67.2-41.8172.1-74.3165.1000111.4L19 L75 K76 A79 P100 T101 R102 E106 M107 I108 L111 F112L19-I104 HydrophobicContact CD1-CD1 4.37Å; L19-I104 HydrophobicContact CD1-CG1 4.12Å; L19-I104 HydrophobicContact CD2-CD1 4.11Å; L19-I104 HydrophobicContact CD2-CG1 3.7Å; L75-I104 HydrophobicContact CB-CD1 3.62Å; L75-I104 WeakPolarHBondContact O-CD1 2.87Å; K76-I104 HydrophobicContact CG-CG2 4.45Å; A79-I104 HydrophobicContact CB-CB 4.26Å; A79-I104 HydrophobicContact CB-CD1 4.07Å; A79-I104 HydrophobicContact CB-CG2 4.1Å; P100-I104 WeakPolarHBondContact O-CG1 3.15Å; P100-I104 PolarHBondContact O-N 2.89Å; T101-I104 PolarHBondContact O-N 2.93Å; T101-I104 VanDerWaalsContact O-N 3.16Å; R102-I104 PolarHBondContact O-N 3.39Å; I104-E106 VanDerWaalsContact C-N 3.32Å; I104-E106 PolarHBondContact O-N 3.32Å; I104-M107 PolarHBondContact O-N 2.75Å; I104-M107 VanDerWaalsContact O-N 3.09Å; I104-I108 HydrophobicContact CG2-CD1 4.32Å; I104-I108 PolarHBondContact O-N 2.92Å; I104-L111 HydrophobicContact CG2-CD2 3.85Å; I104-F112 HydrophobicContact CG2-CE2 3.99Å; I104-F112 HydrophobicContact CG2-CZ 3.9Å
105M92.7Very high87.3Confident0 Ų048.1 Ų48.10%026%0.255CS..Hα-helixtrans-60-40.8176.6-67.9171.372.200112.5V83 I97 T101 R102 M107 P109 F112 L124 L127 I128V83-M105 HydrophobicContact CG2-SD 4.08Å; I97-M105 HydrophobicContact CD1-SD 3.53Å; I97-M105 VanDerWaalsContact CD1-SD 3.53Å; T101-M105 HydrophobicContact CG2-SD 4.24Å; T101-M105 WeakPolarHBondContact O-CG 3.43Å; T101-M105 PolarHBondContact O-N 3.47Å; R102-M105 WeakPolarHBondContact O-CB 3.48Å; R102-M105 PolarHBondContact O-N 3.4Å; M105-M107 VanDerWaalsContact C-N 3.3Å; M105-M107 PolarHBondContact O-N 2.81Å; M105-P109 WeakPolarHBondContact O-CA 3.42Å; M105-F112 HydrophobicContact CB-CD2 4.43Å; M105-F112 HydrophobicContact CB-CE2 4.1Å; M105-F112 HydrophobicContact CG-CD1 4.4Å; M105-F112 HydrophobicContact CG-CD2 3.91Å; M105-F112 HydrophobicContact CG-CE1 4.02Å; M105-F112 HydrophobicContact CG-CE2 3.51Å; M105-F112 HydrophobicContact CG-CG 4.35Å; M105-F112 HydrophobicContact CG-CZ 3.56Å; M105-L124 HydrophobicContact CE-CD1 3.29Å; M105-L124 HydrophobicContact CE-CD2 4.33Å; M105-L124 HydrophobicContact CE-CG 3.52Å; M105-L124 HydrophobicContact SD-CD1 4.09Å; M105-L127 HydrophobicContact CB-CD2 3.95Å; M105-L127 HydrophobicContact CB-CG 4.47Å; M105-L127 HydrophobicContact CE-CD2 4.04Å; M105-L127 HydrophobicContact SD-CD2 4.2Å; M105-I128 HydrophobicContact CE-CD1 3.51Å; M105-I128 HydrophobicContact CE-CG1 3.74Å
106E92Very high86.5Confident51 Ų5149.8 Ų49.824%0.23826%0.256CS..Hα-helixtrans-65.4-30.4173.6-70.2175.4-168.600114.3R23 R102 R103 I104 L127R23-E106 IonicContact NH1-OE2 3Å; R102-E106 PolarHBondContact O-N 3.06Å; R102-E106 VanDerWaalsContact O-N 3.1Å; R103-E106 WeakPolarHBondContact CD-OE2 3.41Å; R103-E106 IonicContact CZ-OE2 3.53Å; R103-E106 IonicContact NE-OE2 2.7Å; R103-E106 IonicContact NH1-OE2 3.58Å; R103-E106 PolarHBondContact NH1-OE2 3.07Å; I104-E106 VanDerWaalsContact C-N 3.32Å; I104-E106 PolarHBondContact O-N 3.32Å; E106-L127 HydrophobicContact CG-CD1 3.72Å; E106-L127 HydrophobicContact CG-CG 4.47Å
107M93.4Very high85.3Confident15 Ų1545.1 Ų45.17%0.07422%0.222CC..Hα-helixtrans-88.1-34.7-173.7-79.9171.24900112L19 V22 R23 I26 R103 I104 M105L19-M107 HydrophobicContact CB-SD 4.31Å; L19-M107 HydrophobicContact CD2-CE 4.16Å; L19-M107 WeakPolarHBondContact O-CE 3.21Å; V22-M107 HydrophobicContact CB-CE 4.45Å; V22-M107 HydrophobicContact CG1-CE 4.14Å; R23-M107 HydrophobicContact CB-CE 4.22Å; R23-M107 HydrophobicContact CB-SD 4.16Å; R23-M107 HydrophobicContact CG-CG 4.18Å; R23-M107 HydrophobicContact CG-SD 4.34Å; I26-M107 HydrophobicContact CD1-CB 3.56Å; I26-M107 HydrophobicContact CD1-CE 3.84Å; I26-M107 HydrophobicContact CD1-CG 3.72Å; I26-M107 HydrophobicContact CG1-CE 4.06Å; R103-M107 HydrophobicContact CG-SD 3.86Å; R103-M107 WeakPolarHBondContact O-CB 3.3Å; R103-M107 WeakPolarHBondContact O-CG 3.36Å; R103-M107 PolarHBondContact O-N 3.21Å; I104-M107 PolarHBondContact O-N 2.75Å; I104-M107 VanDerWaalsContact O-N 3.09Å; M105-M107 VanDerWaalsContact C-N 3.3Å; M105-M107 PolarHBondContact O-N 2.81Å
108I93.1Very high83.6Confident0 Ų048.8 Ų48.80%024%0.239CC..  trans-140.361.3-168.4-35.8173.8000109.3I26 E30 Y72 K76 I104 H110 L111I26-I108 HydrophobicContact CG2-CG1 4.39Å; E30-I108 HydrophobicContact CG-CD1 4.27Å; E30-I108 HydrophobicContact CG-CG2 4.28Å; Y72-I108 HydrophobicContact CE2-CD1 4.43Å; Y72-I108 WeakPolarHBondContact OH-CD1 3.47Å; K76-I108 HydrophobicContact CD-CD1 3.55Å; K76-I108 HydrophobicContact CG-CD1 4.17Å; I104-I108 HydrophobicContact CG2-CD1 4.32Å; I104-I108 PolarHBondContact O-N 2.92Å; I108-H110 WeakPolarHBondContact CG2-CE1 3.23Å; I108-H110 VanDerWaalsContact CG2-NE2 3.33Å; I108-H110 WeakPolarHBondContact CG2-NE2 3.41Å; I108-H110 PolarHBondContact O-N 3.45Å; I108-H110 VanDerWaalsContact O-N 3.15Å; I108-L111 HydrophobicContact CB-CB 4.23Å; I108-L111 HydrophobicContact CG2-CB 3.9Å; I108-L111 WeakPolarHBondContact O-CB 3.44Å; I108-L111 PolarHBondContact O-N 3.32Å
109P89.9Confident81.7Confident26 Ų2654 Ų5417%0.16926%0.259CS..G310 helixtrans-60.4-30.5-173.723.6-34.2000112.8M105 L111 F112 I128M105-P109 WeakPolarHBondContact O-CA 3.42Å; P109-L111 PolarHBondContact O-N 2.91Å; P109-F112 PolarHBondContact O-N 3.07Å; P109-F112 VanDerWaalsContact O-N 3.12Å; P109-I128 HydrophobicContact CB-CG2 4.44Å
110H88Confident79.6Confident83 Ų8357.6 Ų57.638%0.38427%0.272SS..G310 helixtrans-62.9-22.6176.663.9-101.2000113.9I108 F112 Q113I108-H110 WeakPolarHBondContact CG2-CE1 3.23Å; I108-H110 VanDerWaalsContact CG2-NE2 3.33Å; I108-H110 WeakPolarHBondContact CG2-NE2 3.41Å; I108-H110 PolarHBondContact O-N 3.45Å; I108-H110 VanDerWaalsContact O-N 3.15Å; H110-F112 PolarHBondContact O-N 3.46Å; H110-Q113 PolarHBondContact O-N 3.15Å
111L88.1Confident78Confident33 Ų3357.8 Ų57.817%0.17327%0.273CS..G310 helixtrans-60.9-18.7175-165.570.1000112.9K76 K80 I104 I108 P109K76-L111 HydrophobicContact CB-CD2 4.01Å; K76-L111 HydrophobicContact CD-CD2 4.17Å; K76-L111 HydrophobicContact CG-CD2 4.16Å; K80-L111 HydrophobicContact CG-CG 4.38Å; I104-L111 HydrophobicContact CG2-CD2 3.85Å; I108-L111 HydrophobicContact CB-CB 4.23Å; I108-L111 HydrophobicContact CG2-CB 3.9Å; I108-L111 WeakPolarHBondContact O-CB 3.44Å; I108-L111 PolarHBondContact O-N 3.32Å; P109-L111 PolarHBondContact O-N 2.91Å
112F86.6Confident76.2Confident1 Ų163 Ų630%0.00430%0.297CS..G310 helixtrans-116.31.6-175.1-53.4-86.7000113.7A79 V83 I104 M105 P109 H110 H114 V115 I128A79-F112 HydrophobicContact CB-CE1 4.31Å; A79-F112 HydrophobicContact CB-CZ 3.97Å; V83-F112 HydrophobicContact CB-CD1 4.41Å; V83-F112 HydrophobicContact CB-CE1 4.46Å; V83-F112 HydrophobicContact CG1-CD1 4.41Å; V83-F112 HydrophobicContact CG2-CD1 4.12Å; V83-F112 HydrophobicContact CG2-CE1 3.94Å; I104-F112 HydrophobicContact CG2-CE2 3.99Å; I104-F112 HydrophobicContact CG2-CZ 3.9Å; M105-F112 HydrophobicContact CB-CD2 4.43Å; M105-F112 HydrophobicContact CB-CE2 4.1Å; M105-F112 HydrophobicContact CG-CD1 4.4Å; M105-F112 HydrophobicContact CG-CD2 3.91Å; M105-F112 HydrophobicContact CG-CE1 4.02Å; M105-F112 HydrophobicContact CG-CE2 3.51Å; M105-F112 HydrophobicContact CG-CG 4.35Å; M105-F112 HydrophobicContact CG-CZ 3.56Å; P109-F112 PolarHBondContact O-N 3.07Å; P109-F112 VanDerWaalsContact O-N 3.12Å; H110-F112 PolarHBondContact O-N 3.46Å; F112-H114 VanDerWaalsContact C-N 3.25Å; F112-H114 PolarHBondContact O-N 2.92Å; F112-V115 WeakPolarHBondContact O-CB 3.44Å; F112-V115 PolarHBondContact O-N 2.99Å; F112-I128 HydrophobicContact CB-CD1 3.92Å
113Q77.9Confident74.6Confident112 Ų11262.6 Ų62.652%0.52331%0.313SS..THydrogen-bonded Turntrans-59.1-32.4-176.3-85.5168-4.900114H110 V115H110-Q113 PolarHBondContact O-N 3.15Å; Q113-V115 VanDerWaalsContact C-N 3.27Å; Q113-V115 PolarHBondContact O-N 3Å
114H66Low73.1Confident177 Ų17760 Ų6082%0.81930%0.304SS*.THydrogen-bonded Turntrans-844.7178-55.7-65.5000113.9F112 P116F112-H114 VanDerWaalsContact C-N 3.25Å; F112-H114 PolarHBondContact O-N 2.92Å; H114-P116 WeakPolarHBondContact O-CD 3.47Å
115V61.1Low71.5Confident21 Ų2165.1 Ų65.113%0.12732%0.323CS..SBendtrans-90.9113.3174.4-174.70000108.7V83 F112 Q113 I117V83-V115 HydrophobicContact CG1-CG1 3.98Å; V83-V115 HydrophobicContact CG1-CG2 4.48Å; F112-V115 WeakPolarHBondContact O-CB 3.44Å; F112-V115 PolarHBondContact O-N 2.99Å; Q113-V115 VanDerWaalsContact C-N 3.27Å; Q113-V115 PolarHBondContact O-N 3Å; V115-I117 WeakPolarHBondContact O-CG1 3.22Å; V115-I117 PolarHBondContact O-N 3.37Å
116P56.3Low70.2Confident87 Ų8772.2 Ų72.257%0.56535%0.35SS*.  trans-69.2104.5179.4-17.132.1000109.9H114 H118H114-P116 WeakPolarHBondContact O-CD 3.47Å; P116-H118 PolarHBondContact O-N 3.41Å
117I56.7Low68.8Low12 Ų1272 Ų726%0.06235%0.35CS..  trans-79.4117.1-176.8-45.8-177.5000110.1V115 D121 L124 R125 I128 Y129V115-I117 WeakPolarHBondContact O-CG1 3.22Å; V115-I117 PolarHBondContact O-N 3.37Å; I117-D121 HydrophobicContact CG2-CB 4.04Å; I117-L124 HydrophobicContact CD1-CD2 4.17Å; I117-L124 HydrophobicContact CG1-CD2 4.34Å; I117-L124 HydrophobicContact CG2-CB 4.37Å; I117-L124 HydrophobicContact CG2-CD2 3.91Å; I117-R125 HydrophobicContact CB-CG 4.1Å; I117-R125 HydrophobicContact CD1-CG 4.22Å; I117-R125 HydrophobicContact CG2-CG 3.71Å; I117-R125 PolarHBondContact O-NE 2.65Å; I117-R125 PolarHBondContact O-NH2 3.3Å; I117-I128 HydrophobicContact CD1-CB 4.5Å; I117-I128 HydrophobicContact CD1-CD1 3.57Å; I117-Y129 HydrophobicContact CD1-CD2 4.46Å; I117-Y129 HydrophobicContact CD1-CE2 3.72Å
118H52.8Low67.4Low95 Ų9571.6 Ų71.644%0.4435%0.349SS..  trans-61134.8172.4-165-29.7000110.3P116 K120 D121P116-H118 PolarHBondContact O-N 3.41Å; H118-K120 PolarHBondContact O-N 2.98Å; H118-D121 PolarHBondContact O-N 3.44Å
119E51.7Low65.7Low156 Ų15676.4 Ų76.473%0.72937%0.367SS*.THydrogen-bonded Turntrans-51.2-28.6-175.7-64.8-180120.400115.5D121E119-D121 VanDerWaalsContact C-N 3.28Å; E119-D121 PolarHBondContact O-N 3.29Å
120K52.7Low64Low164 Ų16480.6 Ų80.671%0.71339%0.388SS*.THydrogen-bonded Turntrans-70.1-19.4-179.4-64.1-173.8176.3-176.50113.6H118 Q122H118-K120 PolarHBondContact O-N 2.98Å; K120-Q122 VanDerWaalsContact C-N 3.25Å; K120-Q122 PolarHBondContact O-N 2.98Å; K120-Q122 VanDerWaalsContact O-N 3.15Å
121D60.8Low62.2Low16 Ų1683 Ų839%0.08640%0.398CS..  trans-86.254.8170.9-76-63.3000111.6R86 R94 I117 H118 E119 A123 L124 R125R86-D121 IonicContact CZ-OD1 2.9Å; R86-D121 IonicContact NE-OD1 2.88Å; R86-D121 IonicContact NH2-OD1 3.94Å; R86-D121 PolarHBondContact NH2-OD1 3.1Å; R94-D121 IonicContact CZ-OD2 3.21Å; R94-D121 IonicContact NH1-OD1 3.56Å; R94-D121 IonicContact NH1-OD2 2.71Å; R94-D121 PolarHBondContact NH1-OD2 3.02Å; I117-D121 HydrophobicContact CG2-CB 4.04Å; H118-D121 PolarHBondContact O-N 3.44Å; E119-D121 VanDerWaalsContact C-N 3.28Å; E119-D121 PolarHBondContact O-N 3.29Å; D121-A123 PolarHBondContact O-N 3.49Å; D121-A123 VanDerWaalsContact O-N 3.15Å; D121-L124 HydrophobicContact CB-CB 3.78Å; D121-L124 WeakPolarHBondContact O-CB 3.33Å; D121-L124 PolarHBondContact O-N 3.07Å; D121-R125 PolarHBondContact O-N 3.21Å
122Q57.5Low60.2Low112 Ų11288.8 Ų88.852%0.52342%0.424SS..Hα-helixtrans-54.4-34.7177.7-76.8-1635.400112.7K120 L124 R125 R126K120-Q122 VanDerWaalsContact C-N 3.25Å; K120-Q122 PolarHBondContact O-N 2.98Å; K120-Q122 VanDerWaalsContact O-N 3.15Å; Q122-L124 PolarHBondContact O-N 3.37Å; Q122-R125 PolarHBondContact O-N 2.99Å; Q122-R126 WeakPolarHBondContact O-CB 3.38Å; Q122-R126 VanDerWaalsContact O-CG 3.23Å; Q122-R126 WeakPolarHBondContact O-CG 3.37Å; Q122-R126 PolarHBondContact O-N 3.29Å
123A60Low57.8Low79 Ų7994.8 Ų94.865%0.65346%0.46SS*.Hα-helixtrans-64.3-38.1176.400000112.7D121 L127D121-A123 PolarHBondContact O-N 3.49Å; D121-A123 VanDerWaalsContact O-N 3.15Å; A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 PolarHBondContact O-N 2.92Å
124L62.6Low55.7Low19 Ų1994.7 Ų94.710%0.09947%0.472CS..Hα-helixtrans-71.3-41.7177-154.490.3000110.8V83 I97 M105 I117 D121 Q122 L127 I128V83-L124 HydrophobicContact CG1-CD2 4.44Å; I97-L124 HydrophobicContact CD1-CD1 3.95Å; M105-L124 HydrophobicContact CE-CD1 3.29Å; M105-L124 HydrophobicContact CE-CD2 4.33Å; M105-L124 HydrophobicContact CE-CG 3.52Å; M105-L124 HydrophobicContact SD-CD1 4.09Å; I117-L124 HydrophobicContact CD1-CD2 4.17Å; I117-L124 HydrophobicContact CG1-CD2 4.34Å; I117-L124 HydrophobicContact CG2-CB 4.37Å; I117-L124 HydrophobicContact CG2-CD2 3.91Å; D121-L124 HydrophobicContact CB-CB 3.78Å; D121-L124 WeakPolarHBondContact O-CB 3.33Å; D121-L124 PolarHBondContact O-N 3.07Å; Q122-L124 PolarHBondContact O-N 3.37Å; L124-L127 PolarHBondContact O-N 3.19Å; L124-I128 HydrophobicContact CD2-CD1 4.43Å; L124-I128 HydrophobicContact CG-CD1 4.25Å; L124-I128 PolarHBondContact O-N 2.97Å
125R62.1Low54.6Low108 Ų10892 Ų9241%0.40847%0.47SS..Hα-helixtrans-59.1-49.5172.7-75.4-120.2179.1-165.12.8111.5I117 D121 Q122 L127 I128 Y129I117-R125 HydrophobicContact CB-CG 4.1Å; I117-R125 HydrophobicContact CD1-CG 4.22Å; I117-R125 HydrophobicContact CG2-CG 3.71Å; I117-R125 PolarHBondContact O-NE 2.65Å; I117-R125 PolarHBondContact O-NH2 3.3Å; D121-R125 PolarHBondContact O-N 3.21Å; Q122-R125 PolarHBondContact O-N 2.99Å; R125-L127 VanDerWaalsContact C-N 3.31Å; R125-L127 PolarHBondContact O-N 3.2Å; R125-I128 PolarHBondContact O-N 3.08Å; R125-Y129 HydrophobicContact CB-CD2 4.45Å; R125-Y129 WeakPolarHBondContact O-CB 3.32Å; R125-Y129 WeakPolarHBondContact O-CD2 3.43Å; R125-Y129 PolarHBondContact O-N 3.33Å
126R64.9Low53.3Low149 Ų14998.2 Ų98.256%0.56250%0.501SS*.Hα-helixtrans-59.1-41.1177-70.6173.3-161.1-168.57.5111.6Q122 N130Q122-R126 WeakPolarHBondContact O-CB 3.38Å; Q122-R126 VanDerWaalsContact O-CG 3.23Å; Q122-R126 WeakPolarHBondContact O-CG 3.37Å; Q122-R126 PolarHBondContact O-N 3.29Å; R126-N130 VanDerWaalsContact O-CB 3.29Å; R126-N130 WeakPolarHBondContact O-CB 3.34Å; R126-N130 PolarHBondContact O-N 3.29Å; R126-N130 VanDerWaalsContact O-N 3.17Å
127L63.8Low52.6Low46 Ų46102.8 Ų102.824%0.24152%0.515CS..Hα-helixtrans-66-38.1179.4-168.564.3000113.4R102 M105 E106 A123 L124 R125R102-L127 HydrophobicContact CG-CD2 3.98Å; M105-L127 HydrophobicContact CB-CD2 3.95Å; M105-L127 HydrophobicContact CB-CG 4.47Å; M105-L127 HydrophobicContact CE-CD2 4.04Å; M105-L127 HydrophobicContact SD-CD2 4.2Å; E106-L127 HydrophobicContact CG-CD1 3.72Å; E106-L127 HydrophobicContact CG-CG 4.47Å; A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 PolarHBondContact O-N 2.92Å; L124-L127 PolarHBondContact O-N 3.19Å; R125-L127 VanDerWaalsContact C-N 3.31Å; R125-L127 PolarHBondContact O-N 3.2Å
128I62.9Low51.4Low8 Ų8110.7 Ų110.74%0.04155%0.551CS.*Hα-helixtrans-84.8-38.2-177.1-70.2167.4000112.4M105 P109 F112 I117 L124 R125M105-I128 HydrophobicContact CE-CD1 3.51Å; M105-I128 HydrophobicContact CE-CG1 3.74Å; P109-I128 HydrophobicContact CB-CG2 4.44Å; F112-I128 HydrophobicContact CB-CD1 3.92Å; I117-I128 HydrophobicContact CD1-CB 4.5Å; I117-I128 HydrophobicContact CD1-CD1 3.57Å; L124-I128 HydrophobicContact CD2-CD1 4.43Å; L124-I128 HydrophobicContact CG-CD1 4.25Å; L124-I128 PolarHBondContact O-N 2.97Å; R125-I128 PolarHBondContact O-N 3.08Å
129Y58.3Low51.3Low100 Ų100112 Ų11239%0.39257%0.568SS.*Hα-helixtrans-106.3-26-168-64.6-73.7000115.4I117 R125 K131I117-Y129 HydrophobicContact CD1-CD2 4.46Å; I117-Y129 HydrophobicContact CD1-CE2 3.72Å; R125-Y129 HydrophobicContact CB-CD2 4.45Å; R125-Y129 WeakPolarHBondContact O-CB 3.32Å; R125-Y129 WeakPolarHBondContact O-CD2 3.43Å; R125-Y129 PolarHBondContact O-N 3.33Å; Y129-K131 PolarHBondContact O-N 3.4Å
130N53.6Low50.4Low114 Ų114107.8 Ų107.861%0.6157%0.567SS**THydrogen-bonded Turntrans-7917.5-172.7-69.434.3000115.4R126R126-N130 VanDerWaalsContact O-CB 3.29Å; R126-N130 WeakPolarHBondContact O-CB 3.34Å; R126-N130 PolarHBondContact O-N 3.29Å; R126-N130 VanDerWaalsContact O-N 3.17Å
131K50.7Low49.2Very low134 Ų134106 Ų10658%0.58358%0.575SS**THydrogen-bonded Turntrans-110.53.6178.9-82.1-165173.2-175.50115.9Y129Y129-K131 PolarHBondContact O-N 3.4Å
132H45.7Very low48.2Very low155 Ų155111.1 Ų111.172%0.71861%0.612SS**SBendtrans-124.419.8-176.3-72.6-63000115.7
133T36.1Very low46.8Very low126 Ų126111.6 Ų111.677%0.77363%0.628SS**  trans-14492.2163.541.90000111.2
134S32.9Very low45.7Very low111 Ų111112.7 Ų112.778%0.77663%0.631SS**  trans-134.397.1159.345.90000108.5I136S134-I136 PolarHBondContact O-N 2.79Å
135P42.7Very low44.4Very low120 Ų120119.8 Ų119.878%0.77967%0.668SS**  trans-67.1120158.6-11.228.1000107.7
136I34.7Very low43Very low151 Ų151119.3 Ų119.377%0.77469%0.688SS**  trans12.9122.8150.4-156.274.7000117.3S134S134-I136 PolarHBondContact O-N 2.79Å
137E42.2Very low41.3Very low183 Ų183115.8 Ų115.886%0.85570%0.698SS**  trans-64.6141.5163.5-63.9-176.5150.300110.3
138H30Very low39.8Very low178 Ų178121.4 Ų121.482%0.82473%0.727SS**  trans-139.9137.9140.4-107.4-80000109.6
139P51.3Low38.4Very low122 Ų122128.4 Ų128.479%0.79276%0.76SS**  trans-92.2152.3-169.336.4-35.3000112.3
140G32.2Very low37.2Very low69 Ų69129.4 Ų129.471%0.71177%0.772SS**  trans171.8107.3170.300000115.4
141S29.2Very low36.2Very low126 Ų126134.1 Ų134.188%0.88178%0.782SS**  trans65.5114.4150.1-54.50000120.4
142S38.3Very low35.2Very low123 Ų123132.2 Ų132.286%0.8679%0.792SS**  trans-66.2148.6150.3-44.30000111.4
143S29.6Very low34.5Very low123 Ų123129.3 Ų129.386%0.8679%0.794SS**  trans-170.9174.8136.5-157.70000111.2
144S36.7Very low34.6Very low102 Ų102129.3 Ų129.371%0.71380%0.796SS**  trans-122.3169.5-163.3-47.40000114.8
145L33.7Very low34.7Very low167 Ų167130.1 Ų130.187%0.87480%0.796SS**  trans78.5122.2157.1-9899.3000122.4
146A33.3Very low34.6Very low99 Ų99130.6 Ų130.682%0.81880%0.8SS**  49.7143.9127.300000124.9
147G29.9Very low34.3Very low75 Ų75128.7 Ų128.777%0.77380%0.8SS**  trans128.7100.4166.300000112.5
148L31Very low33.8Very low164 Ų164127.8 Ų127.886%0.85980%0.799SS**  81.8109.568.4-152102.7000114.7
149Q35.1Very low33.8Very low155 Ų155123.5 Ų123.572%0.72479%0.794SS**  trans33.4138.1148.7-91.1170.3-29.100121.7
150D31.8Very low33.2Very low121 Ų121123.1 Ų123.165%0.64779%0.792SS**  -174.6162.359.2-103.2-26.5000115.2
151Y33.6Very low33Very low212 Ų212128.3 Ų128.383%0.83180%0.797SS**  trans17.4154.5153.8-67.8-87.9000123.7
152A28.6Very low33.2Very low95 Ų95128.3 Ų128.379%0.78579%0.792SS**  cis-155.3179.110.300000113.7
153A31.4Very low32.7Very low93 Ų93129.2 Ų129.277%0.76979%0.787SS**  trans-87.3-175.4176.400000113
154P38.6Very low32.6Very low126 Ų126130.5 Ų130.582%0.81878%0.784SS**  cis-143.6-173.736.142.1-19.8000118.3
155V35.6Very low32.4Very low128 Ų128132.8 Ų132.878%0.77679%0.788SS**  trans-89.3159.1-175.4-176.20000112.5
156P39.3Very low32.5Very low130 Ų130130.8 Ų130.884%0.84478%0.778SS**  -134.8159.9124.434.7-22.2000114.9
157S28.6Very low33.1Very low111 Ų111131.2 Ų131.278%0.77677%0.773SS**  trans-98.8141.3-168.5-1800000113.5
158I31.7Very low33.3Very low165 Ų165135.4 Ų135.485%0.84677%0.772SS**  trans-146.5133.9160.7-55.9-177.8000109.6
159A31Very low33.4Very low87 Ų87136.5 Ų136.572%0.71977%0.773SS**  trans-115.9152.4161.800000108.4
160P38.9Very low33.8Very low114 Ų114135.3 Ų135.374%0.7477%0.771SS**  -138.2-166.183.337.8-18.8000111
161E27.4Very low34.3Very low178 Ų178135.9 Ų135.983%0.83278%0.779SS**  cis-157.3169.519.8-155.9163-17800111.1
162V32.5Very low35.2Very low126 Ų126133.7 Ų133.776%0.76477%0.774SS**  trans-123.7174.7-175.9-96.80000111.4
163D28.6Very low36.3Very low142 Ų142134.2 Ų134.276%0.75977%0.769SS**  trans73.9138.7179.5-61.6-26.1000116.4
164N27.1Very low37.1Very low150 Ų150135.5 Ų135.580%0.80277%0.769SS**  cis-132.8150.623-76.5-101.9000115
165L31.9Very low37.5Very low150 Ų150134.9 Ų134.979%0.78577%0.766SS**  trans-120.7160.7152.8-67.8171.6000106.9
166D37.5Very low37.7Very low126 Ų126136.7 Ų136.767%0.67477%0.771SS**  cis-134.7-108.83-149.3-58.9000108.9
167P44.9Very low37.8Very low108 Ų108138 Ų13870%0.70177%0.77SS**  cis-128.4143.4-23.330.9-9.3000116.8
168E34.4Very low38.2Very low162 Ų162137.7 Ų137.776%0.75777%0.765SS**  trans61.3114134.7-57.3-82.6118.200120.4
169E33Very low38.5Very low187 Ų187136.1 Ų136.187%0.87476%0.763SS**  -136104129.6-157.4175168.600110V171E169-V171 PolarHBondContact O-N 2.71Å
170D43.2Very low38.4Very low131 Ų131137.5 Ų137.570%0.70176%0.762SS**  trans-67.4115.2-179.7171.530.5000111.8K172D170-K172 PolarHBondContact OD1-N 2.6Å
171V43.4Very low38.2Very low132 Ų132137 Ų13780%0.876%0.758SS**  trans-114.684.7170.7-171.50000110.5E169E169-V171 PolarHBondContact O-N 2.71Å
172K51.3Low38.3Very low166 Ų166133.6 Ų133.672%0.72275%0.753SS**  trans-38.7136169.5-174.5178.7-177.6174.10114.4D170D170-K172 PolarHBondContact OD1-N 2.6Å
173P52.4Low38.2Very low107 Ų107136.1 Ų136.170%0.69576%0.756SS**PPolyproline II helixtrans-67.4151.3172.928.9-34.9000112.1
174P47.3Very low38.2Very low119 Ų119134 Ų13477%0.77376%0.758SS**PPolyproline II helixtrans-66.5145.5-178.828.3-34.9000111.8
175P47.3Very low38.2Very low114 Ų114133.5 Ų133.574%0.7476%0.761SS**PPolyproline II helixtrans-77.5141.9-174.830.9-35.2000113.1
176D40.4Very low38.4Very low165 Ų165132.2 Ų132.288%0.88276%0.761SS**PPolyproline II helixtrans-64137.4168.5-69-55.6000111.5
177L42Very low37.9Very low158 Ų158132.5 Ų132.583%0.82777%0.767SS**PPolyproline II helixtrans-92.5142.1174.8-69.1178000111.3
178P36.3Very low37.2Very low105 Ų105134.2 Ų134.268%0.68277%0.769SS**PPolyproline II helixtrans-76144.2-165.229.3-36.1000113.9V180P178-V180 PolarHBondContact O-N 3.36Å
179V37.9Very low37Very low132 Ų132133.8 Ų133.880%0.877%0.772SS**  trans-61.8113.1162174.50000108.9
180V29.8Very low36.7Very low115 Ų115127.5 Ų127.570%0.69776%0.758SS**  trans-98.197.8167.3178.50000108.7P178 S182P178-V180 PolarHBondContact O-N 3.36Å; V180-S182 PolarHBondContact O-N 3.5Å
181T34.2Very low35.9Very low105 Ų105131.6 Ų131.664%0.64477%0.77SS**  trans-75.1111.5167.3-400000108.6
182S28.9Very low35.2Very low106 Ų106134.2 Ų134.274%0.74177%0.774SS**  trans-114.983.4171-66.50000110.7V180V180-S182 PolarHBondContact O-N 3.5Å
183H30.6Very low34.4Very low179 Ų179134.5 Ų134.583%0.82978%0.777SS**  trans-76.6118.2157.2-79.1-80.1000109
184A27.9Very low33.9Very low96 Ų96133.8 Ų133.879%0.79377%0.773SS**  trans153.6105.9140.100000111.8
185V28Very low33.2Very low141 Ų141135.7 Ų135.786%0.85578%0.777SS**  trans-137.2139.2144.8-179.10000107.2
186P35Very low32.3Very low122 Ų122134 Ų13479%0.79278%0.779SS**  trans-83.5171.2-172.2-9.628.7000114.7
187V28.2Very low31.9Very low132 Ų132134.2 Ų134.280%0.878%0.775SS**  trans-63.2130.2170.1-177.50000111.6
188L30.4Very low31.4Very low144 Ų144135.6 Ų135.675%0.75478%0.777SS**  -170.9137.5120.6-130.388.1000113.9
189D29.1Very low31.1Very low153 Ų153137.9 Ų137.982%0.81878%0.784SS**  trans49.5141.6146.4-84.7-30.4000124.8
190G26.8Very low31.1Very low56 Ų56139.3 Ų139.358%0.57779%0.786SS**  trans14394.2138.600000117.7
191F27.6Very low31.1Very low217 Ų217138 Ų13895%0.95279%0.787SS**  trans72.990.7153.1-53.9-77.3000119.6
192Q27.8Very low31.1Very low187 Ų187138.4 Ų138.487%0.87479%0.794SS**  trans-139.1129.1144.5-178.9164.838.500109.1
193E33.9Very low31.4Very low171 Ų171138 Ų13880%0.79979%0.792SS**  trans-160.8155.2173.6-83.3-62.2100.500107.3
194P42.9Very low31.4Very low92 Ų92136.8 Ų136.860%0.59779%0.786SS**  -139.1-164.3-51.838.4-19.5000113.1
195D31.2Very low31.7Very low160 Ų160139.5 Ų139.586%0.85679%0.788SS**  trans79.6134.3158.1-69.7-15000122.8
196G30.1Very low32.1Very low77 Ų77142.6 Ų142.679%0.79479%0.785SS**  trans153.648.6171.200000115.9
197E31.3Very low32.4Very low171 Ų171145.6 Ų145.680%0.79979%0.789SS**  trans-61.7140.4-177.5-56.3166109.600114.4
198Q32.5Very low32.6Very low186 Ų186143.8 Ų143.887%0.86979%0.787SS**  -172.2107.4124-106.4152.59700112.9
199D28.7Very low33.2Very low153 Ų153141.9 Ų141.982%0.81879%0.786SS**  trans-81.2132.2161.4-116.4-32.8000109.7
200L38.5Very low33.7Very low162 Ų162142.7 Ų142.785%0.84879%0.789SS**  trans-138.480.7158.1-80.9-177.1000109.7S202L200-S202 PolarHBondContact O-N 2.92Å
201A29.9Very low34.5Very low88 Ų88145.5 Ų145.573%0.72780%0.8SS**  trans-63.6117.1166.900000110.4
202S34.3Very low35.4Very low113 Ų113141.4 Ų141.479%0.7980%0.795SS**  trans-98.896.3166.6-168.10000109.6L200 H204L200-S202 PolarHBondContact O-N 2.92Å; S202-H204 PolarHBondContact O-N 3.12Å
203S34.7Very low35.8Very low99 Ų99137 Ų13769%0.69279%0.791SS**  trans-71.7116.7178.5-49.80000111.1
204H30.6Very low36Very low153 Ų153134.6 Ų134.671%0.70879%0.793SS**  trans-131.493159.6-101.6-58.8000112.1S202 Y206S202-H204 PolarHBondContact O-N 3.12Å; H204-Y206 AromaticContact ND1-CE2 3.76Å; H204-Y206 PolarHBondContact O-N 3.27Å
205N33.7Very low35.6Very low153 Ų153135.6 Ų135.682%0.81880%0.803SS**  trans-66.5124.6160.1-70.4-43.2000109.2
206Y37.2Very low36.1Very low206 Ų206132.2 Ų132.281%0.80879%0.792SS**  trans-136.2101.7151.4-86.9-71.9000110.3H204H204-Y206 AromaticContact ND1-CE2 3.76Å; H204-Y206 PolarHBondContact O-N 3.27Å
207Q40.5Very low36.8Very low185 Ų185134.2 Ų134.286%0.86479%0.788SS**  trans-76.4116.3166.4173.4179.1-19.200108.5
208A32.8Very low37.4Very low93 Ų93132.8 Ų132.877%0.76979%0.786SS**  trans-143.291.4172.500000110.5L210A208-L210 PolarHBondContact O-N 3.14Å
209S42.2Very low38.1Very low104 Ų104130.7 Ų130.773%0.72778%0.779SS**  trans-66.4124.5170.5-46.60000110.3
210L39.8Very low38.5Very low170 Ų170127.8 Ų127.889%0.8978%0.776SS**  trans-145.8100158.4-77.2-175.8000110.9A208A208-L210 PolarHBondContact O-N 3.14Å
211S43.6Very low38.7Very low115 Ų115127.7 Ų127.780%0.80478%0.776SS**  trans-74.9131162.2-52.90000109.7A213S211-A213 PolarHBondContact O-N 3.21Å
212P47.2Very low39.2Very low131 Ų131129.2 Ų129.285%0.85178%0.781SS**  trans-77.6109.6159.4-4.922.9000108.2
213A35.7Very low39.4Very low95 Ų95128.1 Ų128.179%0.78578%0.779SS**  trans-72.9160.7174.900000112S211 S215S211-A213 PolarHBondContact O-N 3.21Å; A213-S215 PolarHBondContact O-N 3.13Å
214S37.7Very low39.5Very low121 Ų121128.8 Ų128.885%0.84678%0.783SS**  trans-53.2127.6-174.2-49.80000114.8S216S214-S216 PolarHBondContact O-N 3.01Å
215S35.5Very low40.5Very low113 Ų113126.5 Ų126.579%0.7978%0.782SS**  trans-87.194.6160.5-174.80000109.5A213 V217A213-S215 PolarHBondContact O-N 3.13Å; S215-V217 PolarHBondContact O-N 3.21Å
216S41.6Very low41Very low89 Ų89127 Ų12762%0.62278%0.784SS**  trans-72.9111.7172.7-174.80000110S214 N218S214-S216 PolarHBondContact O-N 3.01Å; S216-N218 PolarHBondContact O-N 3.26Å; S216-N218 PolarHBondContact OG-OD1 3.18Å; S216-N218 VanDerWaalsContact OG-OD1 3.07Å
217V44.2Very low41.4Very low118 Ų118122.6 Ų122.672%0.71578%0.781SS**  trans-83.196.7166.4-1750000107.8S215 I219S215-V217 PolarHBondContact O-N 3.21Å; V217-I219 HydrophobicContact CG1-CG1 4.41Å; V217-I219 PolarHBondContact O-N 2.85Å
218N44.4Very low41.7Very low142 Ų142122 Ų12276%0.75978%0.782SS**  trans-68.393.6175.1-67.9-26.7000110S216 A220S216-N218 PolarHBondContact O-N 3.26Å; S216-N218 PolarHBondContact OG-OD1 3.18Å; S216-N218 VanDerWaalsContact OG-OD1 3.07Å; N218-A220 PolarHBondContact O-N 3.33Å
219I46.9Very low41.9Very low142 Ų142123 Ų12373%0.72878%0.784SS**  trans-76.2103.2166.1-58.8176.7000107.4V217 L221V217-I219 HydrophobicContact CG1-CG1 4.41Å; V217-I219 PolarHBondContact O-N 2.85Å; I219-L221 PolarHBondContact O-N 3.44Å
220A37.5Very low41.9Very low92 Ų92124.7 Ų124.776%0.7678%0.78SS**  trans-68.9100.417400000110.1N218 S222N218-A220 PolarHBondContact O-N 3.33Å; A220-S222 VanDerWaalsContact C-N 3.28Å; A220-S222 PolarHBondContact O-N 3.28Å
221L41.7Very low41.7Very low159 Ų159125.4 Ų125.483%0.83278%0.779SS**  trans-71.986.7167-71.5176.2000109.3I219 A223I219-L221 PolarHBondContact O-N 3.44Å; L221-A223 PolarHBondContact O-N 2.92Å
222S41.1Very low41.8Very low121 Ų121127.3 Ų127.385%0.84677%0.773SS**  trans-71.890.6169179.10000109.9A220A220-S222 VanDerWaalsContact C-N 3.28Å; A220-S222 PolarHBondContact O-N 3.28Å
223A38.5Very low41.6Very low89 Ų89132 Ų13274%0.73678%0.776SS**  trans-107.2105.416600000109L221L221-A223 PolarHBondContact O-N 2.92Å
224S36.3Very low42.6Very low113 Ų113132.6 Ų132.679%0.7977%0.771SS**  trans-65.5130.5176.6-170.60000110.5
225P52.3Low42.7Very low105 Ų105134.7 Ų134.768%0.68277%0.773SS**  trans-78.8163.5162.134.4-32.9000110.6
226L44.1Very low43.6Very low164 Ų164136.7 Ų136.786%0.85978%0.775SS**  trans119.7140.5168.7-69.8173000113.3
227P44.9Very low44Very low113 Ų113139.3 Ų139.373%0.73478%0.78SS**  cis-127.8178-36.836.3-21.1000112.2S229P227-S229 PolarHBondContact O-N 2.91Å
228L48.7Very low44.2Very low172 Ų172144 Ų14490%0.90179%0.787SS**  trans-54.7124.4170.4-8865.4000111.4
229S36Very low44.5Very low116 Ų116143.2 Ų143.281%0.81179%0.789SS**  trans-104.2105.8151.961.90000108.8P227P227-S229 PolarHBondContact O-N 2.91Å
230H43Very low44.9Very low138 Ų138145.7 Ų145.764%0.63979%0.789SS**  trans-81.2111178.2173.759.4000109.5F232H230-F232 AromaticContact CD2-CE2 3.68Å; H230-F232 AromaticContact CE1-CE1 3.95Å; H230-F232 AromaticContact CE1-CE2 3.71Å; H230-F232 AromaticContact CE1-CZ 3.66Å; H230-F232 AromaticContact NE2-CD2 3.79Å; H230-F232 AromaticContact NE2-CE1 3.89Å; H230-F232 AromaticContact NE2-CE2 3.07Å; H230-F232 WeakPolarHBondContact NE2-CE2 3.45Å; H230-F232 AromaticContact NE2-CZ 3.13Å; H230-F232 WeakPolarHBondContact NE2-CZ 3.43Å
231E34.3Very low45.7Very low186 Ų186148.5 Ų148.587%0.86979%0.786SS**  trans-121.6129161.1-73.8-158.8155.900110.5
232F46.7Very low46.3Very low154 Ų154146.2 Ų146.268%0.67577%0.772SS**  trans-77.8128.2-179.2-70.1-99.7000110.8H230H230-F232 AromaticContact CD2-CE2 3.68Å; H230-F232 AromaticContact CE1-CE1 3.95Å; H230-F232 AromaticContact CE1-CE2 3.71Å; H230-F232 AromaticContact CE1-CZ 3.66Å; H230-F232 AromaticContact NE2-CD2 3.79Å; H230-F232 AromaticContact NE2-CE1 3.89Å; H230-F232 AromaticContact NE2-CE2 3.07Å; H230-F232 WeakPolarHBondContact NE2-CE2 3.45Å; H230-F232 AromaticContact NE2-CZ 3.13Å; H230-F232 WeakPolarHBondContact NE2-CZ 3.43Å
233Y43.6Very low47.1Very low231 Ų231143.5 Ų143.591%0.90676%0.756SS**  trans-151.5117.3136.7-95-69.2000109.9
234P54.8Low48Very low106 Ų106142.9 Ų142.969%0.68874%0.741SS**  trans-89.9119174.433.1-29.1000110.4
235N41.2Very low49.1Very low165 Ų165145.1 Ų145.188%0.88273%0.732SS**  trans-160110.3151.9-97.4-44.6000109.6
236D53.2Low49.4Very low156 Ų156145.8 Ų145.883%0.83472%0.724SS**  trans-76.2-169.7170.7-94.5-53.9000111.5
237I50.8Low50.3Low144 Ų144145.3 Ų145.374%0.73871%0.711SS**  trans91.566.9171.4-43.7154.8000113.9
238Y47.5Very low51.4Low217 Ų217144.1 Ų144.185%0.85170%0.703SS**  -155126125.5-94.1-69.8000109.2R240Y238-R240 PolarHBondContact O-N 3.47Å
239P52.4Low52.5Low125 Ų125141.7 Ų141.781%0.81269%0.69SS**  trans-72.577.9168.1-6.222.8000109H241P239-H241 PolarHBondContact O-N 3.44Å
240R54.9Low54.3Low194 Ų194142.1 Ų142.173%0.73268%0.679SS**  trans-67.7107.8175.9-166.9-142.5-99.6-102.15.9108Y238 E242Y238-R240 PolarHBondContact O-N 3.47Å; R240-E242 PolarHBondContact O-N 3.41Å
241H54.9Low55.7Low150 Ų150140.2 Ų140.269%0.69467%0.673SS**  trans-33.2116.1-175.7-94-65.3000113.9P239 A243 D244P239-H241 PolarHBondContact O-N 3.44Å; H241-A243 PolarHBondContact O-N 3.48Å; H241-A243 VanDerWaalsContact O-N 3.1Å; H241-D244 PolarHBondContact O-N 3.45Å
242E53.8Low57.9Low112 Ų112133.8 Ų133.852%0.52365%0.652SS.*Hα-helixtrans-45.1-41.5170.2-71.1-89.699.100111.9R240 D244 R245 F246R240-E242 PolarHBondContact O-N 3.41Å; E242-D244 PolarHBondContact O-N 3.46Å; E242-D244 VanDerWaalsContact O-N 3.12Å; E242-R245 PolarHBondContact O-N 3.35Å; E242-R245 IonicContact OE1-CZ 3.51Å; E242-R245 IonicContact OE1-NE 3.52Å; E242-R245 IonicContact OE1-NH2 2.71Å; E242-R245 PolarHBondContact OE1-NH2 2.93Å; E242-F246 WeakPolarHBondContact O-CD2 3.3Å; E242-F246 PolarHBondContact O-N 3.16Å
243A57.6Low59.8Low63 Ų63132.6 Ų132.652%0.52165%0.647SS.*Hα-helixtrans-52.4-34.4-179.800000114.1H241 F246 R247H241-A243 PolarHBondContact O-N 3.48Å; H241-A243 VanDerWaalsContact O-N 3.1Å; A243-F246 PolarHBondContact O-N 2.87Å; A243-R247 WeakPolarHBondContact O-CG 3.38Å; A243-R247 PolarHBondContact O-N 3.27Å
244D56.6Low62Low77 Ų77127.2 Ų127.241%0.41263%0.63SS.*Hα-helixtrans-82-18.6-176.2-131.331.2000112.3H241 E242 R247H241-D244 PolarHBondContact O-N 3.45Å; E242-D244 PolarHBondContact O-N 3.46Å; E242-D244 VanDerWaalsContact O-N 3.12Å; D244-R247 IonicContact OD1-CZ 2.65Å; D244-R247 IonicContact OD1-NE 3.83Å; D244-R247 PolarHBondContact OD1-NE 3.3Å; D244-R247 IonicContact OD1-NH2 2.65Å; D244-R247 PolarHBondContact OD1-NH2 2.88Å
245R59.4Low63.6Low159 Ų159128.5 Ų128.560%0.663%0.627SS**Hα-helixtrans-74.2-32.3169.3-69.9-164-80.8-154.3-2.6112.4E242E242-R245 PolarHBondContact O-N 3.35Å; E242-R245 IonicContact OE1-CZ 3.51Å; E242-R245 IonicContact OE1-NE 3.52Å; E242-R245 IonicContact OE1-NH2 2.71Å; E242-R245 PolarHBondContact OE1-NH2 2.93Å
246F58.2Low66.1Low119 Ų119126 Ų12652%0.52261%0.609SS.*Hα-helixtrans-88-15.4179.8-62.7-70000113.8E242 A243 L249 H250E242-F246 WeakPolarHBondContact O-CD2 3.3Å; E242-F246 PolarHBondContact O-N 3.16Å; A243-F246 PolarHBondContact O-N 2.87Å; F246-L249 HydrophobicContact CD1-CD1 4.42Å; F246-L249 PolarHBondContact O-N 2.94Å; F246-H250 WeakPolarHBondContact O-CB 3.45Å; F246-H250 PolarHBondContact O-N 3.49Å
247R63.8Low68.1Low155 Ų155122.2 Ų122.259%0.58559%0.589SS**Hα-helixtrans-55.6-47.2179.3-85.8-138-80.1-173.7-9.9114.8A243 D244 L249 H250 L251A243-R247 WeakPolarHBondContact O-CG 3.38Å; A243-R247 PolarHBondContact O-N 3.27Å; D244-R247 IonicContact OD1-CZ 2.65Å; D244-R247 IonicContact OD1-NE 3.83Å; D244-R247 PolarHBondContact OD1-NE 3.3Å; D244-R247 IonicContact OD1-NH2 2.65Å; D244-R247 PolarHBondContact OD1-NH2 2.88Å; R247-L249 VanDerWaalsContact C-N 3.3Å; R247-L249 PolarHBondContact O-N 3.04Å; R247-H250 PolarHBondContact O-N 2.88Å; R247-L251 WeakPolarHBondContact O-CG 3.31Å; R247-L251 PolarHBondContact O-N 3.04Å
248P68Low70.2Confident87 Ų87120.9 Ų120.957%0.56558%0.583SS**Hα-helixtrans-61.4-37.4177-24.735.5000113.2A252P248-A252 WeakPolarHBondContact O-CB 3.35Å; P248-A252 PolarHBondContact O-N 3.26Å; P248-A252 VanDerWaalsContact O-N 3.12Å
249L71.6Confident72.4Confident121 Ų121114.2 Ų114.263%0.63456%0.564SS**Hα-helixtrans-72.1-35.1177.7-66.4171.6000112.3F246 R247 K253F246-L249 HydrophobicContact CD1-CD1 4.42Å; F246-L249 PolarHBondContact O-N 2.94Å; R247-L249 VanDerWaalsContact C-N 3.3Å; R247-L249 PolarHBondContact O-N 3.04Å; L249-K253 WeakPolarHBondContact O-CB 3.38Å; L249-K253 PolarHBondContact O-N 3.04Å
250H73.6Confident74.5Confident125 Ų125111.3 Ų111.358%0.57954%0.542SS*.Hα-helixtrans-68.3-44.3176.4-170.2-165.5000111.4F246 R247 K253 E254F246-H250 WeakPolarHBondContact O-CB 3.45Å; F246-H250 PolarHBondContact O-N 3.49Å; R247-H250 PolarHBondContact O-N 2.88Å; H250-K253 WeakPolarHBondContact O-CB 3.49Å; H250-K253 PolarHBondContact O-N 2.98Å; H250-E254 PolarHBondContact O-N 2.95Å
251L73.6Confident76.5Confident99 Ų99103.2 Ų103.252%0.51852%0.517SS..Hα-helixtrans-59.9-46.8174.8-69.6169.1000111.3R247 K253 E254 E255R247-L251 WeakPolarHBondContact O-CG 3.31Å; R247-L251 PolarHBondContact O-N 3.04Å; L251-K253 VanDerWaalsContact C-N 3.27Å; L251-K253 PolarHBondContact O-N 3.48Å; L251-E254 PolarHBondContact O-N 2.94Å; L251-E255 WeakPolarHBondContact O-CG 3.48Å; L251-E255 PolarHBondContact O-N 3.25Å
252A79.4Confident78.5Confident51 Ų51100.5 Ų100.542%0.42151%0.507SS..Hα-helixtrans-61.5-33.4176.300000113.2P248 H256P248-A252 WeakPolarHBondContact O-CB 3.35Å; P248-A252 PolarHBondContact O-N 3.26Å; P248-A252 VanDerWaalsContact O-N 3.12Å; A252-H256 WeakPolarHBondContact O-CB 3.43Å; A252-H256 PolarHBondContact O-N 3.03Å; A252-H256 VanDerWaalsContact O-N 3.13Å
253K87.4Confident80.6Confident129 Ų129100.6 Ų100.656%0.56151%0.507SS*.Hα-helixtrans-70.3-44.6173.6-174.9-172.4171.7-168.60111.7L249 H250 L251 E255 H256 D257L249-K253 WeakPolarHBondContact O-CB 3.38Å; L249-K253 PolarHBondContact O-N 3.04Å; H250-K253 WeakPolarHBondContact O-CB 3.49Å; H250-K253 PolarHBondContact O-N 2.98Å; L251-K253 VanDerWaalsContact C-N 3.27Å; L251-K253 PolarHBondContact O-N 3.48Å; K253-E255 VanDerWaalsContact C-N 3.35Å; K253-E255 PolarHBondContact O-N 3.48Å; K253-H256 WeakPolarHBondContact O-CB 3.49Å; K253-H256 PolarHBondContact O-N 3Å; K253-D257 PolarHBondContact O-N 3.23Å
254E89.7Confident82.5Confident117 Ų117104.6 Ų104.655%0.54751%0.509SS..Hα-helixtrans-61.3-43177.4-175.6176.2-170.100111.4H250 L251 H256 D257 L258H250-E254 PolarHBondContact O-N 2.95Å; L251-E254 PolarHBondContact O-N 2.94Å; E254-H256 PolarHBondContact O-N 3.37Å; E254-D257 PolarHBondContact O-N 2.89Å; E254-L258 VanDerWaalsContact O-CB 3.28Å; E254-L258 WeakPolarHBondContact O-CB 3.42Å; E254-L258 PolarHBondContact O-N 3.19Å
255E88.4Confident84.5Confident134 Ų134108.1 Ų108.163%0.62652%0.521SS*.Hα-helixtrans-59.6-43.6172.4-72.6-179.4152.700112L251 K253 L258 V259L251-E255 WeakPolarHBondContact O-CG 3.48Å; L251-E255 PolarHBondContact O-N 3.25Å; K253-E255 VanDerWaalsContact C-N 3.35Å; K253-E255 PolarHBondContact O-N 3.48Å; E255-L258 PolarHBondContact O-N 3.29Å; E255-V259 WeakPolarHBondContact O-CG2 3.49Å; E255-V259 PolarHBondContact O-N 3.03Å
256H93.4Very high86.3Confident111 Ų111103.7 Ų103.751%0.51451%0.511SS..Hα-helixtrans-63.2-47.5176.6-175.979000112.3A252 K253 E254 L258 V259 L260A252-H256 WeakPolarHBondContact O-CB 3.43Å; A252-H256 PolarHBondContact O-N 3.03Å; A252-H256 VanDerWaalsContact O-N 3.13Å; K253-H256 WeakPolarHBondContact O-CB 3.49Å; K253-H256 PolarHBondContact O-N 3Å; E254-H256 PolarHBondContact O-N 3.37Å; H256-L258 VanDerWaalsContact C-N 3.29Å; H256-L258 PolarHBondContact O-N 2.99Å; H256-V259 PolarHBondContact O-N 3.05Å; H256-L260 WeakPolarHBondContact NE2-CD1 3.45Å; H256-L260 WeakPolarHBondContact O-CG 3.43Å; H256-L260 PolarHBondContact O-N 2.95Å
257D95Very high88Confident77 Ų77101.8 Ų101.841%0.41251%0.512SS..Hα-helixtrans-62.9-36.4178.1-75.3-27.9000111.4K253 E254 L260 A261K253-D257 PolarHBondContact O-N 3.23Å; E254-D257 PolarHBondContact O-N 2.89Å; D257-L260 PolarHBondContact O-N 3.07Å; D257-A261 WeakPolarHBondContact O-CB 3.43Å; D257-A261 PolarHBondContact O-N 3.27Å
258L95.1Very high89.6Confident116 Ų11699.9 Ų99.961%0.60751%0.513SS*.Hα-helixtrans-66.6-42.3173.5-178.762000112.4E254 E255 H256 A261 N262E254-L258 VanDerWaalsContact O-CB 3.28Å; E254-L258 WeakPolarHBondContact O-CB 3.42Å; E254-L258 PolarHBondContact O-N 3.19Å; E255-L258 PolarHBondContact O-N 3.29Å; H256-L258 VanDerWaalsContact C-N 3.29Å; H256-L258 PolarHBondContact O-N 2.99Å; L258-A261 PolarHBondContact O-N 3.1Å; L258-N262 WeakPolarHBondContact O-CB 3.47Å; L258-N262 PolarHBondContact O-N 2.74Å
259V94.5Very high91.1Very high77 Ų77101.9 Ų101.947%0.46751%0.511SS..Hα-helixtrans-62.2-45.1174.6167.50000110.8E255 H256 A261 N262 H263E255-V259 WeakPolarHBondContact O-CG2 3.49Å; E255-V259 PolarHBondContact O-N 3.03Å; H256-V259 PolarHBondContact O-N 3.05Å; V259-A261 VanDerWaalsContact C-N 3.34Å; V259-A261 PolarHBondContact O-N 3.46Å; V259-N262 WeakPolarHBondContact O-CB 3.34Å; V259-N262 PolarHBondContact O-N 2.98Å; V259-H263 PolarHBondContact O-N 3.23Å
260L95.8Very high92.3Very high64 Ų64100.7 Ų100.734%0.33550%0.504SS..Hα-helixtrans-62.7-39.5175-68.3-178.7000112.1H256 D257 N262 H263 R264H256-L260 WeakPolarHBondContact NE2-CD1 3.45Å; H256-L260 WeakPolarHBondContact O-CG 3.43Å; H256-L260 PolarHBondContact O-N 2.95Å; D257-L260 PolarHBondContact O-N 3.07Å; L260-N262 VanDerWaalsContact C-N 3.34Å; L260-H263 PolarHBondContact O-N 3.07Å; L260-R264 WeakPolarHBondContact O-CG 3.32Å; L260-R264 PolarHBondContact O-N 3.42Å
261A96.5Very high93.4Very high25 Ų2599.8 Ų99.821%0.20750%0.5CS..Hα-helixtrans-65.4-36.9174.400000112.4D257 L258 V259 R264 K265D257-A261 WeakPolarHBondContact O-CB 3.43Å; D257-A261 PolarHBondContact O-N 3.27Å; L258-A261 PolarHBondContact O-N 3.1Å; V259-A261 VanDerWaalsContact C-N 3.34Å; V259-A261 PolarHBondContact O-N 3.46Å; A261-R264 PolarHBondContact O-N 3.3Å; A261-K265 WeakPolarHBondContact O-CG 3.48Å; A261-K265 PolarHBondContact O-N 3.41Å
262N97.2Very high94.5Very high93 Ų93100.1 Ų100.150%0.49750%0.499SS..Hα-helixtrans-66-47.9175.3-163.2-37.1000110.9L258 V259 L260 R264 K265 V266L258-N262 WeakPolarHBondContact O-CB 3.47Å; L258-N262 PolarHBondContact O-N 2.74Å; V259-N262 WeakPolarHBondContact O-CB 3.34Å; V259-N262 PolarHBondContact O-N 2.98Å; L260-N262 VanDerWaalsContact C-N 3.34Å; N262-R264 VanDerWaalsContact C-N 3.33Å; N262-R264 PolarHBondContact O-N 2.95Å; N262-K265 WeakPolarHBondContact O-CB 3.44Å; N262-K265 PolarHBondContact O-N 2.93Å; N262-K265 VanDerWaalsContact O-N 3.07Å; N262-V266 WeakPolarHBondContact O-CG2 3.2Å; N262-V266 PolarHBondContact O-N 2.87Å
263H97.1Very high95.4Very high114 Ų114102.5 Ų102.553%0.52850%0.5SS..Hα-helixtrans-55.1-45.3173.5-71.6160.1000112.3V259 L260 K265 V266 S267V259-H263 PolarHBondContact O-N 3.23Å; L260-H263 PolarHBondContact O-N 3.07Å; H263-K265 PolarHBondContact O-N 3.49Å; H263-V266 PolarHBondContact O-N 3.49Å; H263-S267 PolarHBondContact O-N 3.48Å; H263-S267 PolarHBondContact O-OG 2.91Å
264R98.1Very high95.9Very high146 Ų146103.5 Ų103.555%0.55150%0.5SS*.Hα-helixtrans-58.7-45174.4-72.2-174-65.5-93.44.1112.5L260 A261 N262 S267 L268L260-R264 WeakPolarHBondContact O-CG 3.32Å; L260-R264 PolarHBondContact O-N 3.42Å; A261-R264 PolarHBondContact O-N 3.3Å; N262-R264 VanDerWaalsContact C-N 3.33Å; N262-R264 PolarHBondContact O-N 2.95Å; R264-S267 PolarHBondContact O-N 3.19Å; R264-L268 WeakPolarHBondContact O-CG 3.36Å; R264-L268 PolarHBondContact O-N 3.21Å; R264-L268 VanDerWaalsContact O-N 3.1Å
265K98Very high96.3Very high152 Ų152101.1 Ų101.166%0.66149%0.489SS*.Hα-helixtrans-62.6-41.4176.7-73.1174.3-179.1-178.60112.2A261 N262 H263 L268 Y269A261-K265 WeakPolarHBondContact O-CG 3.48Å; A261-K265 PolarHBondContact O-N 3.41Å; N262-K265 WeakPolarHBondContact O-CB 3.44Å; N262-K265 PolarHBondContact O-N 2.93Å; N262-K265 VanDerWaalsContact O-N 3.07Å; H263-K265 PolarHBondContact O-N 3.49Å; K265-L268 PolarHBondContact O-N 2.93Å; K265-Y269 WeakPolarHBondContact O-CB 3.39Å; K265-Y269 PolarHBondContact O-N 3.27Å
266V97Very high96.7Very high66 Ų6696.1 Ų96.140%0.447%0.474SS..Hα-helixtrans-65.6-43.5177.1171.90000111.2N262 H263 L268 Y269 L270N262-V266 WeakPolarHBondContact O-CG2 3.2Å; N262-V266 PolarHBondContact O-N 2.87Å; H263-V266 PolarHBondContact O-N 3.49Å; V266-L268 PolarHBondContact O-N 3.38Å; V266-Y269 PolarHBondContact O-N 2.95Å; V266-L270 HydrophobicContact CG1-CD1 4Å; V266-L270 HydrophobicContact CG1-CG 4.39Å; V266-L270 VanDerWaalsContact O-CG 3.32Å; V266-L270 WeakPolarHBondContact O-CG 3.5Å; V266-L270 PolarHBondContact O-N 3.31Å
267S95.6Very high96.9Very high78 Ų7896.2 Ų96.255%0.54548%0.477SS..Hα-helixtrans-58.6-47.9175.5-64.90000112.2H263 R264 Y269 L270 E271H263-S267 PolarHBondContact O-N 3.48Å; H263-S267 PolarHBondContact O-OG 2.91Å; R264-S267 PolarHBondContact O-N 3.19Å; S267-Y269 PolarHBondContact O-N 3.13Å; S267-L270 PolarHBondContact O-N 3.45Å; S267-E271 PolarHBondContact O-N 3.2Å
268L97.4Very high97Very high115 Ų11597.2 Ų97.260%0.60248%0.478SS*.Hα-helixtrans-62-41.8176.6-70.6170.6000112.3R264 K265 V266 L270 E271 E272R264-L268 WeakPolarHBondContact O-CG 3.36Å; R264-L268 PolarHBondContact O-N 3.21Å; R264-L268 VanDerWaalsContact O-N 3.1Å; K265-L268 PolarHBondContact O-N 2.93Å; V266-L268 PolarHBondContact O-N 3.38Å; L268-L270 PolarHBondContact O-N 3.3Å; L268-E271 PolarHBondContact O-N 3.18Å; L268-E272 WeakPolarHBondContact O-CB 3.44Å; L268-E272 PolarHBondContact O-N 3.46Å
269Y97.7Very high97.2Very high130 Ų13098.1 Ų98.151%0.5147%0.473SS..Hα-helixtrans-60.9-44.1175.5173.1-91.2000112K265 V266 S267 E271 E272 K273K265-Y269 WeakPolarHBondContact O-CB 3.39Å; K265-Y269 PolarHBondContact O-N 3.27Å; V266-Y269 PolarHBondContact O-N 2.95Å; S267-Y269 PolarHBondContact O-N 3.13Å; Y269-E271 VanDerWaalsContact C-N 3.33Å; Y269-E271 PolarHBondContact O-N 3.4Å; Y269-E272 PolarHBondContact O-N 3.07Å; Y269-K273 HydrophobicContact CD1-CG 4.32Å; Y269-K273 HydrophobicContact CE1-CG 3.91Å; Y269-K273 HydrophobicContact CE2-CD 4.46Å; Y269-K273 HydrophobicContact CE2-CG 4.35Å; Y269-K273 VanDerWaalsContact CZ-CE 3.46Å; Y269-K273 WeakPolarHBondContact O-CG 3.34Å; Y269-K273 PolarHBondContact O-N 3.12Å
270L97.6Very high97.3Very high96 Ų9699.7 Ų99.750%0.50347%0.474SS..Hα-helixtrans-66-36.2178.7-70172.4000112.2V266 S267 L268 R274V266-L270 HydrophobicContact CG1-CD1 4Å; V266-L270 HydrophobicContact CG1-CG 4.39Å; V266-L270 VanDerWaalsContact O-CG 3.32Å; V266-L270 WeakPolarHBondContact O-CG 3.5Å; V266-L270 PolarHBondContact O-N 3.31Å; S267-L270 PolarHBondContact O-N 3.45Å; L268-L270 PolarHBondContact O-N 3.3Å; L270-R274 PolarHBondContact O-N 2.9Å
271E97.2Very high97.4Very high105 Ų105102.8 Ų102.849%0.49149%0.486SS..Hα-helixtrans-67.4-46173.4-175.8158.9-118.600112.1S267 L268 Y269 K273 R274 E275S267-E271 PolarHBondContact O-N 3.2Å; L268-E271 PolarHBondContact O-N 3.18Å; Y269-E271 VanDerWaalsContact C-N 3.33Å; Y269-E271 PolarHBondContact O-N 3.4Å; E271-K273 VanDerWaalsContact C-N 3.3Å; E271-K273 PolarHBondContact O-N 3.41Å; E271-R274 WeakPolarHBondContact O-CB 3.4Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 VanDerWaalsContact O-N 3.07Å; E271-E275 PolarHBondContact O-N 2.94Å
272E97.3Very high97.5Very high107 Ų107106.1 Ų106.150%0.550%0.498SS..Hα-helixtrans-57.6-41.7173.9-170-151.7-148.900111.6L268 Y269 G276L268-E272 WeakPolarHBondContact O-CB 3.44Å; L268-E272 PolarHBondContact O-N 3.46Å; Y269-E272 PolarHBondContact O-N 3.07Å; E272-G276 PolarHBondContact O-N 3.14Å
273K98.2Very high97.5Very high100 Ų100107 Ų10744%0.43550%0.502SS..Hα-helixtrans-67.7-33175.7-65.3-45171.6-133.60113.2Y269 E271 L277Y269-K273 HydrophobicContact CD1-CG 4.32Å; Y269-K273 HydrophobicContact CE1-CG 3.91Å; Y269-K273 HydrophobicContact CE2-CD 4.46Å; Y269-K273 HydrophobicContact CE2-CG 4.35Å; Y269-K273 VanDerWaalsContact CZ-CE 3.46Å; Y269-K273 WeakPolarHBondContact O-CG 3.34Å; Y269-K273 PolarHBondContact O-N 3.12Å; E271-K273 VanDerWaalsContact C-N 3.3Å; E271-K273 PolarHBondContact O-N 3.41Å; K273-L277 WeakPolarHBondContact O-CB 3.48Å; K273-L277 PolarHBondContact O-N 3.06Å
274R97.9Very high97.5Very high150 Ų150106.8 Ų106.857%0.56650%0.501SS*.Hα-helixtrans-66.8-50.9174.1-168.1-173.4-58.2115.51.5111.1L270 E271 G276 L277 K278L270-R274 PolarHBondContact O-N 2.9Å; E271-R274 WeakPolarHBondContact O-CB 3.4Å; E271-R274 PolarHBondContact O-N 3.38Å; E271-R274 VanDerWaalsContact O-N 3.07Å; R274-G276 VanDerWaalsContact C-N 3.33Å; R274-G276 PolarHBondContact O-N 3.07Å; R274-L277 PolarHBondContact O-N 2.66Å; R274-K278 PolarHBondContact O-N 2.79Å
275E97.9Very high97.5Very high68 Ų68104 Ų10432%0.31849%0.494SS..Hα-helixtrans-67.2-33.3178.6-72.2-58.712000112.5E271 K278 R279E271-E275 PolarHBondContact O-N 2.94Å; E275-K278 PolarHBondContact O-N 2.86Å; E275-K278 IonicContact OE2-NZ 3.54Å; E275-R279 WeakPolarHBondContact O-CB 3.42Å; E275-R279 WeakPolarHBondContact O-CG 3.48Å; E275-R279 PolarHBondContact O-N 3.08Å
276G96.9Very high97.5Very high29 Ų29102.9 Ų102.930%0.29949%0.492SS..Hα-helixtrans-64.2-39.7172.200000113E272 R274 K280E272-G276 PolarHBondContact O-N 3.14Å; R274-G276 VanDerWaalsContact C-N 3.33Å; R274-G276 PolarHBondContact O-N 3.07Å; G276-K280 WeakPolarHBondContact O-CB 3.48Å; G276-K280 PolarHBondContact O-N 3.42Å; G276-K280 VanDerWaalsContact O-N 3.1Å
277L96.8Very high97.5Very high113 Ų113104.4 Ų104.459%0.59250%0.497SS*.Hα-helixtrans-68-41.8174.5-177.862.4000111.7K273 R274 K280 Q281K273-L277 WeakPolarHBondContact O-CB 3.48Å; K273-L277 PolarHBondContact O-N 3.06Å; R274-L277 PolarHBondContact O-N 2.66Å; L277-K280 WeakPolarHBondContact O-CB 3.39Å; L277-K280 PolarHBondContact O-N 3Å; L277-Q281 PolarHBondContact O-N 3.44Å
278K98.1Very high97.7Very high98 Ų98105.3 Ų105.343%0.42650%0.495SS..Hα-helixtrans-59.3-52176.1-177-173.5168.5-163.10111.7R274 E275 K280 Q281 E282R274-K278 PolarHBondContact O-N 2.79Å; E275-K278 PolarHBondContact O-N 2.86Å; E275-K278 IonicContact OE2-NZ 3.54Å; K278-K280 VanDerWaalsContact C-N 3.28Å; K278-K280 PolarHBondContact O-N 3.3Å; K278-Q281 WeakPolarHBondContact O-CB 3.32Å; K278-Q281 PolarHBondContact O-N 3.49Å; K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CG-OE1 3.24Å; K278-E282 WeakPolarHBondContact O-CG 3.4Å; K278-E282 PolarHBondContact O-N 2.95Å
279R97.9Very high97.7Very high134 Ų134107.7 Ų107.751%0.50650%0.496SS..Hα-helixtrans-57.5-38.3174.7-76.1-179.3-111119.8-5.7113E275 E282 L283E275-R279 WeakPolarHBondContact O-CB 3.42Å; E275-R279 WeakPolarHBondContact O-CG 3.48Å; E275-R279 PolarHBondContact O-N 3.08Å; R279-E282 PolarHBondContact O-N 3.19Å; R279-L283 WeakPolarHBondContact O-CG 3.31Å; R279-L283 PolarHBondContact O-N 3.48Å; R279-L283 VanDerWaalsContact O-N 3.08Å
280K97.4Very high97.7Very high111 Ų111104 Ų10448%0.48349%0.493SS..Hα-helixtrans-63.6-42.7174.5-179.7179.5179.3-75.10111.8G276 L277 K278 L283 E284G276-K280 WeakPolarHBondContact O-CB 3.48Å; G276-K280 PolarHBondContact O-N 3.42Å; G276-K280 VanDerWaalsContact O-N 3.1Å; L277-K280 WeakPolarHBondContact O-CB 3.39Å; L277-K280 PolarHBondContact O-N 3Å; K278-K280 VanDerWaalsContact C-N 3.28Å; K278-K280 PolarHBondContact O-N 3.3Å; K280-L283 PolarHBondContact O-N 3.28Å; K280-E284 WeakPolarHBondContact CE-OE1 3.39Å; K280-E284 IonicContact NZ-OE1 3.73Å; K280-E284 PolarHBondContact NZ-OE1 3.48Å; K280-E284 IonicContact NZ-OE2 3Å; K280-E284 WeakPolarHBondContact O-CG 3.43Å; K280-E284 PolarHBondContact O-N 3.03Å
281Q97.6Very high97.7Very high128 Ų128105.5 Ų105.560%0.59850%0.495SS*.Hα-helixtrans-65.2-42.1177.9-177.6178.1-14.300111.7L277 K278 L283 E284 E285L277-Q281 PolarHBondContact O-N 3.44Å; K278-Q281 WeakPolarHBondContact O-CB 3.32Å; K278-Q281 PolarHBondContact O-N 3.49Å; Q281-L283 PolarHBondContact O-N 2.89Å; Q281-E284 PolarHBondContact O-N 2.81Å; Q281-E285 PolarHBondContact O-N 2.93Å
282E97.9Very high97.7Very high96 Ų96104.4 Ų104.445%0.44949%0.492SS..Hα-helixtrans-58.4-45.9175.1-70.2163.2175.300111.4K278 R279 E285 E286K278-E282 VanDerWaalsContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CE-OE1 3.22Å; K278-E282 WeakPolarHBondContact CG-OE1 3.24Å; K278-E282 WeakPolarHBondContact O-CG 3.4Å; K278-E282 PolarHBondContact O-N 2.95Å; R279-E282 PolarHBondContact O-N 3.19Å; E282-E285 PolarHBondContact O-N 2.82Å; E282-E286 PolarHBondContact O-N 2.94Å
283L98.3Very high97.7Very high112 Ų112106.4 Ų106.459%0.58650%0.499SS*.Hα-helixtrans-66.1-36.5175.9-70.2171.1000113.4R279 K280 Q281 E285 L287R279-L283 WeakPolarHBondContact O-CG 3.31Å; R279-L283 PolarHBondContact O-N 3.48Å; R279-L283 VanDerWaalsContact O-N 3.08Å; K280-L283 PolarHBondContact O-N 3.28Å; Q281-L283 PolarHBondContact O-N 2.89Å; L283-E285 VanDerWaalsContact C-N 3.34Å; L283-L287 WeakPolarHBondContact O-CB 3.49Å; L283-L287 PolarHBondContact O-N 3.49Å
284E97.2Very high97.6Very high108 Ų108105.1 Ų105.151%0.50550%0.499SS..Hα-helixtrans-66.6-37174.4-77.7177.8171.700111.7K280 Q281 L288K280-E284 WeakPolarHBondContact CE-OE1 3.39Å; K280-E284 IonicContact NZ-OE1 3.73Å; K280-E284 PolarHBondContact NZ-OE1 3.48Å; K280-E284 IonicContact NZ-OE2 3Å; K280-E284 WeakPolarHBondContact O-CG 3.43Å; K280-E284 PolarHBondContact O-N 3.03Å; Q281-E284 PolarHBondContact O-N 2.81Å; E284-L288 WeakPolarHBondContact O-CB 3.42Å; E284-L288 PolarHBondContact O-N 3.34Å
285E97.8Very high97.5Very high88 Ų88103 Ų10341%0.41150%0.496SS..Hα-helixtrans-69.7-44.1174.6-163.7-170.6141.300112.1Q281 E282 L283 L287 L288 R289Q281-E285 PolarHBondContact O-N 2.93Å; E282-E285 PolarHBondContact O-N 2.82Å; L283-E285 VanDerWaalsContact C-N 3.34Å; E285-L287 PolarHBondContact O-N 2.93Å; E285-L288 WeakPolarHBondContact O-CB 3.48Å; E285-L288 PolarHBondContact O-N 3.35Å; E285-R289 VanDerWaalsContact O-CG 3.31Å; E285-R289 WeakPolarHBondContact O-CG 3.42Å; E285-R289 PolarHBondContact O-N 3.1Å; E285-R289 IonicContact OE1-CZ 2.7Å; E285-R289 IonicContact OE1-NE 2.75Å; E285-R289 PolarHBondContact OE1-NE 2.88Å; E285-R289 IonicContact OE1-NH2 3.57Å; E285-R289 PolarHBondContact OE1-NH2 3.39Å
286E98Very high97.3Very high129 Ų129106.9 Ų106.960%0.60351%0.511SS*.Hα-helixtrans-60.3-45.3175.3-172.5-179.3-175.100111.2E282 L288 R289 A290E282-E286 PolarHBondContact O-N 2.94Å; E286-L288 VanDerWaalsContact C-N 3.29Å; E286-L288 PolarHBondContact O-N 3.47Å; E286-R289 WeakPolarHBondContact O-CB 3.47Å; E286-R289 PolarHBondContact O-N 2.96Å; E286-A290 WeakPolarHBondContact O-CB 3.45Å; E286-A290 PolarHBondContact O-N 2.88Å
287L97.9Very high97.2Very high97 Ų97110.8 Ų110.851%0.50853%0.525SS..Hα-helixtrans-62-36175.9-179.6148000112.1L283 E285 K291L283-L287 WeakPolarHBondContact O-CB 3.49Å; L283-L287 PolarHBondContact O-N 3.49Å; E285-L287 PolarHBondContact O-N 2.93Å; L287-K291 HydrophobicContact CD2-CD 3.9Å; L287-K291 WeakPolarHBondContact O-CB 3.47Å; L287-K291 WeakPolarHBondContact O-CG 3.34Å; L287-K291 PolarHBondContact O-N 3.04Å
288L98.1Very high96.9Very high98 Ų98108.7 Ų108.751%0.51351%0.511SS..Hα-helixtrans-68.2-44.8173-178.960.3000111.7E284 E285 E286 A290 K291 I292E284-L288 WeakPolarHBondContact O-CB 3.42Å; E284-L288 PolarHBondContact O-N 3.34Å; E285-L288 WeakPolarHBondContact O-CB 3.48Å; E285-L288 PolarHBondContact O-N 3.35Å; E286-L288 VanDerWaalsContact C-N 3.29Å; E286-L288 PolarHBondContact O-N 3.47Å; L288-A290 VanDerWaalsContact C-N 3.32Å; L288-A290 PolarHBondContact O-N 3.33Å; L288-K291 PolarHBondContact O-N 3.45Å; L288-I292 HydrophobicContact CD1-CD1 4.21Å; L288-I292 HydrophobicContact CD1-CG1 4.46Å; L288-I292 HydrophobicContact CG-CD1 4.02Å; L288-I292 VanDerWaalsContact O-CG1 3.31Å; L288-I292 WeakPolarHBondContact O-CG1 3.48Å; L288-I292 PolarHBondContact O-N 3.5Å
289R98Very high96.6Very high165 Ų165106.6 Ų106.662%0.62351%0.512SS*.Hα-helixtrans-59.2-42.4175-71.8167.8176.1-103.44.2111.3E285 E286 I292 K293E285-R289 VanDerWaalsContact O-CG 3.31Å; E285-R289 WeakPolarHBondContact O-CG 3.42Å; E285-R289 PolarHBondContact O-N 3.1Å; E285-R289 IonicContact OE1-CZ 2.7Å; E285-R289 IonicContact OE1-NE 2.75Å; E285-R289 PolarHBondContact OE1-NE 2.88Å; E285-R289 IonicContact OE1-NH2 3.57Å; E285-R289 PolarHBondContact OE1-NH2 3.39Å; E286-R289 WeakPolarHBondContact O-CB 3.47Å; E286-R289 PolarHBondContact O-N 2.96Å; R289-I292 PolarHBondContact O-N 3.29Å; R289-K293 PolarHBondContact O-N 3.04Å
290A97.9Very high96.3Very high53 Ų53101.4 Ų101.444%0.43850%0.498SS..Hα-helixtrans-63.8-46.4175.400000112.1E286 L288 I292 K293 V294E286-A290 WeakPolarHBondContact O-CB 3.45Å; E286-A290 PolarHBondContact O-N 2.88Å; L288-A290 VanDerWaalsContact C-N 3.32Å; L288-A290 PolarHBondContact O-N 3.33Å; A290-I292 PolarHBondContact O-N 2.91Å; A290-K293 WeakPolarHBondContact O-CB 3.46Å; A290-K293 PolarHBondContact O-N 3.38Å; A290-K293 VanDerWaalsContact O-N 3.14Å; A290-V294 WeakPolarHBondContact O-CG2 3.42Å; A290-V294 PolarHBondContact O-N 3.4Å
291K97.3Very high96Very high126 Ų126100.7 Ų100.755%0.54849%0.492SS..Hα-helixtrans-58.1-45.3173.8-78.2176177.6175.90112.1L287 L288 K293 V294 E295L287-K291 HydrophobicContact CD2-CD 3.9Å; L287-K291 WeakPolarHBondContact O-CB 3.47Å; L287-K291 WeakPolarHBondContact O-CG 3.34Å; L287-K291 PolarHBondContact O-N 3.04Å; L288-K291 PolarHBondContact O-N 3.45Å; K291-K293 VanDerWaalsContact C-N 3.31Å; K291-K293 PolarHBondContact O-N 3.19Å; K291-V294 PolarHBondContact O-N 2.96Å; K291-E295 PolarHBondContact O-N 2.88Å
292I97.6Very high95.7Very high82 Ų82100 Ų10042%0.42149%0.492SS..Hα-helixtrans-61.3-39.9176-68.5165.4000110.9L288 R289 A290 E295 K296L288-I292 HydrophobicContact CD1-CD1 4.21Å; L288-I292 HydrophobicContact CD1-CG1 4.46Å; L288-I292 HydrophobicContact CG-CD1 4.02Å; L288-I292 VanDerWaalsContact O-CG1 3.31Å; L288-I292 WeakPolarHBondContact O-CG1 3.48Å; L288-I292 PolarHBondContact O-N 3.5Å; R289-I292 PolarHBondContact O-N 3.29Å; A290-I292 PolarHBondContact O-N 2.91Å; I292-E295 PolarHBondContact O-N 3.5Å; I292-K296 HydrophobicContact CG2-CD 4.18Å; I292-K296 HydrophobicContact CG2-CG 4.45Å; I292-K296 WeakPolarHBondContact O-CB 3.45Å; I292-K296 VanDerWaalsContact O-CG 3.3Å; I292-K296 WeakPolarHBondContact O-CG 3.13Å; I292-K296 PolarHBondContact O-N 2.84Å
293K97.6Very high95.3Very high149 Ų149105 Ų10565%0.64851%0.507SS*.Hα-helixtrans-63.2-43.4175.4-169.9175.5-179.11790111.7R289 A290 K291 K296 L297R289-K293 PolarHBondContact O-N 3.04Å; A290-K293 WeakPolarHBondContact O-CB 3.46Å; A290-K293 PolarHBondContact O-N 3.38Å; A290-K293 VanDerWaalsContact O-N 3.14Å; K291-K293 VanDerWaalsContact C-N 3.31Å; K291-K293 PolarHBondContact O-N 3.19Å; K293-K296 PolarHBondContact O-N 3.44Å; K293-L297 HydrophobicContact CG-CD1 4.46Å; K293-L297 VanDerWaalsContact O-CG 3.32Å; K293-L297 WeakPolarHBondContact O-CG 3.48Å; K293-L297 PolarHBondContact O-N 3.26Å
294V96.1Very high94.9Very high74 Ų74106.5 Ų106.545%0.44851%0.51SS..Hα-helixtrans-62.2-47.4175.4170.50000111.5A290 K291 K296 L297 K298A290-V294 WeakPolarHBondContact O-CG2 3.42Å; A290-V294 PolarHBondContact O-N 3.4Å; K291-V294 PolarHBondContact O-N 2.96Å; V294-K296 PolarHBondContact O-N 3.01Å; V294-L297 PolarHBondContact O-N 3.18Å; V294-L297 VanDerWaalsContact O-N 3.16Å; V294-K298 HydrophobicContact CG1-CD 4.43Å; V294-K298 WeakPolarHBondContact O-CG 3.45Å; V294-K298 PolarHBondContact O-N 3.04Å
295E94.9Very high94.4Very high105 Ų105104.7 Ų104.749%0.49152%0.52SS..Hα-helixtrans-66.9-36.4178.9-67.6-53.6128.100112.4K291 I292 L297 K298 A299K291-E295 PolarHBondContact O-N 2.88Å; I292-E295 PolarHBondContact O-N 3.5Å; E295-L297 VanDerWaalsContact C-N 3.33Å; E295-L297 PolarHBondContact O-N 3.5Å; E295-K298 PolarHBondContact O-N 2.89Å; E295-K298 WeakPolarHBondContact OE1-CD 3.35Å; E295-K298 WeakPolarHBondContact OE1-CE 3.36Å; E295-K298 IonicContact OE1-NZ 2.62Å; E295-K298 PolarHBondContact OE1-NZ 3.04Å; E295-A299 WeakPolarHBondContact O-CB 3.28Å; E295-A299 PolarHBondContact O-N 3.5Å
296K94.9Very high93.8Very high149 Ų149104.6 Ų104.665%0.64852%0.522SS*.Hα-helixtrans-59.9-41.6170-78.3179177.6-175.50112I292 K293 V294 A299 A300I292-K296 HydrophobicContact CG2-CD 4.18Å; I292-K296 HydrophobicContact CG2-CG 4.45Å; I292-K296 WeakPolarHBondContact O-CB 3.45Å; I292-K296 VanDerWaalsContact O-CG 3.3Å; I292-K296 WeakPolarHBondContact O-CG 3.13Å; I292-K296 PolarHBondContact O-N 2.84Å; K293-K296 PolarHBondContact O-N 3.44Å; V294-K296 PolarHBondContact O-N 3.01Å; K296-A299 PolarHBondContact O-N 3.03Å; K296-A300 WeakPolarHBondContact O-CB 3.41Å; K296-A300 PolarHBondContact O-N 3.1Å
297L94.1Very high93Very high111 Ų111103 Ų10358%0.58152%0.523SS*.Hα-helixtrans-68-41.5176.5-72.3170000112K293 V294 E295 A300 R301K293-L297 HydrophobicContact CG-CD1 4.46Å; K293-L297 VanDerWaalsContact O-CG 3.32Å; K293-L297 WeakPolarHBondContact O-CG 3.48Å; K293-L297 PolarHBondContact O-N 3.26Å; V294-L297 PolarHBondContact O-N 3.18Å; V294-L297 VanDerWaalsContact O-N 3.16Å; E295-L297 VanDerWaalsContact C-N 3.33Å; E295-L297 PolarHBondContact O-N 3.5Å; L297-A300 PolarHBondContact O-N 3Å; L297-R301 VanDerWaalsContact O-CB 3.24Å; L297-R301 WeakPolarHBondContact O-CB 3.07Å; L297-R301 PolarHBondContact O-N 3.37Å
298K91.4Very high92Very high70 Ų70102.7 Ų102.730%0.30452%0.521SS..Hα-helixtrans-60.3-45.9172.6-71.7178.6-174.3167.90111.7V294 E295 A300 R301 L302 I308V294-K298 HydrophobicContact CG1-CD 4.43Å; V294-K298 WeakPolarHBondContact O-CG 3.45Å; V294-K298 PolarHBondContact O-N 3.04Å; E295-K298 PolarHBondContact O-N 2.89Å; E295-K298 WeakPolarHBondContact OE1-CD 3.35Å; E295-K298 WeakPolarHBondContact OE1-CE 3.36Å; E295-K298 IonicContact OE1-NZ 2.62Å; E295-K298 PolarHBondContact OE1-NZ 3.04Å; K298-A300 PolarHBondContact O-N 3Å; K298-R301 PolarHBondContact O-N 3.19Å; K298-L302 WeakPolarHBondContact O-CB 3.45Å; K298-L302 PolarHBondContact O-N 2.87Å; K298-I308 HydrophobicContact CD-CG2 4.32Å; K298-I308 HydrophobicContact CG-CG2 4.4Å
299A91Very high90.7Very high53 Ų53102 Ų10244%0.43852%0.523SS..Hα-helixtrans-63.6-40.3177.400000112.3E295 K296 R303E295-A299 WeakPolarHBondContact O-CB 3.28Å; E295-A299 PolarHBondContact O-N 3.5Å; K296-A299 PolarHBondContact O-N 3.03Å; A299-R303 WeakPolarHBondContact O-CG 3.49Å; A299-R303 PolarHBondContact O-N 3.12Å; A299-R303 VanDerWaalsContact O-N 3.12Å
300A92.1Very high89Confident25 Ų25106 Ų10621%0.20755%0.554CS.*Hα-helixtrans-62.1-48.7172.100000111.5K296 L297 K298 L302 R303 H304K296-A300 WeakPolarHBondContact O-CB 3.41Å; K296-A300 PolarHBondContact O-N 3.1Å; L297-A300 PolarHBondContact O-N 3Å; K298-A300 PolarHBondContact O-N 3Å; A300-L302 VanDerWaalsContact C-N 3.33Å; A300-L302 PolarHBondContact O-N 3.48Å; A300-R303 WeakPolarHBondContact O-CB 3.2Å; A300-R303 PolarHBondContact O-N 3.01Å; A300-R303 VanDerWaalsContact O-N 3.13Å; A300-H304 PolarHBondContact O-CD2 3.29Å; A300-H304 PolarHBondContact O-N 3.46Å; A300-H304 VanDerWaalsContact O-N 3.14Å
301R90.6Very high88.6Confident96 Ų96108.6 Ų108.636%0.36256%0.56SS.*Hα-helixtrans-59.8-40.4179.8-169.2170.9167102.2-0.6112.4L297 K298 H304 G305 L306 P307L297-R301 VanDerWaalsContact O-CB 3.24Å; L297-R301 WeakPolarHBondContact O-CB 3.07Å; L297-R301 PolarHBondContact O-N 3.37Å; K298-R301 PolarHBondContact O-N 3.19Å; R301-H304 CarbonylContact O-C 3.49Å; R301-H304 PolarHBondContact O-N 3.39Å; R301-G305 PolarHBondContact O-N 2.65Å; R301-L306 HydrophobicContact CG-CB 3.41Å; R301-L306 VanDerWaalsContact CG-CB 3.41Å; R301-L306 HydrophobicContact CG-CD1 4.19Å; R301-L306 HydrophobicContact CG-CG 4.46Å; R301-L306 PolarHBondContact O-N 3.2Å; R301-P307 VanDerWaalsContact CZ-O 3.25Å; R301-P307 PolarHBondContact NE-O 3.2Å; R301-P307 PolarHBondContact NH2-O 3.38Å
302L90.3Very high88.2Confident114 Ų114107.7 Ų107.760%0.59756%0.561SS**Hα-helixtrans-64.4-41.8173.9-175.464.7000112.5K298 A300 H304 G305K298-L302 WeakPolarHBondContact O-CB 3.45Å; K298-L302 PolarHBondContact O-N 2.87Å; A300-L302 VanDerWaalsContact C-N 3.33Å; A300-L302 PolarHBondContact O-N 3.48Å; L302-H304 PolarHBondContact O-N 3.42Å; L302-G305 PolarHBondContact O-N 2.83Å
303R90.6Very high87.6Confident202 Ų202109.1 Ų109.176%0.76257%0.569SS**Hα-helixtrans-62.3-25.7174-71.5-177.8-59.2177.86.2113.1A299 A300A299-R303 WeakPolarHBondContact O-CG 3.49Å; A299-R303 PolarHBondContact O-N 3.12Å; A299-R303 VanDerWaalsContact O-N 3.12Å; A300-R303 WeakPolarHBondContact O-CB 3.2Å; A300-R303 PolarHBondContact O-N 3.01Å; A300-R303 VanDerWaalsContact O-N 3.13Å
304H90.5Very high87Confident143 Ų143106.8 Ų106.866%0.66256%0.564SS**THydrogen-bonded Turntrans-93.211.2173.9-63.1-62.9000113.7A300 R301 L302 L306A300-H304 PolarHBondContact O-CD2 3.29Å; A300-H304 PolarHBondContact O-N 3.46Å; A300-H304 VanDerWaalsContact O-N 3.14Å; R301-H304 CarbonylContact O-C 3.49Å; R301-H304 PolarHBondContact O-N 3.39Å; L302-H304 PolarHBondContact O-N 3.42Å; H304-L306 HydrophobicContact CB-CD1 4.42Å; H304-L306 PolarHBondContact O-N 3.5Å
305G86.4Confident86.5Confident69 Ų69108.8 Ų108.871%0.71157%0.571SS**THydrogen-bonded Turntrans70.312.9175.700000115.3R301 L302R301-G305 PolarHBondContact O-N 2.65Å; L302-G305 PolarHBondContact O-N 2.83Å
306L84.9Confident85.9Confident86 Ų86109.1 Ų109.145%0.4558%0.577SS.*PPolyproline II helixtrans-90.4141.5-175.6-70.8171.1000111.6R301 H304R301-L306 HydrophobicContact CG-CB 3.41Å; R301-L306 VanDerWaalsContact CG-CB 3.41Å; R301-L306 HydrophobicContact CG-CD1 4.19Å; R301-L306 HydrophobicContact CG-CG 4.46Å; R301-L306 PolarHBondContact O-N 3.2Å; H304-L306 HydrophobicContact CB-CD1 4.42Å; H304-L306 PolarHBondContact O-N 3.5Å
307P80.1Confident85.3Confident95 Ų95106.2 Ų106.262%0.61757%0.572SS**PPolyproline II helixtrans-69.2138.8-174.127.3-34.9000112.3R301R301-P307 VanDerWaalsContact CZ-O 3.25Å; R301-P307 PolarHBondContact NE-O 3.2Å; R301-P307 PolarHBondContact NH2-O 3.38Å
308I77.9Confident84.6Confident92 Ų92105.8 Ų105.847%0.47257%0.571SS.*PPolyproline II helixtrans-72.3128-178.8-58.7173000109.8K298K298-I308 HydrophobicContact CD-CG2 4.32Å; K298-I308 HydrophobicContact CG-CG2 4.4Å
309P71Confident84Confident84 Ų84108.8 Ų108.855%0.54559%0.593SS.*PPolyproline II helixtrans-65.4137170.4-17.231.3000111.2
310L63.1Low83.4Confident247 Ų247113.9 Ų113.9100%1.29361%0.607SS**  trans-75.90171.7-69.1171.9000111.1

Retrieved 310 of 310 residues in 94 ms (Link to these results)

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