A0A5K4F547_SCHMA Loading...

Prefoldin subunit 4

Binds specifically to cytosolic chaperonin (c-CPN) and transfers target proteins to it. Binds to nascent polypeptide chain and promotes folding in an environment in which there are many competing pathways for nonnative proteins.

AlphaFold DB , UniProt , Accession A0A5K4F547, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 122 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M41.3Very low77.8Confident234 Ų234106.1 Ų106.1100%1.15357%0.565SS**  0107.80-71.1174.6172.200105E3M1-E3 PolarHBondContact O-N 3.1Å; M1-E3 VanDerWaalsContact O-N 3.1Å
2S56.1Low79.1Confident106 Ų106103.9 Ų103.974%0.74155%0.549SS*.  trans-61.7107.2164.337.20000105.2D4S2-D4 VanDerWaalsContact C-N 3.25Å; S2-D4 PolarHBondContact O-N 2.84Å
3E61.5Low80.4Confident165 Ų165103.9 Ų103.977%0.77154%0.544SS*.  trans-60103.6162.3-78.6175.3163.700104.6M1 I5M1-E3 PolarHBondContact O-N 3.1Å; M1-E3 VanDerWaalsContact O-N 3.1Å; E3-I5 PolarHBondContact O-N 2.92Å
4D70.9Confident81.5Confident152 Ų152103.1 Ų103.181%0.81353%0.53SS*.  trans-6196.2168-98.5-62.7000105.7S2 E6S2-D4 VanDerWaalsContact C-N 3.25Å; S2-D4 PolarHBondContact O-N 2.84Å; D4-E6 PolarHBondContact O-N 2.93Å
5I77.6Confident82.3Confident50 Ų5099 Ų9926%0.25651%0.509SS..  trans-68.7107.6178.4-59.9176.8000106.5E3 V7 F113 H116E3-I5 PolarHBondContact O-N 2.92Å; I5-V7 PolarHBondContact O-N 3.29Å; I5-F113 HydrophobicContact CB-CD1 4.4Å; I5-F113 HydrophobicContact CG2-CD1 3.54Å; I5-F113 HydrophobicContact CG2-CE1 3.6Å; I5-H116 HydrophobicContact CD1-CB 4.04Å; I5-H116 WeakPolarHBondContact CD1-ND1 3.2Å
6E86.7Confident83.2Confident159 Ų15998.3 Ų98.374%0.74351%0.506SS*.  trans-65.9117.7177.4-170.7179.9-169.100110.1D4 T8D4-E6 PolarHBondContact O-N 2.93Å; E6-T8 PolarHBondContact O-N 3.07Å
7V89.4Confident83.9Confident77 Ų7795.4 Ų95.447%0.46750%0.497SS..  trans-83.5109.2174.5-1770000108.4I5 D11 F113I5-V7 PolarHBondContact O-N 3.29Å; V7-D11 HydrophobicContact CG1-CB 4.29Å; V7-F113 HydrophobicContact CG1-CZ 4.39Å; V7-F113 HydrophobicContact CG2-CE1 3.84Å; V7-F113 HydrophobicContact CG2-CZ 4.24Å
8T92.8Very high84.6Confident55 Ų5590.9 Ų90.934%0.33747%0.473SS..  trans-80.6161.2176.474.70000110.8E6 G10 D11 Q12E6-T8 PolarHBondContact O-N 3.07Å; T8-G10 PolarHBondContact O-N 3.21Å; T8-D11 VanDerWaalsContact CB-OD2 3.3Å; T8-D11 WeakPolarHBondContact CB-OD2 2.92Å; T8-D11 PolarHBondContact N-OD2 2.85Å; T8-D11 WeakPolarHBondContact O-CB 3.35Å; T8-D11 PolarHBondContact O-N 3.43Å; T8-D11 PolarHBondContact OG1-N 3.42Å; T8-D11 PolarHBondContact OG1-OD2 3.35Å; T8-Q12 PolarHBondContact O-N 3.18Å; T8-Q12 VanDerWaalsContact O-N 3.11Å
9H92.5Very high85.1Confident141 Ų14189.1 Ų89.165%0.65347%0.472SS*.Hα-helixtrans-54.9-39.4174.6-176.970.8000112.7D11 Q12 Q13H9-D11 VanDerWaalsContact C-N 3.29Å; H9-D11 PolarHBondContact O-N 2.92Å; H9-Q12 PolarHBondContact O-N 3.23Å; H9-Q13 PolarHBondContact CD2-NE2 3.03Å; H9-Q13 PolarHBondContact NE2-NE2 2.74Å; H9-Q13 WeakPolarHBondContact O-CG 3.37Å; H9-Q13 PolarHBondContact O-N 3.12Å
10G93.9Very high85.7Confident26 Ų2688.3 Ų88.327%0.26847%0.471SS..Hα-helixtrans-64.8-32.8177.700000112.9T8 R14T8-G10 PolarHBondContact O-N 3.21Å; G10-R14 WeakPolarHBondContact O-CG 3.33Å; G10-R14 PolarHBondContact O-N 2.9Å; G10-R14 VanDerWaalsContact O-N 3.13Å
11D93Very high86.2Confident2 Ų287 Ų871%0.01146%0.46CS..Hα-helixtrans-71.7-43.5175.7-51.6-48.1000111.2V7 T8 H9 Q13 R14 I15 K112 F113V7-D11 HydrophobicContact CG1-CB 4.29Å; T8-D11 VanDerWaalsContact CB-OD2 3.3Å; T8-D11 WeakPolarHBondContact CB-OD2 2.92Å; T8-D11 PolarHBondContact N-OD2 2.85Å; T8-D11 WeakPolarHBondContact O-CB 3.35Å; T8-D11 PolarHBondContact O-N 3.43Å; T8-D11 PolarHBondContact OG1-N 3.42Å; T8-D11 PolarHBondContact OG1-OD2 3.35Å; H9-D11 VanDerWaalsContact C-N 3.29Å; H9-D11 PolarHBondContact O-N 2.92Å; D11-Q13 PolarHBondContact O-N 2.69Å; D11-R14 WeakPolarHBondContact O-CB 3.21Å; D11-R14 PolarHBondContact O-N 3.27Å; D11-R14 IonicContact OD1-NH1 2.92Å; D11-R14 PolarHBondContact OD1-NH1 2.87Å; D11-I15 WeakPolarHBondContact O-CG1 3.5Å; D11-I15 PolarHBondContact O-N 3.23Å; D11-K112 VanDerWaalsContact OD1-CD 3.26Å; D11-K112 WeakPolarHBondContact OD1-CD 3.48Å; D11-K112 IonicContact OD1-NZ 2.74Å; D11-K112 PolarHBondContact OD1-NZ 3.08Å; D11-K112 VanDerWaalsContact OD2-CE 3.28Å; D11-K112 WeakPolarHBondContact OD2-CE 3.38Å; D11-K112 IonicContact OD2-NZ 3.06Å; D11-K112 PolarHBondContact OD2-NZ 3.42Å; D11-F113 HydrophobicContact CB-CE2 3.87Å; D11-F113 HydrophobicContact CB-CZ 3.71Å
12Q93.2Very high88.8Confident80 Ų8077.2 Ų77.237%0.37441%0.412SS..Hα-helixtrans-60.2-37.9175.5-170.560.955.300111.6T8 H9 I15 N16T8-Q12 PolarHBondContact O-N 3.18Å; T8-Q12 VanDerWaalsContact O-N 3.11Å; H9-Q12 PolarHBondContact O-N 3.23Å; Q12-I15 PolarHBondContact O-N 3.46Å; Q12-N16 PolarHBondContact NE2-OD1 3.37Å; Q12-N16 WeakPolarHBondContact O-CB 3.28Å; Q12-N16 PolarHBondContact O-N 2.89Å; Q12-N16 PolarHBondContact O-OD1 3.06Å
13Q95.9Very high90.7Very high104 Ų10477.1 Ų77.149%0.48640%0.403SS..Hα-helixtrans-61.8-41.7173.1-74-178.3-17.500112.3H9 D11 N16 S17H9-Q13 PolarHBondContact CD2-NE2 3.03Å; H9-Q13 PolarHBondContact NE2-NE2 2.74Å; H9-Q13 WeakPolarHBondContact O-CG 3.37Å; H9-Q13 PolarHBondContact O-N 3.12Å; D11-Q13 PolarHBondContact O-N 2.69Å; Q13-N16 PolarHBondContact O-N 3.43Å; Q13-S17 WeakPolarHBondContact O-CB 3.33Å; Q13-S17 PolarHBondContact O-N 3.08Å; Q13-S17 PolarHBondContact O-OG 3.3Å
14R95.8Very high92.5Very high92 Ų9272.9 Ų72.935%0.34738%0.382SS..Hα-helixtrans-64-41.8174.5-71178.2-175.8112.33.3112.1G10 D11 S17 F18 L105 E108 L109G10-R14 WeakPolarHBondContact O-CG 3.33Å; G10-R14 PolarHBondContact O-N 2.9Å; G10-R14 VanDerWaalsContact O-N 3.13Å; D11-R14 WeakPolarHBondContact O-CB 3.21Å; D11-R14 PolarHBondContact O-N 3.27Å; D11-R14 IonicContact OD1-NH1 2.92Å; D11-R14 PolarHBondContact OD1-NH1 2.87Å; R14-S17 WeakPolarHBondContact O-CB 3.39Å; R14-S17 PolarHBondContact O-N 3.49Å; R14-F18 WeakPolarHBondContact O-CB 3.26Å; R14-F18 PolarHBondContact O-N 3.11Å; R14-L105 HydrophobicContact CB-CD2 4Å; R14-L105 HydrophobicContact CG-CD2 4.02Å; R14-E108 VanDerWaalsContact CD-OE2 3.3Å; R14-E108 WeakPolarHBondContact CD-OE2 3.03Å; R14-E108 IonicContact CZ-OE2 2.99Å; R14-E108 IonicContact NE-OE2 2.71Å; R14-E108 PolarHBondContact NE-OE2 3.24Å; R14-E108 IonicContact NH2-OE2 3.22Å; R14-L109 HydrophobicContact CB-CD1 4.42Å; R14-L109 HydrophobicContact CB-CD2 3.91Å; R14-L109 HydrophobicContact CB-CG 4.29Å
15I94.6Very high93.8Very high42 Ų4266.9 Ų66.922%0.21535%0.348CS..Hα-helixtrans-60.8-49.2176.4-66.8169.3000110.2D11 Q12 S17 F18 A19 L109 I117D11-I15 WeakPolarHBondContact O-CG1 3.5Å; D11-I15 PolarHBondContact O-N 3.23Å; Q12-I15 PolarHBondContact O-N 3.46Å; I15-S17 VanDerWaalsContact C-N 3.28Å; I15-S17 PolarHBondContact O-N 2.63Å; I15-F18 WeakPolarHBondContact O-CB 3.11Å; I15-F18 PolarHBondContact O-N 2.58Å; I15-A19 PolarHBondContact O-N 2.9Å; I15-L109 HydrophobicContact CD1-CD2 4.48Å; I15-L109 HydrophobicContact CG1-CD1 4.08Å; I15-L109 HydrophobicContact CG1-CD2 3.71Å; I15-I117 HydrophobicContact CD1-CD1 3.97Å; I15-I117 HydrophobicContact CG1-CD1 3.96Å
16N95.4Very high94.7Very high87 Ų8768.7 Ų68.747%0.46535%0.354SS..Hα-helixtrans-62.9-38.1178-66.5-6.7000111.6Q12 Q13 A19 T20Q12-N16 PolarHBondContact NE2-OD1 3.37Å; Q12-N16 WeakPolarHBondContact O-CB 3.28Å; Q12-N16 PolarHBondContact O-N 2.89Å; Q12-N16 PolarHBondContact O-OD1 3.06Å; Q13-N16 PolarHBondContact O-N 3.43Å; N16-A19 PolarHBondContact O-N 3.41Å; N16-T20 WeakPolarHBondContact O-CB 3.33Å; N16-T20 PolarHBondContact O-N 3.38Å; N16-T20 PolarHBondContact O-OG1 3.02Å
17S96.1Very high95.2Very high50 Ų5065.4 Ų65.435%0.3534%0.342SS..Hα-helixtrans-64.2-43.3175.2-59.40000111Q13 R14 I15 T20 W21Q13-S17 WeakPolarHBondContact O-CB 3.33Å; Q13-S17 PolarHBondContact O-N 3.08Å; Q13-S17 PolarHBondContact O-OG 3.3Å; R14-S17 WeakPolarHBondContact O-CB 3.39Å; R14-S17 PolarHBondContact O-N 3.49Å; I15-S17 VanDerWaalsContact C-N 3.28Å; I15-S17 PolarHBondContact O-N 2.63Å; S17-T20 WeakPolarHBondContact O-CB 3.29Å; S17-T20 PolarHBondContact O-N 3.06Å; S17-W21 PolarHBondContact O-N 3.33Å
18F95.8Very high95.7Very high15 Ų1564 Ų647%0.06633%0.329CS..Hα-helixtrans-60.2-48176.3-179.8-88000110.9R14 I15 T20 W21 N22 M102 L105 K106 L109 L119R14-F18 WeakPolarHBondContact O-CB 3.26Å; R14-F18 PolarHBondContact O-N 3.11Å; I15-F18 WeakPolarHBondContact O-CB 3.11Å; I15-F18 PolarHBondContact O-N 2.58Å; F18-T20 VanDerWaalsContact C-N 3.26Å; F18-T20 PolarHBondContact O-N 2.91Å; F18-W21 PolarHBondContact O-N 3.05Å; F18-N22 WeakPolarHBondContact O-CB 3.24Å; F18-N22 PolarHBondContact O-N 3.33Å; F18-M102 HydrophobicContact CD2-CB 4.32Å; F18-M102 HydrophobicContact CD2-CG 4.35Å; F18-M102 HydrophobicContact CE2-CB 3.92Å; F18-M102 HydrophobicContact CE2-CG 4.14Å; F18-L105 HydrophobicContact CB-CB 4.32Å; F18-L105 HydrophobicContact CB-CD1 4.18Å; F18-L105 HydrophobicContact CD2-CB 4.07Å; F18-K106 HydrophobicContact CE2-CB 4.07Å; F18-L109 HydrophobicContact CB-CD1 4.34Å; F18-L119 HydrophobicContact CD1-CD2 3.8Å; F18-L119 HydrophobicContact CE1-CB 3.87Å; F18-L119 HydrophobicContact CE1-CD2 3.97Å; F18-L119 HydrophobicContact CE1-CG 4.44Å; F18-L119 HydrophobicContact CE2-CB 4.4Å; F18-L119 HydrophobicContact CG-CD2 4.28Å; F18-L119 HydrophobicContact CZ-CB 3.82Å; F18-L119 VanDerWaalsContact CZ-O 3.28Å; F18-L119 WeakPolarHBondContact CZ-O 3.33Å
19A94.7Very high95.9Very high55 Ų5563.4 Ų63.446%0.45533%0.325SS..Hα-helixtrans-58.2-39.7176.100000112.2I15 N16 N22 L23I15-A19 PolarHBondContact O-N 2.9Å; N16-A19 PolarHBondContact O-N 3.41Å; A19-N22 PolarHBondContact O-N 3.03Å; A19-L23 PolarHBondContact O-N 3.42Å
20T96.3Very high96.2Very high73 Ų7359.5 Ų59.545%0.44831%0.313SS..Hα-helixtrans-66.2-45.4177.7-57.70000111.9N16 S17 F18 N22 L23 K24N16-T20 WeakPolarHBondContact O-CB 3.33Å; N16-T20 PolarHBondContact O-N 3.38Å; N16-T20 PolarHBondContact O-OG1 3.02Å; S17-T20 WeakPolarHBondContact O-CB 3.29Å; S17-T20 PolarHBondContact O-N 3.06Å; F18-T20 VanDerWaalsContact C-N 3.26Å; F18-T20 PolarHBondContact O-N 2.91Å; T20-N22 VanDerWaalsContact C-N 3.33Å; T20-L23 PolarHBondContact O-N 3.29Å; T20-K24 WeakPolarHBondContact O-CG 3.26Å; T20-K24 PolarHBondContact O-N 3.06Å; T20-K24 VanDerWaalsContact O-N 3.1Å
21W97.3Very high96.4Very high62 Ų6260.9 Ų60.924%0.23531%0.313CS..Hα-helixtrans-66-37176.6-74.3115.5000112.2S17 F18 K24 F25 C98 H101 M102S17-W21 PolarHBondContact O-N 3.33Å; F18-W21 PolarHBondContact O-N 3.05Å; W21-K24 HydrophobicContact CE3-CD 3.97Å; W21-K24 HydrophobicContact CZ3-CD 4.13Å; W21-K24 PolarHBondContact O-N 3.24Å; W21-F25 WeakPolarHBondContact O-CB 3.28Å; W21-F25 PolarHBondContact O-N 2.96Å; W21-C98 HydrophobicContact CE3-CB 4.33Å; W21-H101 HydrophobicContact CD2-CB 3.82Å; W21-H101 AromaticContact CE2-CD2 3.93Å; W21-H101 AromaticContact CE2-CG 3.74Å; W21-H101 HydrophobicContact CE3-CB 4.4Å; W21-H101 HydrophobicContact CG-CB 3.97Å; W21-H101 AromaticContact CH2-CD2 3.52Å; W21-H101 AromaticContact CH2-NE2 3.91Å; W21-H101 HydrophobicContact CZ2-CB 4.23Å; W21-H101 AromaticContact CZ2-CD2 3.51Å; W21-H101 AromaticContact CZ2-CG 3.73Å; W21-H101 AromaticContact CZ2-NE2 3.85Å; W21-H101 AromaticContact CZ3-CD2 3.98Å; W21-M102 HydrophobicContact CB-CG 3.69Å; W21-M102 HydrophobicContact CB-SD 4.35Å
22N95.7Very high96.7Very high28 Ų2863.2 Ų63.215%0.1532%0.322CS..Hα-helixtrans-63.7-42.2175.8-166.450.6000112F18 A19 T20 F25 K26 M102 E121F18-N22 WeakPolarHBondContact O-CB 3.24Å; F18-N22 PolarHBondContact O-N 3.33Å; A19-N22 PolarHBondContact O-N 3.03Å; T20-N22 VanDerWaalsContact C-N 3.33Å; N22-F25 WeakPolarHBondContact O-CB 3.37Å; N22-F25 PolarHBondContact O-N 3.36Å; N22-K26 WeakPolarHBondContact O-CG 3.41Å; N22-K26 PolarHBondContact O-N 3.35Å; N22-M102 HydrophobicContact CB-SD 4.39Å; N22-E121 PolarHBondContact OD1-OE1 2.76Å
23L96.3Very high96.9Very high104 Ų10463.3 Ų63.355%0.54533%0.325SS..Hα-helixtrans-61.1-48.5174.7-179.261.3000111.2A19 T20 F25 K26 D27A19-L23 PolarHBondContact O-N 3.42Å; T20-L23 PolarHBondContact O-N 3.29Å; L23-F25 VanDerWaalsContact C-N 3.3Å; L23-F25 PolarHBondContact O-N 2.89Å; L23-K26 PolarHBondContact O-N 3.01Å; L23-D27 PolarHBondContact O-N 2.78Å
24K97.9Very high97Very high76 Ų7663.8 Ų63.833%0.3333%0.327SS..Hα-helixtrans-58.2-42.6175.7-72.7177.7177.7-1780112.3T20 W21 K26 D27 Y28T20-K24 WeakPolarHBondContact O-CG 3.26Å; T20-K24 PolarHBondContact O-N 3.06Å; T20-K24 VanDerWaalsContact O-N 3.1Å; W21-K24 HydrophobicContact CE3-CD 3.97Å; W21-K24 HydrophobicContact CZ3-CD 4.13Å; W21-K24 PolarHBondContact O-N 3.24Å; K24-K26 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 3.41Å; K24-D27 PolarHBondContact O-N 3.24Å; K24-Y28 HydrophobicContact CB-CD2 4.29Å; K24-Y28 HydrophobicContact CB-CE2 3.84Å; K24-Y28 HydrophobicContact CG-CE2 4.48Å; K24-Y28 WeakPolarHBondContact O-CB 3.2Å; K24-Y28 WeakPolarHBondContact O-CD2 3.5Å; K24-Y28 PolarHBondContact O-N 3.32Å
25F97.9Very high97.2Very high26 Ų2661.5 Ų61.511%0.11432%0.32CS..Hα-helixtrans-58.2-46.1176.8171.3-105.8000111.7W21 N22 L23 T29 I95 C98 K99 M102W21-F25 WeakPolarHBondContact O-CB 3.28Å; W21-F25 PolarHBondContact O-N 2.96Å; N22-F25 WeakPolarHBondContact O-CB 3.37Å; N22-F25 PolarHBondContact O-N 3.36Å; L23-F25 VanDerWaalsContact C-N 3.3Å; L23-F25 PolarHBondContact O-N 2.89Å; F25-T29 VanDerWaalsContact O-CB 3.29Å; F25-T29 WeakPolarHBondContact O-CB 3.26Å; F25-T29 PolarHBondContact O-N 2.78Å; F25-T29 PolarHBondContact O-OG1 2.86Å; F25-I95 HydrophobicContact CD2-CG2 4.14Å; F25-I95 HydrophobicContact CE2-CG2 3.8Å; F25-C98 HydrophobicContact CB-CB 3.87Å; F25-C98 HydrophobicContact CD2-CB 4.31Å; F25-K99 HydrophobicContact CD2-CG 4.26Å; F25-K99 HydrophobicContact CE2-CD 4.37Å; F25-K99 VanDerWaalsContact CE2-CE 3.45Å; F25-K99 HydrophobicContact CE2-CG 3.98Å; F25-M102 HydrophobicContact CB-SD 3.81Å; F25-M102 HydrophobicContact CD1-CE 4.34Å; F25-M102 HydrophobicContact CG-CE 4.36Å; F25-M102 HydrophobicContact CG-SD 4.18Å
26K97.1Very high97.3Very high88 Ų8865.6 Ų65.638%0.38334%0.336SS..Hα-helixtrans-64-44.7176.9-70.6-176.7178.9-161.90111.9N22 L23 K24 T29 S30 E121N22-K26 WeakPolarHBondContact O-CG 3.41Å; N22-K26 PolarHBondContact O-N 3.35Å; L23-K26 PolarHBondContact O-N 3.01Å; K24-K26 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 3.41Å; K26-T29 PolarHBondContact O-N 3.37Å; K26-S30 VanDerWaalsContact O-CB 3.31Å; K26-S30 WeakPolarHBondContact O-CB 3.3Å; K26-S30 PolarHBondContact O-N 3.05Å; K26-E121 WeakPolarHBondContact CE-OE1 3.38Å
27D98.1Very high97.5Very high90 Ų9068.3 Ų68.348%0.48134%0.344SS..Hα-helixtrans-61.7-48.6178.5-69.2-17.7000111.4L23 K24 S30 E31L23-D27 PolarHBondContact O-N 2.78Å; K24-D27 PolarHBondContact O-N 3.24Å; D27-S30 PolarHBondContact O-N 3.18Å; D27-E31 WeakPolarHBondContact O-CB 3.49Å; D27-E31 PolarHBondContact O-N 2.83Å
28Y98.5Very high97.6Very high49 Ų4969.6 Ų69.619%0.19234%0.344CS..Hα-helixtrans-67-38179.5-61.7-32.7000112.6K24 E31 Y32 L91 R94K24-Y28 HydrophobicContact CB-CD2 4.29Å; K24-Y28 HydrophobicContact CB-CE2 3.84Å; K24-Y28 HydrophobicContact CG-CE2 4.48Å; K24-Y28 WeakPolarHBondContact O-CB 3.2Å; K24-Y28 WeakPolarHBondContact O-CD2 3.5Å; K24-Y28 PolarHBondContact O-N 3.32Å; Y28-E31 PolarHBondContact O-N 3.33Å; Y28-Y32 WeakPolarHBondContact O-CB 3.49Å; Y28-Y32 PolarHBondContact O-N 3.13Å; Y28-L91 HydrophobicContact CD1-CD2 3.97Å; Y28-L91 HydrophobicContact CG-CD2 4.3Å; Y28-R94 HydrophobicContact CD2-CB 3.68Å; Y28-R94 HydrophobicContact CE2-CB 3.81Å; Y28-R94 HydrophobicContact CE2-CG 4.41Å; Y28-R94 HydrophobicContact CG-CB 4.22Å
29T98.1Very high97.7Very high41 Ų4170.3 Ų70.325%0.25235%0.348SS..Hα-helixtrans-65.4-43.9175.8-570000111F25 K26 E31 Y32 D33F25-T29 VanDerWaalsContact O-CB 3.29Å; F25-T29 WeakPolarHBondContact O-CB 3.26Å; F25-T29 PolarHBondContact O-N 2.78Å; F25-T29 PolarHBondContact O-OG1 2.86Å; K26-T29 PolarHBondContact O-N 3.37Å; T29-E31 PolarHBondContact O-N 3.28Å; T29-Y32 PolarHBondContact O-N 2.99Å; T29-D33 PolarHBondContact O-N 2.95Å
30S98.3Very high97.9Very high59 Ų5969.7 Ų69.741%0.41334%0.344SS..Hα-helixtrans-61-44.2175.3179.90000112K26 D27 D33 Q34K26-S30 VanDerWaalsContact O-CB 3.31Å; K26-S30 WeakPolarHBondContact O-CB 3.3Å; K26-S30 PolarHBondContact O-N 3.05Å; D27-S30 PolarHBondContact O-N 3.18Å; S30-D33 PolarHBondContact O-N 3.38Å; S30-Q34 WeakPolarHBondContact O-CG 3.43Å; S30-Q34 PolarHBondContact O-N 2.84Å; S30-Q34 PolarHBondContact OG-NE2 3.35Å
31E98.5Very high98Very high55 Ų5571.2 Ų71.226%0.25735%0.349SS..Hα-helixtrans-64.2-41.4176-168.2-172.716000111.5D27 Y28 T29 D33 Q34 K35 R87 L91D27-E31 WeakPolarHBondContact O-CB 3.49Å; D27-E31 PolarHBondContact O-N 2.83Å; Y28-E31 PolarHBondContact O-N 3.33Å; T29-E31 PolarHBondContact O-N 3.28Å; E31-D33 VanDerWaalsContact C-N 3.34Å; E31-D33 PolarHBondContact O-N 3.38Å; E31-Q34 WeakPolarHBondContact O-CB 3.35Å; E31-Q34 PolarHBondContact O-N 2.73Å; E31-K35 WeakPolarHBondContact O-CG 3.47Å; E31-K35 PolarHBondContact O-N 2.96Å; E31-R87 IonicContact OE1-CZ 2.94Å; E31-R87 VanDerWaalsContact OE1-CZ 3.22Å; E31-R87 IonicContact OE1-NE 2.77Å; E31-R87 PolarHBondContact OE1-NE 2.88Å; E31-R87 IonicContact OE1-NH2 3.78Å; E31-R87 PolarHBondContact OE1-NH2 3.47Å; E31-R87 IonicContact OE2-CZ 3.98Å; E31-R87 IonicContact OE2-NE 3.5Å; E31-R87 IonicContact OE2-NH2 2.78Å; E31-R87 PolarHBondContact OE2-NH2 3.24Å; E31-L91 HydrophobicContact CB-CD1 4.13Å; E31-L91 HydrophobicContact CB-CD2 4.25Å; E31-L91 HydrophobicContact CG-CD1 3.82Å; E31-L91 HydrophobicContact CG-CD2 4.38Å
32Y98.6Very high98Very high52 Ų5269.6 Ų69.620%0.20435%0.345CS..Hα-helixtrans-60.3-43.9176.9-179.3-90.9000111.6Y28 T29 Q34 K35 K36 M88 L91 E92 I95Y28-Y32 WeakPolarHBondContact O-CB 3.49Å; Y28-Y32 PolarHBondContact O-N 3.13Å; T29-Y32 PolarHBondContact O-N 2.99Å; Y32-Q34 VanDerWaalsContact C-N 3.32Å; Y32-Q34 PolarHBondContact O-N 3.39Å; Y32-K35 PolarHBondContact O-N 3.37Å; Y32-K36 PolarHBondContact O-N 3.44Å; Y32-M88 HydrophobicContact CD2-CB 4.26Å; Y32-M88 HydrophobicContact CD2-CE 4.37Å; Y32-M88 HydrophobicContact CD2-CG 4.38Å; Y32-M88 HydrophobicContact CE1-CE 4.34Å; Y32-M88 HydrophobicContact CE2-CB 3.95Å; Y32-M88 HydrophobicContact CE2-CE 3.68Å; Y32-M88 HydrophobicContact CE2-CG 4.28Å; Y32-L91 HydrophobicContact CD2-CB 4.11Å; Y32-E92 HydrophobicContact CD2-CG 4.04Å; Y32-E92 HydrophobicContact CE2-CG 3.42Å; Y32-E92 VanDerWaalsContact CE2-CG 3.42Å; Y32-E92 VanDerWaalsContact CE2-OE1 3.23Å; Y32-E92 WeakPolarHBondContact CE2-OE1 3.3Å; Y32-E92 VanDerWaalsContact CZ-OE1 3.26Å; Y32-E92 PolarHBondContact OH-OE1 3.48Å; Y32-I95 HydrophobicContact CG-CD1 4.33Å
33D98.4Very high98.1Very high82 Ų8271.1 Ų71.144%0.43935%0.353SS..Hα-helixtrans-64.7-36176.4-74.7-27.4000112.5T29 S30 E31 K36 K37T29-D33 PolarHBondContact O-N 2.95Å; S30-D33 PolarHBondContact O-N 3.38Å; E31-D33 VanDerWaalsContact C-N 3.34Å; E31-D33 PolarHBondContact O-N 3.38Å; D33-K36 PolarHBondContact O-N 2.93Å; D33-K37 WeakPolarHBondContact O-CG 3.3Å; D33-K37 PolarHBondContact O-N 3.35Å
34Q98.5Very high98.2Very high114 Ų11470.6 Ų70.653%0.53335%0.351SS..Hα-helixtrans-65.2-44.1172.5-70.2170.836.500111.3S30 E31 Y32 K36 K37 E38S30-Q34 WeakPolarHBondContact O-CG 3.43Å; S30-Q34 PolarHBondContact O-N 2.84Å; S30-Q34 PolarHBondContact OG-NE2 3.35Å; E31-Q34 WeakPolarHBondContact O-CB 3.35Å; E31-Q34 PolarHBondContact O-N 2.73Å; Y32-Q34 VanDerWaalsContact C-N 3.32Å; Y32-Q34 PolarHBondContact O-N 3.39Å; Q34-K36 VanDerWaalsContact C-N 3.29Å; Q34-K36 PolarHBondContact O-N 3.19Å; Q34-K37 WeakPolarHBondContact O-CB 3.38Å; Q34-K37 PolarHBondContact O-N 2.95Å; Q34-K37 VanDerWaalsContact O-N 3.14Å; Q34-E38 PolarHBondContact O-N 3.15Å
35K98.4Very high98.1Very high44 Ų4469 Ų6919%0.19135%0.351CS..Hα-helixtrans-63.8-35177.2-69.7-71160.2-158.90112.4E31 Y32 K37 E38 L39 V84 R87 M88 L91E31-K35 WeakPolarHBondContact O-CG 3.47Å; E31-K35 PolarHBondContact O-N 2.96Å; Y32-K35 PolarHBondContact O-N 3.37Å; K35-K37 VanDerWaalsContact C-N 3.34Å; K35-K37 PolarHBondContact O-N 3.41Å; K35-E38 WeakPolarHBondContact CD-OE2 3.48Å; K35-E38 WeakPolarHBondContact CE-OE2 3.33Å; K35-E38 IonicContact NZ-OE1 2.65Å; K35-E38 IonicContact NZ-OE2 3.59Å; K35-E38 PolarHBondContact NZ-OE2 3.06Å; K35-E38 PolarHBondContact O-N 3.43Å; K35-L39 WeakPolarHBondContact O-CB 3.35Å; K35-L39 PolarHBondContact O-N 2.74Å; K35-V84 HydrophobicContact CB-CG1 4.18Å; K35-V84 HydrophobicContact CD-CG1 4.11Å; K35-V84 WeakPolarHBondContact O-CG1 3.46Å; K35-R87 HydrophobicContact CD-CG 4.17Å; K35-R87 HydrophobicContact CG-CG 4.31Å; K35-M88 HydrophobicContact CB-CG 3.6Å; K35-M88 HydrophobicContact CB-SD 4.18Å; K35-M88 HydrophobicContact CG-CG 4.48Å; K35-L91 HydrophobicContact CG-CD1 4.12Å
36K98.3Very high98Very high128 Ų12871.1 Ų71.156%0.55736%0.361SS*.Hα-helixtrans-62-40.9173-169.3178.1-177.7178.10112.3Y32 D33 Q34 A40 M88Y32-K36 PolarHBondContact O-N 3.44Å; D33-K36 PolarHBondContact O-N 2.93Å; Q34-K36 VanDerWaalsContact C-N 3.29Å; Q34-K36 PolarHBondContact O-N 3.19Å; K36-A40 PolarHBondContact O-N 2.91Å; K36-A40 VanDerWaalsContact O-N 3.12Å; K36-M88 HydrophobicContact CB-CE 4.22Å
37K98.5Very high98Very high144 Ų14471.8 Ų71.863%0.62637%0.369SS*.Hα-helixtrans-68-42.6174.6-66.9173.3-175176.20111.7D33 Q34 K35 L39 A40 N41D33-K37 WeakPolarHBondContact O-CG 3.3Å; D33-K37 PolarHBondContact O-N 3.35Å; Q34-K37 WeakPolarHBondContact O-CB 3.38Å; Q34-K37 PolarHBondContact O-N 2.95Å; Q34-K37 VanDerWaalsContact O-N 3.14Å; K35-K37 VanDerWaalsContact C-N 3.34Å; K35-K37 PolarHBondContact O-N 3.41Å; K37-L39 VanDerWaalsContact C-N 3.32Å; K37-L39 PolarHBondContact O-N 2.85Å; K37-A40 WeakPolarHBondContact O-CB 3.16Å; K37-A40 PolarHBondContact O-N 3.21Å; K37-N41 VanDerWaalsContact O-CG 3.25Å; K37-N41 PolarHBondContact O-N 2.92Å; K37-N41 PolarHBondContact O-OD1 3.18Å
38E98.4Very high97.9Very high76 Ų7673.8 Ų73.836%0.35538%0.376SS..Hα-helixtrans-59.2-44.3175.7-172.5179.4166.200111.4Q34 K35 A40 N41 L42 V84Q34-E38 PolarHBondContact O-N 3.15Å; K35-E38 WeakPolarHBondContact CD-OE2 3.48Å; K35-E38 WeakPolarHBondContact CE-OE2 3.33Å; K35-E38 IonicContact NZ-OE1 2.65Å; K35-E38 IonicContact NZ-OE2 3.59Å; K35-E38 PolarHBondContact NZ-OE2 3.06Å; K35-E38 PolarHBondContact O-N 3.43Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 2.87Å; E38-N41 PolarHBondContact O-N 3.47Å; E38-L42 HydrophobicContact CG-CD1 4.41Å; E38-L42 WeakPolarHBondContact O-CG 3.25Å; E38-L42 PolarHBondContact O-N 3.03Å; E38-V84 HydrophobicContact CG-CG2 3.96Å; E38-V84 VanDerWaalsContact OE1-CG2 3.31Å; E38-V84 WeakPolarHBondContact OE1-CG2 3.48Å
39L98.4Very high97.7Very high30 Ų3072.7 Ų72.716%0.15737%0.373CS..Hα-helixtrans-62.8-39.9176.1-175.961000112.3K35 K37 L42 N43 K81 V84 K85 M88K35-L39 WeakPolarHBondContact O-CB 3.35Å; K35-L39 PolarHBondContact O-N 2.74Å; K37-L39 VanDerWaalsContact C-N 3.32Å; K37-L39 PolarHBondContact O-N 2.85Å; L39-L42 PolarHBondContact O-N 3.36Å; L39-N43 VanDerWaalsContact O-CG 3.32Å; L39-N43 PolarHBondContact O-N 3.33Å; L39-N43 PolarHBondContact O-ND2 3.44Å; L39-K81 HydrophobicContact CD1-CB 4.2Å; L39-K81 HydrophobicContact CD1-CG 4.07Å; L39-V84 HydrophobicContact CB-CG1 3.94Å; L39-K85 HydrophobicContact CD1-CG 4.31Å; L39-K85 HydrophobicContact CD2-CG 4.29Å; L39-M88 HydrophobicContact CD2-SD 4.08Å
40A98.5Very high97.5Very high43 Ų4376.5 Ų76.536%0.35540%0.396SS..Hα-helixtrans-61.3-49.4174.700000111K36 K37 E38 L42 N43 D44K36-A40 PolarHBondContact O-N 2.91Å; K36-A40 VanDerWaalsContact O-N 3.12Å; K37-A40 WeakPolarHBondContact O-CB 3.16Å; K37-A40 PolarHBondContact O-N 3.21Å; E38-A40 VanDerWaalsContact C-N 3.34Å; E38-A40 PolarHBondContact O-N 2.87Å; A40-L42 VanDerWaalsContact C-N 3.27Å; A40-L42 PolarHBondContact O-N 3.33Å; A40-N43 WeakPolarHBondContact O-CA 3.47Å; A40-N43 WeakPolarHBondContact O-CB 3.44Å; A40-N43 PolarHBondContact O-N 2.94Å; A40-D44 PolarHBondContact O-N 3.44Å
41N98.3Very high97.3Very high105 Ų10578.9 Ų78.956%0.56141%0.408SS*.Hα-helixtrans-59.3-37.4177.6-64.6-12000112.6K37 E38 N43 D44 A45K37-N41 VanDerWaalsContact O-CG 3.25Å; K37-N41 PolarHBondContact O-N 2.92Å; K37-N41 PolarHBondContact O-OD1 3.18Å; E38-N41 PolarHBondContact O-N 3.47Å; N41-N43 VanDerWaalsContact C-N 3.34Å; N41-D44 PolarHBondContact O-N 2.97Å; N41-A45 WeakPolarHBondContact O-CB 3.4Å; N41-A45 PolarHBondContact O-N 2.94Å
42L98.2Very high97Very high27 Ų2778.6 Ų78.614%0.14141%0.41CS..Hα-helixtrans-68.5-32.9175.6-71.7170.2000112.3E38 L39 A40 E46 L77 A80 K81 V84E38-L42 HydrophobicContact CG-CD1 4.41Å; E38-L42 WeakPolarHBondContact O-CG 3.25Å; E38-L42 PolarHBondContact O-N 3.03Å; L39-L42 PolarHBondContact O-N 3.36Å; A40-L42 VanDerWaalsContact C-N 3.27Å; A40-L42 PolarHBondContact O-N 3.33Å; L42-E46 PolarHBondContact O-N 2.93Å; L42-E46 VanDerWaalsContact O-N 3.14Å; L42-L77 HydrophobicContact CD2-CD2 3.79Å; L42-A80 HydrophobicContact CD1-CB 3.98Å; L42-A80 HydrophobicContact CD2-CB 3.92Å; L42-K81 HydrophobicContact CB-CD 4.45Å; L42-K81 HydrophobicContact CB-CG 3.72Å; L42-K81 HydrophobicContact CD1-CG 4Å; L42-K81 HydrophobicContact CG-CG 4.44Å; L42-K81 WeakPolarHBondContact O-CE 3.43Å; L42-K81 PolarHBondContact O-NZ 3.37Å; L42-V84 HydrophobicContact CD1-CG2 3.94Å
43N98Very high96.7Very high61 Ų6185 Ų8533%0.32644%0.441SS..Hα-helixtrans-69.4-46.3173.1-67.9-33.7000110.8L39 A40 N41 A45 E46 D47 K81L39-N43 VanDerWaalsContact O-CG 3.32Å; L39-N43 PolarHBondContact O-N 3.33Å; L39-N43 PolarHBondContact O-ND2 3.44Å; A40-N43 WeakPolarHBondContact O-CA 3.47Å; A40-N43 WeakPolarHBondContact O-CB 3.44Å; A40-N43 PolarHBondContact O-N 2.94Å; N41-N43 VanDerWaalsContact C-N 3.34Å; N43-A45 VanDerWaalsContact C-N 3.27Å; N43-A45 PolarHBondContact O-N 3.1Å; N43-E46 WeakPolarHBondContact O-CB 3.46Å; N43-E46 PolarHBondContact O-N 3.41Å; N43-D47 PolarHBondContact O-N 3Å; N43-K81 VanDerWaalsContact OD1-CE 3.22Å; N43-K81 WeakPolarHBondContact OD1-CE 3.36Å; N43-K81 PolarHBondContact OD1-NZ 2.8Å
44D97.8Very high96.3Very high93 Ų9386.8 Ų86.850%0.49745%0.447SS..Hα-helixtrans-57.6-43175.9-60.3-15.9000110.5A40 N41 E46 D47 E48A40-D44 PolarHBondContact O-N 3.44Å; N41-D44 PolarHBondContact O-N 2.97Å; D44-E46 VanDerWaalsContact C-N 3.34Å; D44-E46 PolarHBondContact O-N 3.42Å; D44-D47 PolarHBondContact O-N 3.41Å; D44-E48 VanDerWaalsContact O-CG 3.3Å; D44-E48 WeakPolarHBondContact O-CG 3.29Å; D44-E48 PolarHBondContact O-N 3.11Å
45A95.9Very high96Very high41 Ų4185.2 Ų85.234%0.33945%0.449SS..Hα-helixtrans-64.1-35.1176.500000113.7N41 N43 L49 L77N41-A45 WeakPolarHBondContact O-CB 3.4Å; N41-A45 PolarHBondContact O-N 2.94Å; N43-A45 VanDerWaalsContact C-N 3.27Å; N43-A45 PolarHBondContact O-N 3.1Å; A45-L49 WeakPolarHBondContact O-CB 3.43Å; A45-L49 PolarHBondContact O-N 3.2Å; A45-L49 VanDerWaalsContact O-N 3.08Å; A45-L77 HydrophobicContact CB-CD1 4.32Å; A45-L77 HydrophobicContact CB-CD2 3.95Å
46E96.2Very high95.8Very high71 Ų7187.8 Ų87.833%0.33246%0.464SS..Hα-helixtrans-68.9-40.7174.7-178.6179.4-89.700111.3L42 N43 D44 L49 L77 K81L42-E46 PolarHBondContact O-N 2.93Å; L42-E46 VanDerWaalsContact O-N 3.14Å; N43-E46 WeakPolarHBondContact O-CB 3.46Å; N43-E46 PolarHBondContact O-N 3.41Å; D44-E46 VanDerWaalsContact C-N 3.34Å; D44-E46 PolarHBondContact O-N 3.42Å; E46-L49 WeakPolarHBondContact O-CB 3.45Å; E46-L49 PolarHBondContact O-N 3.38Å; E46-L77 HydrophobicContact CB-CD1 4.18Å; E46-K81 VanDerWaalsContact CB-NZ 3.28Å; E46-K81 IonicContact OE1-NZ 3.07Å; E46-K81 PolarHBondContact OE1-NZ 3.32Å; E46-K81 IonicContact OE2-NZ 2.9Å; E46-K81 PolarHBondContact OE2-NZ 2.88Å
47D96.2Very high95.6Very high102 Ų10283.4 Ų83.455%0.54545%0.446SS..Hα-helixtrans-64.8-41.5176.1-71-22000111.2N43 D44 L49 V50N43-D47 PolarHBondContact O-N 3Å; D44-D47 PolarHBondContact O-N 3.41Å; D47-L49 VanDerWaalsContact C-N 3.34Å; D47-L49 PolarHBondContact O-N 3.42Å; D47-V50 WeakPolarHBondContact O-CB 3.31Å; D47-V50 PolarHBondContact O-N 2.95Å
48E95.4Very high95.5Very high133 Ų13380.8 Ų80.862%0.62144%0.443SS*.Hα-helixtrans-65-35.6176.3-70.9-62.7143.400112.5D44 V50 V51 V52D44-E48 VanDerWaalsContact O-CG 3.3Å; D44-E48 WeakPolarHBondContact O-CG 3.29Å; D44-E48 PolarHBondContact O-N 3.11Å; E48-V50 PolarHBondContact O-N 3.4Å; E48-V50 VanDerWaalsContact O-N 3.16Å; E48-V51 PolarHBondContact O-N 2.84Å; E48-V52 PolarHBondContact O-N 3.11Å
49L95.3Very high95.3Very high26 Ų2681.2 Ų81.214%0.13644%0.442CS..Hα-helixtrans-61.7-23.1176.7-171.965.9000112.9A45 E46 D47 V52 N70 V73 L77A45-L49 WeakPolarHBondContact O-CB 3.43Å; A45-L49 PolarHBondContact O-N 3.2Å; A45-L49 VanDerWaalsContact O-N 3.08Å; E46-L49 WeakPolarHBondContact O-CB 3.45Å; E46-L49 PolarHBondContact O-N 3.38Å; D47-L49 VanDerWaalsContact C-N 3.34Å; D47-L49 PolarHBondContact O-N 3.42Å; L49-V52 HydrophobicContact CD1-CG1 4.1Å; L49-V52 WeakPolarHBondContact O-CG1 3.45Å; L49-N70 HydrophobicContact CD1-CB 4.23Å; L49-V73 HydrophobicContact CD1-CB 4.14Å; L49-V73 HydrophobicContact CD1-CG1 3.96Å; L49-V73 HydrophobicContact CD2-CB 4.05Å; L49-V73 HydrophobicContact CD2-CG1 3.87Å; L49-L77 HydrophobicContact CD2-CD1 4.15Å
50V93.2Very high95.1Very high120 Ų12084.3 Ų84.373%0.72746%0.458SS*.Hα-helixtrans-75.7-27.9175.6178.80000111.8D47 E48D47-V50 WeakPolarHBondContact O-CB 3.31Å; D47-V50 PolarHBondContact O-N 2.95Å; E48-V50 PolarHBondContact O-N 3.4Å; E48-V50 VanDerWaalsContact O-N 3.16Å
51V93.8Very high94.8Very high110 Ų11086.8 Ų86.867%0.66746%0.464SS*.Hα-helixtrans-99.2-24.1-172.7-174.40000112.1E48E48-V51 PolarHBondContact O-N 2.84Å
52V93.1Very high94.6Very high48 Ų4885.1 Ų85.129%0.29147%0.473SS..  trans-62133.8-178.476.10000111.9E48 L49 E54E48-V52 PolarHBondContact O-N 3.11Å; L49-V52 HydrophobicContact CD1-CG1 4.1Å; L49-V52 WeakPolarHBondContact O-CG1 3.45Å; V52-E54 HydrophobicContact CG2-CB 4.16Å; V52-E54 WeakPolarHBondContact CG2-OE2 3.46Å
53E91.3Very high94.5Very high187 Ų18793 Ų9387%0.87451%0.508SS*.  trans-81.6-28.1179.4-65.5-173175.200111.5
54E91.5Very high94.4Very high120 Ų12093.9 Ų93.956%0.56152%0.516SS*.  trans-66.2130.4177.8-66.277.5-174.200111.4V52 H57 N70V52-E54 HydrophobicContact CG2-CB 4.16Å; V52-E54 WeakPolarHBondContact CG2-OE2 3.46Å; E54-H57 PolarHBondContact O-CE1 3.48Å; E54-H57 PolarHBondContact O-NE2 3.23Å; E54-N70 PolarHBondContact O-OD1 2.88Å; E54-N70 VanDerWaalsContact O-OD1 3.08Å
55S90.9Very high94.3Very high80 Ų8095.6 Ų95.656%0.55952%0.52SS*.SBendtrans-95.9-3.2179.969.60000113.9S69 N70S55-S69 WeakPolarHBondContact O-CA 3.15Å; S55-N70 WeakPolarHBondContact CA-OD1 3.47Å
56L94.8Very high94.2Very high98 Ų9898.6 Ų98.651%0.51353%0.525SS..EExtended strand (participates in β ladder)trans-138.2124.5-175.7-72.1178.8000110H67 L68L56-H67 HydrophobicContact CB-CB 4.25Å; L56-H67 HydrophobicContact CD2-CB 4.25Å; L56-L68 CarbonylContact C-O 3.49Å; L56-L68 WeakPolarHBondContact CA-O 3.44Å
57H94.4Very high94.2Very high37 Ų37101 Ų10117%0.17154%0.536CS..EExtended strand (participates in β ladder)trans-118.8130.3-172.9-58.7-76.5000110.6E54 Y59 H67 L68 N70 V73E54-H57 PolarHBondContact O-CE1 3.48Å; E54-H57 PolarHBondContact O-NE2 3.23Å; H57-Y59 PolarHBondContact O-N 3.44Å; H57-H67 CarbonylContact O-C 3.59Å; H57-H67 WeakPolarHBondContact O-CA 3.33Å; H57-L68 PolarHBondContact N-O 2.87Å; H57-L68 PolarHBondContact O-N 3.25Å; H57-N70 PolarHBondContact CD2-OD1 3.05Å; H57-N70 PolarHBondContact NE2-OD1 3.37Å; H57-V73 HydrophobicContact CB-CG2 3.79Å
58P95.6Very high94.1Very high88 Ų8897.2 Ų97.257%0.57152%0.516SS*.EExtended strand (participates in β ladder)trans-66.7126.5177.527.6-33.4000110.8F65 F66P58-F65 HydrophobicContact CB-CD1 3.96Å; P58-F66 CarbonylContact C-O 3.54Å; P58-F66 VanDerWaalsContact CA-O 3.29Å; P58-F66 WeakPolarHBondContact CA-O 3.45Å
59Y94.3Very high94.2Very high85 Ų8592.5 Ų92.533%0.33350%0.498SS..EExtended strand (participates in β ladder)trans-119.5121.6178.7-173.4-101000109.9H57 I61 F65 F66 L68 E76H57-Y59 PolarHBondContact O-N 3.44Å; Y59-I61 HydrophobicContact CD1-CD1 3.9Å; Y59-I61 HydrophobicContact CD1-CG1 3.62Å; Y59-I61 HydrophobicContact CE1-CD1 3.78Å; Y59-I61 HydrophobicContact CE1-CG1 3.52Å; Y59-F65 CarbonylContact O-C 3.58Å; Y59-F65 WeakPolarHBondContact O-CA 3.5Å; Y59-F66 PolarHBondContact N-O 3.4Å; Y59-F66 PolarHBondContact O-N 3.44Å; Y59-L68 HydrophobicContact CD1-CD1 4.12Å; Y59-L68 HydrophobicContact CD2-CD1 3.46Å; Y59-L68 VanDerWaalsContact CD2-CD1 3.46Å; Y59-L68 HydrophobicContact CD2-CG 4.38Å; Y59-L68 HydrophobicContact CE2-CD1 4Å; Y59-L68 HydrophobicContact CG-CD1 3.51Å; Y59-L68 HydrophobicContact CG-CG 3.99Å; Y59-E76 HydrophobicContact CE2-CG 4.34Å; Y59-E76 PolarHBondContact OH-OE2 2.99Å
60L94.7Very high94.2Very high95 Ų9593.4 Ų93.450%0.49750%0.503SS..EExtended strand (participates in β ladder)trans-91121.1-174.7-17960.8000111F65L60-F65 HydrophobicContact CB-CD1 3.98Å; L60-F65 HydrophobicContact CB-CE1 3.68Å; L60-F65 HydrophobicContact CB-CZ 4.31Å; L60-F65 HydrophobicContact CD1-CD1 4.21Å; L60-F65 HydrophobicContact CD1-CD2 4.25Å; L60-F65 HydrophobicContact CD1-CE1 3.99Å; L60-F65 HydrophobicContact CD1-CE2 4.01Å; L60-F65 HydrophobicContact CD1-CG 4.36Å; L60-F65 HydrophobicContact CD1-CZ 3.87Å; L60-F65 HydrophobicContact CD2-CE1 4.48Å; L60-F65 HydrophobicContact CD2-CZ 4.34Å; L60-F65 HydrophobicContact CG-CE1 4.25Å; L60-F65 HydrophobicContact CG-CZ 4.4Å
61I92.2Very high94.3Very high95 Ų9594 Ų9449%0.48750%0.501SS..EExtended strand (participates in β ladder)trans-120.2112.5170-56.5176.9000108.3Y59 E63 T64 F66Y59-I61 HydrophobicContact CD1-CD1 3.9Å; Y59-I61 HydrophobicContact CD1-CG1 3.62Å; Y59-I61 HydrophobicContact CE1-CD1 3.78Å; Y59-I61 HydrophobicContact CE1-CG1 3.52Å; I61-E63 PolarHBondContact O-N 2.89Å; I61-T64 PolarHBondContact N-O 2.98Å; I61-T64 PolarHBondContact O-N 3.21Å; I61-F66 HydrophobicContact CB-CD2 4.27Å; I61-F66 HydrophobicContact CB-CE2 4.06Å; I61-F66 HydrophobicContact CD1-CD2 3.82Å; I61-F66 HydrophobicContact CD1-CE2 4Å; I61-F66 HydrophobicContact CG1-CD2 4.09Å; I61-F66 HydrophobicContact CG1-CE2 4.31Å
62G95Very high94.4Very high71 Ų7192.9 Ų92.973%0.73249%0.489SS*.THydrogen-bonded Turntrans62.3-104-173.900000110.9
63E95.1Very high94.5Very high191 Ų19191.9 Ų91.989%0.89348%0.483SS*.THydrogen-bonded Turntrans-118.28.3179.8-58.6-175.8147.100112.7I61I61-E63 PolarHBondContact O-N 2.89Å
64T95.2Very high94.8Very high80 Ų8083.8 Ų83.849%0.49145%0.45SS..EExtended strand (participates in β ladder)trans-120.4138.7-175.3-57.50000111.6I61 F66I61-T64 PolarHBondContact N-O 2.98Å; I61-T64 PolarHBondContact O-N 3.21Å; T64-F66 HydrophobicContact CG2-CE2 3.92Å; T64-F66 HydrophobicContact CG2-CZ 3.96Å
65F95.6Very high95.1Very high130 Ų13084.7 Ų84.757%0.5745%0.454SS*.EExtended strand (participates in β ladder)trans-95.1134.5173.8-69.8-82.5000111.7P58 Y59 L60P58-F65 HydrophobicContact CB-CD1 3.96Å; Y59-F65 CarbonylContact O-C 3.58Å; Y59-F65 WeakPolarHBondContact O-CA 3.5Å; L60-F65 HydrophobicContact CB-CD1 3.98Å; L60-F65 HydrophobicContact CB-CE1 3.68Å; L60-F65 HydrophobicContact CB-CZ 4.31Å; L60-F65 HydrophobicContact CD1-CD1 4.21Å; L60-F65 HydrophobicContact CD1-CD2 4.25Å; L60-F65 HydrophobicContact CD1-CE1 3.99Å; L60-F65 HydrophobicContact CD1-CE2 4.01Å; L60-F65 HydrophobicContact CD1-CG 4.36Å; L60-F65 HydrophobicContact CD1-CZ 3.87Å; L60-F65 HydrophobicContact CD2-CE1 4.48Å; L60-F65 HydrophobicContact CD2-CZ 4.34Å; L60-F65 HydrophobicContact CG-CE1 4.25Å; L60-F65 HydrophobicContact CG-CZ 4.4Å
66F94Very high95.3Very high104 Ų10485 Ų8546%0.45645%0.447SS..EExtended strand (participates in β ladder)trans-111.5168166.1-61.2-87.3000108.9P58 Y59 I61 T64P58-F66 CarbonylContact C-O 3.54Å; P58-F66 VanDerWaalsContact CA-O 3.29Å; P58-F66 WeakPolarHBondContact CA-O 3.45Å; Y59-F66 PolarHBondContact N-O 3.4Å; Y59-F66 PolarHBondContact O-N 3.44Å; I61-F66 HydrophobicContact CB-CD2 4.27Å; I61-F66 HydrophobicContact CB-CE2 4.06Å; I61-F66 HydrophobicContact CD1-CD2 3.82Å; I61-F66 HydrophobicContact CD1-CE2 4Å; I61-F66 HydrophobicContact CG1-CD2 4.09Å; I61-F66 HydrophobicContact CG1-CE2 4.31Å; T64-F66 HydrophobicContact CG2-CE2 3.92Å; T64-F66 HydrophobicContact CG2-CZ 3.96Å
67H96.1Very high95.4Very high120 Ų12081.3 Ų81.356%0.55643%0.428SS*.EExtended strand (participates in β ladder)trans-112.3124.6172.7-67.182.3000108.5L56 H57L56-H67 HydrophobicContact CB-CB 4.25Å; L56-H67 HydrophobicContact CD2-CB 4.25Å; H57-H67 CarbonylContact O-C 3.59Å; H57-H67 WeakPolarHBondContact O-CA 3.33Å
68L96.1Very high95.6Very high24 Ų2482.6 Ų82.613%0.12644%0.44CS..EExtended strand (participates in β ladder)trans-100.4138.5172.2-63-174.5000109.1L56 H57 Y59 E72 V73 E76L56-L68 CarbonylContact C-O 3.49Å; L56-L68 WeakPolarHBondContact CA-O 3.44Å; H57-L68 PolarHBondContact N-O 2.87Å; H57-L68 PolarHBondContact O-N 3.25Å; Y59-L68 HydrophobicContact CD1-CD1 4.12Å; Y59-L68 HydrophobicContact CD2-CD1 3.46Å; Y59-L68 VanDerWaalsContact CD2-CD1 3.46Å; Y59-L68 HydrophobicContact CD2-CG 4.38Å; Y59-L68 HydrophobicContact CE2-CD1 4Å; Y59-L68 HydrophobicContact CG-CD1 3.51Å; Y59-L68 HydrophobicContact CG-CG 3.99Å; L68-E72 HydrophobicContact CB-CB 3.9Å; L68-E72 HydrophobicContact CD2-CB 4.12Å; L68-E72 HydrophobicContact CG-CB 4.38Å; L68-V73 HydrophobicContact CB-CG2 3.69Å; L68-V73 HydrophobicContact CD1-CG2 4.41Å; L68-E76 HydrophobicContact CD1-CG 4.04Å
69S96.6Very high95.7Very high34 Ų3481.2 Ų81.224%0.23844%0.436CS..EExtended strand (participates in β ladder)trans-67.6165.8167.5610000111.8S55 D71 E72 V73S55-S69 WeakPolarHBondContact O-CA 3.15Å; S69-D71 PolarHBondContact O-N 2.6Å; S69-E72 WeakPolarHBondContact CB-OE2 3.34Å; S69-E72 PolarHBondContact N-OE2 3.3Å; S69-E72 PolarHBondContact O-N 3.48Å; S69-E72 VanDerWaalsContact O-N 3.17Å; S69-E72 WeakPolarHBondContact OG-CG 3.13Å; S69-E72 PolarHBondContact OG-N 3.11Å; S69-E72 PolarHBondContact OG-OE2 2.92Å; S69-V73 WeakPolarHBondContact O-CG2 3.33Å; S69-V73 PolarHBondContact O-N 3.44Å
70N94.7Very high95.8Very high45 Ų4578.8 Ų78.824%0.24143%0.434CS..Hα-helixtrans-56.7-38.8176.4-66.58.1000111.9L49 E54 S55 H57 V73 G74L49-N70 HydrophobicContact CD1-CB 4.23Å; E54-N70 PolarHBondContact O-OD1 2.88Å; E54-N70 VanDerWaalsContact O-OD1 3.08Å; S55-N70 WeakPolarHBondContact CA-OD1 3.47Å; H57-N70 PolarHBondContact CD2-OD1 3.05Å; H57-N70 PolarHBondContact NE2-OD1 3.37Å; N70-V73 PolarHBondContact O-N 3.38Å; N70-G74 PolarHBondContact O-N 3.04Å
71D95Very high96Very high131 Ų13174.7 Ų74.770%0.70141%0.412SS*.Hα-helixtrans-63.8-46.9177.9-66.7-15.6000110.9S69 V73 G74 E75S69-D71 PolarHBondContact O-N 2.6Å; D71-V73 PolarHBondContact O-N 3.28Å; D71-G74 PolarHBondContact O-N 3.42Å; D71-G74 VanDerWaalsContact O-N 3.17Å; D71-E75 WeakPolarHBondContact O-CG 3.42Å; D71-E75 PolarHBondContact O-N 3.47Å
72E96.4Very high96.3Very high87 Ų8775 Ų7541%0.40741%0.412SS..Hα-helixtrans-63.8-39.6177.5-71.1166.3124.700112.2L68 S69 G74 E75 E76L68-E72 HydrophobicContact CB-CB 3.9Å; L68-E72 HydrophobicContact CD2-CB 4.12Å; L68-E72 HydrophobicContact CG-CB 4.38Å; S69-E72 WeakPolarHBondContact CB-OE2 3.34Å; S69-E72 PolarHBondContact N-OE2 3.3Å; S69-E72 PolarHBondContact O-N 3.48Å; S69-E72 VanDerWaalsContact O-N 3.17Å; S69-E72 WeakPolarHBondContact OG-CG 3.13Å; S69-E72 PolarHBondContact OG-N 3.11Å; S69-E72 PolarHBondContact OG-OE2 2.92Å; E72-G74 VanDerWaalsContact C-N 3.33Å; E72-E75 PolarHBondContact O-N 2.9Å; E72-E76 WeakPolarHBondContact O-CG 3.47Å; E72-E76 PolarHBondContact O-N 2.95Å
73V96.4Very high96.5Very high27 Ų2779.2 Ų79.216%0.16441%0.41CS..Hα-helixtrans-64.1-41.1173.7177.60000110.7L49 H57 L68 S69 N70 D71 E75 E76 L77L49-V73 HydrophobicContact CD1-CB 4.14Å; L49-V73 HydrophobicContact CD1-CG1 3.96Å; L49-V73 HydrophobicContact CD2-CB 4.05Å; L49-V73 HydrophobicContact CD2-CG1 3.87Å; H57-V73 HydrophobicContact CB-CG2 3.79Å; L68-V73 HydrophobicContact CB-CG2 3.69Å; L68-V73 HydrophobicContact CD1-CG2 4.41Å; S69-V73 WeakPolarHBondContact O-CG2 3.33Å; S69-V73 PolarHBondContact O-N 3.44Å; N70-V73 PolarHBondContact O-N 3.38Å; D71-V73 PolarHBondContact O-N 3.28Å; V73-E75 VanDerWaalsContact C-N 3.33Å; V73-E75 PolarHBondContact O-N 3.28Å; V73-E76 PolarHBondContact O-N 2.92Å; V73-L77 HydrophobicContact CG1-CD1 4.05Å; V73-L77 HydrophobicContact CG1-CG 4.24Å; V73-L77 WeakPolarHBondContact O-CB 3.46Å; V73-L77 VanDerWaalsContact O-CG 3.29Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 2.9Å
74G96.4Very high96.6Very high18 Ų1870.3 Ų70.319%0.18637%0.368CS..Hα-helixtrans-61.7-39.8176.200000112.7N70 D71 E72 S78N70-G74 PolarHBondContact O-N 3.04Å; D71-G74 PolarHBondContact O-N 3.42Å; D71-G74 VanDerWaalsContact O-N 3.17Å; E72-G74 VanDerWaalsContact C-N 3.33Å; G74-S78 WeakPolarHBondContact O-CB 3.23Å; G74-S78 PolarHBondContact O-N 3.47Å; G74-S78 PolarHBondContact O-OG 3.46Å
75E97.1Very high96.8Very high139 Ų13971.2 Ų71.265%0.6537%0.365SS*.Hα-helixtrans-63.9-46173.4-71.8-177.3-178.800111.8D71 E72 V73 S78 A79D71-E75 WeakPolarHBondContact O-CG 3.42Å; D71-E75 PolarHBondContact O-N 3.47Å; E72-E75 PolarHBondContact O-N 2.9Å; V73-E75 VanDerWaalsContact C-N 3.33Å; V73-E75 PolarHBondContact O-N 3.28Å; E75-S78 WeakPolarHBondContact O-CB 3.41Å; E75-S78 PolarHBondContact O-N 2.99Å; E75-A79 WeakPolarHBondContact O-CB 3.33Å; E75-A79 PolarHBondContact O-N 3.22Å
76E96.1Very high96.9Very high86 Ų8670 Ų7040%0.40237%0.365SS..Hα-helixtrans-62.1-43.7177-75.4-67.7121.300112.1Y59 L68 E72 V73 A79 A80Y59-E76 HydrophobicContact CE2-CG 4.34Å; Y59-E76 PolarHBondContact OH-OE2 2.99Å; L68-E76 HydrophobicContact CD1-CG 4.04Å; E72-E76 WeakPolarHBondContact O-CG 3.47Å; E72-E76 PolarHBondContact O-N 2.95Å; V73-E76 PolarHBondContact O-N 2.92Å; E76-A79 PolarHBondContact O-N 3.46Å; E76-A80 VanDerWaalsContact O-CB 3.3Å; E76-A80 WeakPolarHBondContact O-CB 3.44Å; E76-A80 PolarHBondContact O-N 2.87Å
77L97.2Very high97.1Very high21 Ų2168.1 Ų68.111%0.1135%0.354CS..Hα-helixtrans-62.1-43.9175.2-72.9175.7000111.2L42 A45 E46 L49 V73 A80 K81L42-L77 HydrophobicContact CD2-CD2 3.79Å; A45-L77 HydrophobicContact CB-CD1 4.32Å; A45-L77 HydrophobicContact CB-CD2 3.95Å; E46-L77 HydrophobicContact CB-CD1 4.18Å; L49-L77 HydrophobicContact CD2-CD1 4.15Å; V73-L77 HydrophobicContact CG1-CD1 4.05Å; V73-L77 HydrophobicContact CG1-CG 4.24Å; V73-L77 WeakPolarHBondContact O-CB 3.46Å; V73-L77 VanDerWaalsContact O-CG 3.29Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 2.9Å; L77-A80 PolarHBondContact O-N 3.14Å; L77-K81 WeakPolarHBondContact O-CB 3.45Å; L77-K81 VanDerWaalsContact O-CG 3.26Å; L77-K81 WeakPolarHBondContact O-CG 3.27Å; L77-K81 PolarHBondContact O-N 3.48Å
78S97.5Very high97.3Very high63 Ų6363.3 Ų63.344%0.44133%0.332SS..Hα-helixtrans-61.3-46.1177.3-65.20000111.6G74 E75 K81 E82G74-S78 WeakPolarHBondContact O-CB 3.23Å; G74-S78 PolarHBondContact O-N 3.47Å; G74-S78 PolarHBondContact O-OG 3.46Å; E75-S78 WeakPolarHBondContact O-CB 3.41Å; E75-S78 PolarHBondContact O-N 2.99Å; S78-K81 PolarHBondContact O-N 3.27Å; S78-E82 PolarHBondContact O-N 3.12Å
79A97.9Very high97.4Very high59 Ų5966.5 Ų66.549%0.48835%0.352SS..Hα-helixtrans-63.4-41.8176.900000112E75 E76 E82 K83E75-A79 WeakPolarHBondContact O-CB 3.33Å; E75-A79 PolarHBondContact O-N 3.22Å; E76-A79 PolarHBondContact O-N 3.46Å; A79-E82 PolarHBondContact O-N 2.88Å; A79-K83 PolarHBondContact O-N 3.19Å
80A97.8Very high97.5Very high34 Ų3467 Ų6728%0.28135%0.353SS..Hα-helixtrans-62.9-45.7176.200000111.6L42 E76 L77 E82 K83 V84L42-A80 HydrophobicContact CD1-CB 3.98Å; L42-A80 HydrophobicContact CD2-CB 3.92Å; E76-A80 VanDerWaalsContact O-CB 3.3Å; E76-A80 WeakPolarHBondContact O-CB 3.44Å; E76-A80 PolarHBondContact O-N 2.87Å; L77-A80 PolarHBondContact O-N 3.14Å; A80-E82 VanDerWaalsContact C-N 3.33Å; A80-E82 PolarHBondContact O-N 2.71Å; A80-K83 PolarHBondContact O-N 2.77Å; A80-V84 WeakPolarHBondContact O-CG2 3.48Å; A80-V84 PolarHBondContact O-N 3.39Å
81K98.4Very high97.7Very high10 Ų1064.9 Ų64.94%0.04334%0.341CS..Hα-helixtrans-58.7-44.6176.4-74176.3-174.2-169.80111.6L39 L42 N43 E46 L77 S78 V84 K85L39-K81 HydrophobicContact CD1-CB 4.2Å; L39-K81 HydrophobicContact CD1-CG 4.07Å; L42-K81 HydrophobicContact CB-CD 4.45Å; L42-K81 HydrophobicContact CB-CG 3.72Å; L42-K81 HydrophobicContact CD1-CG 4Å; L42-K81 HydrophobicContact CG-CG 4.44Å; L42-K81 WeakPolarHBondContact O-CE 3.43Å; L42-K81 PolarHBondContact O-NZ 3.37Å; N43-K81 VanDerWaalsContact OD1-CE 3.22Å; N43-K81 WeakPolarHBondContact OD1-CE 3.36Å; N43-K81 PolarHBondContact OD1-NZ 2.8Å; E46-K81 VanDerWaalsContact CB-NZ 3.28Å; E46-K81 IonicContact OE1-NZ 3.07Å; E46-K81 PolarHBondContact OE1-NZ 3.32Å; E46-K81 IonicContact OE2-NZ 2.9Å; E46-K81 PolarHBondContact OE2-NZ 2.88Å; L77-K81 WeakPolarHBondContact O-CB 3.45Å; L77-K81 VanDerWaalsContact O-CG 3.26Å; L77-K81 WeakPolarHBondContact O-CG 3.27Å; L77-K81 PolarHBondContact O-N 3.48Å; S78-K81 PolarHBondContact O-N 3.27Å; K81-V84 PolarHBondContact O-N 3.41Å; K81-K85 WeakPolarHBondContact O-CB 3.45Å; K81-K85 VanDerWaalsContact O-CG 3.29Å; K81-K85 WeakPolarHBondContact O-CG 3.45Å; K81-K85 PolarHBondContact O-N 2.92Å
82E98.4Very high97.8Very high101 Ų10163.1 Ų63.147%0.47233%0.329SS..Hα-helixtrans-63-45178.9-173.858.2-161.500111.4S78 A79 A80 V84 K85 L86S78-E82 PolarHBondContact O-N 3.12Å; A79-E82 PolarHBondContact O-N 2.88Å; A80-E82 VanDerWaalsContact C-N 3.33Å; A80-E82 PolarHBondContact O-N 2.71Å; E82-V84 VanDerWaalsContact C-N 3.31Å; E82-V84 PolarHBondContact O-N 2.94Å; E82-K85 PolarHBondContact O-N 2.94Å; E82-L86 HydrophobicContact CG-CD1 4.26Å; E82-L86 WeakPolarHBondContact O-CG 3.43Å; E82-L86 PolarHBondContact O-N 2.99Å
83K98.4Very high97.9Very high160 Ų16064.8 Ų64.870%0.69634%0.337SS*.Hα-helixtrans-59-42.3175.4-174.4-179.3179.9-177.70112.2A79 A80 R87A79-K83 PolarHBondContact O-N 3.19Å; A80-K83 PolarHBondContact O-N 2.77Å; K83-R87 PolarHBondContact O-N 3.39Å; K83-R87 VanDerWaalsContact O-N 3.1Å
84V98.5Very high98Very high3 Ų367.5 Ų67.52%0.01834%0.344CS..Hα-helixtrans-65.1-46.6177172.50000110.7K35 E38 L39 L42 A80 K81 E82 L86 R87 M88K35-V84 HydrophobicContact CB-CG1 4.18Å; K35-V84 HydrophobicContact CD-CG1 4.11Å; K35-V84 WeakPolarHBondContact O-CG1 3.46Å; E38-V84 HydrophobicContact CG-CG2 3.96Å; E38-V84 VanDerWaalsContact OE1-CG2 3.31Å; E38-V84 WeakPolarHBondContact OE1-CG2 3.48Å; L39-V84 HydrophobicContact CB-CG1 3.94Å; L42-V84 HydrophobicContact CD1-CG2 3.94Å; A80-V84 WeakPolarHBondContact O-CG2 3.48Å; A80-V84 PolarHBondContact O-N 3.39Å; K81-V84 PolarHBondContact O-N 3.41Å; E82-V84 VanDerWaalsContact C-N 3.31Å; E82-V84 PolarHBondContact O-N 2.94Å; V84-L86 PolarHBondContact O-N 3.12Å; V84-R87 PolarHBondContact O-N 3.3Å; V84-M88 HydrophobicContact CG1-CG 4.41Å; V84-M88 HydrophobicContact CG1-SD 4.07Å; V84-M88 WeakPolarHBondContact O-CG 3.46Å; V84-M88 PolarHBondContact O-N 2.95Å
85K98.5Very high98.1Very high99 Ų9967.5 Ų67.543%0.4334%0.34SS..Hα-helixtrans-60.3-45.6177.8-73.3172.2-175.81740112.2L39 K81 E82 R87 M88 V89L39-K85 HydrophobicContact CD1-CG 4.31Å; L39-K85 HydrophobicContact CD2-CG 4.29Å; K81-K85 WeakPolarHBondContact O-CB 3.45Å; K81-K85 VanDerWaalsContact O-CG 3.29Å; K81-K85 WeakPolarHBondContact O-CG 3.45Å; K81-K85 PolarHBondContact O-N 2.92Å; E82-K85 PolarHBondContact O-N 2.94Å; K85-R87 VanDerWaalsContact C-N 3.3Å; K85-R87 PolarHBondContact O-N 3.18Å; K85-M88 WeakPolarHBondContact O-CB 3.46Å; K85-M88 PolarHBondContact O-N 3.49Å; K85-M88 VanDerWaalsContact O-N 3.12Å; K85-V89 WeakPolarHBondContact O-CG2 3.22Å; K85-V89 PolarHBondContact O-N 2.89Å
86L98.5Very high98.2Very high106 Ų10664 Ų6456%0.55533%0.33SS*.Hα-helixtrans-59.7-41.3175.8-71.7173.4000111.8E82 V84 V89 D90E82-L86 HydrophobicContact CG-CD1 4.26Å; E82-L86 WeakPolarHBondContact O-CG 3.43Å; E82-L86 PolarHBondContact O-N 2.99Å; V84-L86 PolarHBondContact O-N 3.12Å; L86-V89 PolarHBondContact O-N 2.88Å; L86-D90 PolarHBondContact O-N 3.38Å
87R98.3Very high98.2Very high64 Ų6463.6 Ų63.624%0.24233%0.331CS..Hα-helixtrans-65.2-39.1175.1-178.456.7178.5161.613.3112E31 K35 K83 V84 K85 V89 D90 L91E31-R87 IonicContact OE1-CZ 2.94Å; E31-R87 VanDerWaalsContact OE1-CZ 3.22Å; E31-R87 IonicContact OE1-NE 2.77Å; E31-R87 PolarHBondContact OE1-NE 2.88Å; E31-R87 IonicContact OE1-NH2 3.78Å; E31-R87 PolarHBondContact OE1-NH2 3.47Å; E31-R87 IonicContact OE2-CZ 3.98Å; E31-R87 IonicContact OE2-NE 3.5Å; E31-R87 IonicContact OE2-NH2 2.78Å; E31-R87 PolarHBondContact OE2-NH2 3.24Å; K35-R87 HydrophobicContact CD-CG 4.17Å; K35-R87 HydrophobicContact CG-CG 4.31Å; K83-R87 PolarHBondContact O-N 3.39Å; K83-R87 VanDerWaalsContact O-N 3.1Å; V84-R87 PolarHBondContact O-N 3.3Å; K85-R87 VanDerWaalsContact C-N 3.3Å; K85-R87 PolarHBondContact O-N 3.18Å; R87-V89 VanDerWaalsContact C-N 3.34Å; R87-D90 IonicContact CZ-OD2 2.59Å; R87-D90 IonicContact NH1-OD2 3.88Å; R87-D90 PolarHBondContact NH1-OD2 3.07Å; R87-D90 PolarHBondContact O-N 3.1Å; R87-L91 HydrophobicContact CG-CD1 3.99Å; R87-L91 HydrophobicContact CG-CG 4.45Å; R87-L91 WeakPolarHBondContact O-CB 3.29Å; R87-L91 VanDerWaalsContact O-CG 3.3Å; R87-L91 WeakPolarHBondContact O-CG 3.35Å; R87-L91 PolarHBondContact O-N 2.96Å
88M98.6Very high98.2Very high19 Ų1962.6 Ų62.69%0.09433%0.326CS..Hα-helixtrans-62.4-40.7176.3-71.8177.771.900111.8Y32 K35 K36 L39 V84 K85 L91 E92Y32-M88 HydrophobicContact CD2-CB 4.26Å; Y32-M88 HydrophobicContact CD2-CE 4.37Å; Y32-M88 HydrophobicContact CD2-CG 4.38Å; Y32-M88 HydrophobicContact CE1-CE 4.34Å; Y32-M88 HydrophobicContact CE2-CB 3.95Å; Y32-M88 HydrophobicContact CE2-CE 3.68Å; Y32-M88 HydrophobicContact CE2-CG 4.28Å; K35-M88 HydrophobicContact CB-CG 3.6Å; K35-M88 HydrophobicContact CB-SD 4.18Å; K35-M88 HydrophobicContact CG-CG 4.48Å; K36-M88 HydrophobicContact CB-CE 4.22Å; L39-M88 HydrophobicContact CD2-SD 4.08Å; V84-M88 HydrophobicContact CG1-CG 4.41Å; V84-M88 HydrophobicContact CG1-SD 4.07Å; V84-M88 WeakPolarHBondContact O-CG 3.46Å; V84-M88 PolarHBondContact O-N 2.95Å; K85-M88 WeakPolarHBondContact O-CB 3.46Å; K85-M88 PolarHBondContact O-N 3.49Å; K85-M88 VanDerWaalsContact O-N 3.12Å; M88-L91 PolarHBondContact O-N 2.89Å; M88-E92 WeakPolarHBondContact O-CG 3.48Å; M88-E92 PolarHBondContact O-N 3.06Å
89V98.6Very high98.2Very high90 Ų9064.4 Ų64.455%0.54533%0.326SS..Hα-helixtrans-62.2-47175.8173.20000111.6K85 L86 R87 L91 E92 E93K85-V89 WeakPolarHBondContact O-CG2 3.22Å; K85-V89 PolarHBondContact O-N 2.89Å; L86-V89 PolarHBondContact O-N 2.88Å; R87-V89 VanDerWaalsContact C-N 3.34Å; V89-L91 VanDerWaalsContact C-N 3.31Å; V89-L91 PolarHBondContact O-N 3.19Å; V89-E92 PolarHBondContact O-N 3.41Å; V89-E93 PolarHBondContact O-N 3.17Å; V89-E93 VanDerWaalsContact O-N 3.11Å
90D98.5Very high98.2Very high46 Ų4665.1 Ų65.125%0.24632%0.324CS..Hα-helixtrans-61.9-38175.216491.9000112L86 R87 E93 R94L86-D90 PolarHBondContact O-N 3.38Å; R87-D90 IonicContact CZ-OD2 2.59Å; R87-D90 IonicContact NH1-OD2 3.88Å; R87-D90 PolarHBondContact NH1-OD2 3.07Å; R87-D90 PolarHBondContact O-N 3.1Å; D90-E93 PolarHBondContact O-N 3.03Å; D90-R94 VanDerWaalsContact CG-NE 3.29Å; D90-R94 VanDerWaalsContact O-CG 3.27Å; D90-R94 WeakPolarHBondContact O-CG 3.48Å; D90-R94 PolarHBondContact O-N 2.91Å; D90-R94 IonicContact OD1-CZ 3.06Å; D90-R94 IonicContact OD1-NE 3.91Å; D90-R94 PolarHBondContact OD1-NE 2.95Å; D90-R94 IonicContact OD1-NH2 2.66Å; D90-R94 PolarHBondContact OD1-NH2 2.59Å; D90-R94 IonicContact OD2-CZ 2.63Å; D90-R94 IonicContact OD2-NE 3.67Å; D90-R94 PolarHBondContact OD2-NE 2.66Å; D90-R94 IonicContact OD2-NH1 3.07Å; D90-R94 IonicContact OD2-NH2 2.88Å; D90-R94 PolarHBondContact OD2-NH2 2.88Å; D90-R94 VanDerWaalsContact OD2-NH2 3.07Å
91L98.6Very high98.2Very high0 Ų067.2 Ų67.20%033%0.328CS..Hα-helixtrans-66.1-41.7175.9-75.8168.3000112.1Y28 E31 Y32 K35 R87 M88 V89 E93 R94 I95Y28-L91 HydrophobicContact CD1-CD2 3.97Å; Y28-L91 HydrophobicContact CG-CD2 4.3Å; E31-L91 HydrophobicContact CB-CD1 4.13Å; E31-L91 HydrophobicContact CB-CD2 4.25Å; E31-L91 HydrophobicContact CG-CD1 3.82Å; E31-L91 HydrophobicContact CG-CD2 4.38Å; Y32-L91 HydrophobicContact CD2-CB 4.11Å; K35-L91 HydrophobicContact CG-CD1 4.12Å; R87-L91 HydrophobicContact CG-CD1 3.99Å; R87-L91 HydrophobicContact CG-CG 4.45Å; R87-L91 WeakPolarHBondContact O-CB 3.29Å; R87-L91 VanDerWaalsContact O-CG 3.3Å; R87-L91 WeakPolarHBondContact O-CG 3.35Å; R87-L91 PolarHBondContact O-N 2.96Å; M88-L91 PolarHBondContact O-N 2.89Å; V89-L91 VanDerWaalsContact C-N 3.31Å; V89-L91 PolarHBondContact O-N 3.19Å; L91-E93 VanDerWaalsContact C-N 3.34Å; L91-E93 PolarHBondContact O-N 3.41Å; L91-R94 PolarHBondContact O-N 2.92Å; L91-I95 WeakPolarHBondContact O-CB 3.02Å; L91-I95 WeakPolarHBondContact O-CD1 3.31Å; L91-I95 WeakPolarHBondContact O-CG1 3.35Å; L91-I95 PolarHBondContact O-N 2.65Å
92E98.3Very high98.1Very high94 Ų9467.6 Ų67.644%0.43933%0.33SS..Hα-helixtrans-59.9-43.5175.9-77.1174.8177.800112Y32 M88 V89 I95 S96Y32-E92 HydrophobicContact CD2-CG 4.04Å; Y32-E92 HydrophobicContact CE2-CG 3.42Å; Y32-E92 VanDerWaalsContact CE2-CG 3.42Å; Y32-E92 VanDerWaalsContact CE2-OE1 3.23Å; Y32-E92 WeakPolarHBondContact CE2-OE1 3.3Å; Y32-E92 VanDerWaalsContact CZ-OE1 3.26Å; Y32-E92 PolarHBondContact OH-OE1 3.48Å; M88-E92 WeakPolarHBondContact O-CG 3.48Å; M88-E92 PolarHBondContact O-N 3.06Å; V89-E92 PolarHBondContact O-N 3.41Å; E92-I95 PolarHBondContact O-N 3.33Å; E92-S96 WeakPolarHBondContact O-CB 3.47Å; E92-S96 PolarHBondContact O-N 3.03Å
93E98.4Very high97.9Very high122 Ų12266.8 Ų66.857%0.5733%0.329SS*.Hα-helixtrans-60.4-49.6175.2-174.2175-162.700110.9V89 D90 L91 I95 S96 D97V89-E93 PolarHBondContact O-N 3.17Å; V89-E93 VanDerWaalsContact O-N 3.11Å; D90-E93 PolarHBondContact O-N 3.03Å; L91-E93 VanDerWaalsContact C-N 3.34Å; L91-E93 PolarHBondContact O-N 3.41Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 3.14Å; E93-S96 WeakPolarHBondContact O-CA 3.41Å; E93-S96 WeakPolarHBondContact O-CB 3.3Å; E93-S96 PolarHBondContact O-N 3.37Å; E93-S96 VanDerWaalsContact O-N 3.11Å; E93-D97 PolarHBondContact O-N 3.39Å
94R98.4Very high97.8Very high83 Ų8362.9 Ų62.931%0.31332%0.315SS..Hα-helixtrans-62.7-38.6178.3-69.7174.5-170.6-160.18.2113.3Y28 D90 L91 S96 D97 C98Y28-R94 HydrophobicContact CD2-CB 3.68Å; Y28-R94 HydrophobicContact CE2-CB 3.81Å; Y28-R94 HydrophobicContact CE2-CG 4.41Å; Y28-R94 HydrophobicContact CG-CB 4.22Å; D90-R94 VanDerWaalsContact CG-NE 3.29Å; D90-R94 VanDerWaalsContact O-CG 3.27Å; D90-R94 WeakPolarHBondContact O-CG 3.48Å; D90-R94 PolarHBondContact O-N 2.91Å; D90-R94 IonicContact OD1-CZ 3.06Å; D90-R94 IonicContact OD1-NE 3.91Å; D90-R94 PolarHBondContact OD1-NE 2.95Å; D90-R94 IonicContact OD1-NH2 2.66Å; D90-R94 PolarHBondContact OD1-NH2 2.59Å; D90-R94 IonicContact OD2-CZ 2.63Å; D90-R94 IonicContact OD2-NE 3.67Å; D90-R94 PolarHBondContact OD2-NE 2.66Å; D90-R94 IonicContact OD2-NH1 3.07Å; D90-R94 IonicContact OD2-NH2 2.88Å; D90-R94 PolarHBondContact OD2-NH2 2.88Å; D90-R94 VanDerWaalsContact OD2-NH2 3.07Å; L91-R94 PolarHBondContact O-N 2.92Å; R94-S96 VanDerWaalsContact C-N 3.33Å; R94-D97 PolarHBondContact O-N 3.42Å; R94-C98 PolarHBondContact O-N 3.3Å; R94-C98 PolarHBondContact O-SG 3.47Å
95I98.4Very high97.7Very high19 Ų1963.8 Ų63.810%0.09732%0.32CS..Hα-helixtrans-62.4-44.3175-73.8166.5000109.6F25 Y32 L91 E92 E93 C98 K99F25-I95 HydrophobicContact CD2-CG2 4.14Å; F25-I95 HydrophobicContact CE2-CG2 3.8Å; Y32-I95 HydrophobicContact CG-CD1 4.33Å; L91-I95 WeakPolarHBondContact O-CB 3.02Å; L91-I95 WeakPolarHBondContact O-CD1 3.31Å; L91-I95 WeakPolarHBondContact O-CG1 3.35Å; L91-I95 PolarHBondContact O-N 2.65Å; E92-I95 PolarHBondContact O-N 3.33Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 3.14Å; I95-C98 PolarHBondContact O-N 3.38Å; I95-K99 WeakPolarHBondContact O-CG 3.35Å; I95-K99 PolarHBondContact O-N 3.27Å
96S98.1Very high97.5Very high65 Ų6561.3 Ų61.346%0.45531%0.309SS..Hα-helixtrans-60.6-47175.4-177.50000111.6E92 E93 R94 C98 K99 V100E92-S96 WeakPolarHBondContact O-CB 3.47Å; E92-S96 PolarHBondContact O-N 3.03Å; E93-S96 WeakPolarHBondContact O-CA 3.41Å; E93-S96 WeakPolarHBondContact O-CB 3.3Å; E93-S96 PolarHBondContact O-N 3.37Å; E93-S96 VanDerWaalsContact O-N 3.11Å; R94-S96 VanDerWaalsContact C-N 3.33Å; S96-C98 PolarHBondContact O-N 3.23Å; S96-K99 WeakPolarHBondContact O-CB 3.32Å; S96-K99 PolarHBondContact O-N 3.35Å; S96-K99 VanDerWaalsContact O-N 3.15Å; S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 2.9Å
97D97.7Very high97.2Very high77 Ų7763.5 Ų63.541%0.41231%0.314SS..Hα-helixtrans-59.5-44.7177.5-75.4-12000112.1E93 R94 K99 V100 H101E93-D97 PolarHBondContact O-N 3.39Å; R94-D97 PolarHBondContact O-N 3.42Å; D97-K99 VanDerWaalsContact C-N 3.32Å; D97-K99 PolarHBondContact O-N 3.42Å; D97-V100 PolarHBondContact O-N 2.88Å; D97-H101 PolarHBondContact O-CD2 3.4Å; D97-H101 PolarHBondContact O-N 2.87Å
98C97.3Very high97Very high1 Ų165.1 Ų65.11%0.00733%0.325CS..Hα-helixtrans-58.7-45.5175.8-66.40000111W21 F25 R94 I95 S96 V100 H101 M102W21-C98 HydrophobicContact CE3-CB 4.33Å; F25-C98 HydrophobicContact CB-CB 3.87Å; F25-C98 HydrophobicContact CD2-CB 4.31Å; R94-C98 PolarHBondContact O-N 3.3Å; R94-C98 PolarHBondContact O-SG 3.47Å; I95-C98 PolarHBondContact O-N 3.38Å; S96-C98 PolarHBondContact O-N 3.23Å; C98-V100 VanDerWaalsContact C-N 3.34Å; C98-V100 PolarHBondContact O-N 3.32Å; C98-H101 PolarHBondContact O-N 2.94Å; C98-M102 HydrophobicContact CB-SD 4.47Å; C98-M102 VanDerWaalsContact O-CB 3.26Å; C98-M102 WeakPolarHBondContact O-CB 3.48Å; C98-M102 VanDerWaalsContact O-CG 3.25Å; C98-M102 WeakPolarHBondContact O-CG 3.36Å; C98-M102 PolarHBondContact O-N 3.27Å
99K96.9Very high96.8Very high101 Ų10164.3 Ų64.344%0.43932%0.321SS..Hα-helixtrans-60.2-42.2176.5-72.2177.6-175.1-179.80111.9F25 I95 S96 D97 N103F25-K99 HydrophobicContact CD2-CG 4.26Å; F25-K99 HydrophobicContact CE2-CD 4.37Å; F25-K99 VanDerWaalsContact CE2-CE 3.45Å; F25-K99 HydrophobicContact CE2-CG 3.98Å; I95-K99 WeakPolarHBondContact O-CG 3.35Å; I95-K99 PolarHBondContact O-N 3.27Å; S96-K99 WeakPolarHBondContact O-CB 3.32Å; S96-K99 PolarHBondContact O-N 3.35Å; S96-K99 VanDerWaalsContact O-N 3.15Å; D97-K99 VanDerWaalsContact C-N 3.32Å; D97-K99 PolarHBondContact O-N 3.42Å; K99-N103 WeakPolarHBondContact O-CB 3.44Å; K99-N103 PolarHBondContact O-N 3.03Å; K99-N103 PolarHBondContact O-ND2 3.16Å
100V97.9Very high96.6Very high73 Ų7363.2 Ų63.244%0.44231%0.307SS..Hα-helixtrans-61.7-50.8177.7171.60000110.6S96 D97 C98 N103 N104S96-V100 WeakPolarHBondContact O-CG2 3.42Å; S96-V100 PolarHBondContact O-N 2.9Å; D97-V100 PolarHBondContact O-N 2.88Å; C98-V100 VanDerWaalsContact C-N 3.34Å; C98-V100 PolarHBondContact O-N 3.32Å; V100-N103 PolarHBondContact O-N 2.98Å; V100-N104 VanDerWaalsContact O-CG 3.31Å; V100-N104 PolarHBondContact O-N 3.08Å; V100-N104 PolarHBondContact O-ND2 2.95Å
101H96.8Very high96.2Very high79 Ų7964.4 Ų64.437%0.36633%0.33SS..Hα-helixtrans-63.3-45.1179.7-76.5-65.3000112.5W21 D97 C98 N104 L105W21-H101 HydrophobicContact CD2-CB 3.82Å; W21-H101 AromaticContact CE2-CD2 3.93Å; W21-H101 AromaticContact CE2-CG 3.74Å; W21-H101 HydrophobicContact CE3-CB 4.4Å; W21-H101 HydrophobicContact CG-CB 3.97Å; W21-H101 AromaticContact CH2-CD2 3.52Å; W21-H101 AromaticContact CH2-NE2 3.91Å; W21-H101 HydrophobicContact CZ2-CB 4.23Å; W21-H101 AromaticContact CZ2-CD2 3.51Å; W21-H101 AromaticContact CZ2-CG 3.73Å; W21-H101 AromaticContact CZ2-NE2 3.85Å; W21-H101 AromaticContact CZ3-CD2 3.98Å; D97-H101 PolarHBondContact O-CD2 3.4Å; D97-H101 PolarHBondContact O-N 2.87Å; C98-H101 PolarHBondContact O-N 2.94Å; H101-N104 PolarHBondContact O-N 2.83Å; H101-L105 WeakPolarHBondContact O-CB 3.47Å; H101-L105 WeakPolarHBondContact O-CG 3.3Å; H101-L105 PolarHBondContact O-N 3.39Å
102M96.1Very high95.8Very high17 Ų1768.8 Ų68.88%0.08435%0.349CS..Hα-helixtrans-59.9-46.5175.6-76.9164.734.400111.5F18 W21 N22 F25 C98 N104 L105 K106F18-M102 HydrophobicContact CD2-CB 4.32Å; F18-M102 HydrophobicContact CD2-CG 4.35Å; F18-M102 HydrophobicContact CE2-CB 3.92Å; F18-M102 HydrophobicContact CE2-CG 4.14Å; W21-M102 HydrophobicContact CB-CG 3.69Å; W21-M102 HydrophobicContact CB-SD 4.35Å; N22-M102 HydrophobicContact CB-SD 4.39Å; F25-M102 HydrophobicContact CB-SD 3.81Å; F25-M102 HydrophobicContact CD1-CE 4.34Å; F25-M102 HydrophobicContact CG-CE 4.36Å; F25-M102 HydrophobicContact CG-SD 4.18Å; C98-M102 HydrophobicContact CB-SD 4.47Å; C98-M102 VanDerWaalsContact O-CB 3.26Å; C98-M102 WeakPolarHBondContact O-CB 3.48Å; C98-M102 VanDerWaalsContact O-CG 3.25Å; C98-M102 WeakPolarHBondContact O-CG 3.36Å; C98-M102 PolarHBondContact O-N 3.27Å; M102-N104 VanDerWaalsContact C-N 3.33Å; M102-N104 PolarHBondContact O-N 2.94Å; M102-L105 PolarHBondContact O-N 2.89Å; M102-K106 WeakPolarHBondContact O-CB 3.47Å; M102-K106 PolarHBondContact O-N 3.27Å
103N95.8Very high95.5Very high84 Ų8464.9 Ų64.945%0.44933%0.331SS..Hα-helixtrans-63.1-38.8179.9-78-32.6000112.5K99 V100 K107K99-N103 WeakPolarHBondContact O-CB 3.44Å; K99-N103 PolarHBondContact O-N 3.03Å; K99-N103 PolarHBondContact O-ND2 3.16Å; V100-N103 PolarHBondContact O-N 2.98Å; N103-K107 VanDerWaalsContact O-CG 3.29Å; N103-K107 WeakPolarHBondContact O-CG 3.29Å; N103-K107 PolarHBondContact O-N 2.99Å
104N96.1Very high95Very high78 Ų7860.4 Ų60.442%0.41732%0.318SS..Hα-helixtrans-65.6-49.5176.2-70.3-21.2000111V100 H101 M102 K106 K107 E108V100-N104 VanDerWaalsContact O-CG 3.31Å; V100-N104 PolarHBondContact O-N 3.08Å; V100-N104 PolarHBondContact O-ND2 2.95Å; H101-N104 PolarHBondContact O-N 2.83Å; M102-N104 VanDerWaalsContact C-N 3.33Å; M102-N104 PolarHBondContact O-N 2.94Å; N104-K106 VanDerWaalsContact C-N 3.33Å; N104-K106 PolarHBondContact O-N 3.36Å; N104-K107 PolarHBondContact O-N 3.46Å; N104-E108 WeakPolarHBondContact O-CG 3.26Å; N104-E108 PolarHBondContact O-N 2.89Å; N104-E108 VanDerWaalsContact O-N 3.08Å
105L95.3Very high94.4Very high23 Ų2364.4 Ų64.412%0.1235%0.345CS..Hα-helixtrans-62.1-40.5177.4-70.6169.5000112.1R14 F18 H101 M102 K107 E108 L109R14-L105 HydrophobicContact CB-CD2 4Å; R14-L105 HydrophobicContact CG-CD2 4.02Å; F18-L105 HydrophobicContact CB-CB 4.32Å; F18-L105 HydrophobicContact CB-CD1 4.18Å; F18-L105 HydrophobicContact CD2-CB 4.07Å; H101-L105 WeakPolarHBondContact O-CB 3.47Å; H101-L105 WeakPolarHBondContact O-CG 3.3Å; H101-L105 PolarHBondContact O-N 3.39Å; M102-L105 PolarHBondContact O-N 2.89Å; L105-K107 PolarHBondContact O-N 3.28Å; L105-E108 PolarHBondContact O-N 2.72Å; L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.46Å
106K93.9Very high93.8Very high47 Ų4770.5 Ų70.520%0.20437%0.373CS..Hα-helixtrans-59.9-46.2177.1-171.4171.2-175.2178.50111.1F18 M102 N104 L109 Y110 L119 E120F18-K106 HydrophobicContact CE2-CB 4.07Å; M102-K106 WeakPolarHBondContact O-CB 3.47Å; M102-K106 PolarHBondContact O-N 3.27Å; N104-K106 VanDerWaalsContact C-N 3.33Å; N104-K106 PolarHBondContact O-N 3.36Å; K106-L109 PolarHBondContact O-N 2.86Å; K106-Y110 HydrophobicContact CD-CE2 4.14Å; K106-Y110 HydrophobicContact CG-CD2 3.52Å; K106-Y110 HydrophobicContact CG-CE2 3.5Å; K106-Y110 WeakPolarHBondContact O-CB 3.38Å; K106-Y110 VanDerWaalsContact O-CD2 3.26Å; K106-Y110 WeakPolarHBondContact O-CD2 3.4Å; K106-Y110 PolarHBondContact O-N 2.76Å; K106-L119 HydrophobicContact CB-CD1 4.43Å; K106-L119 HydrophobicContact CG-CB 4.46Å; K106-L119 HydrophobicContact CG-CD1 4.24Å; K106-E120 WeakPolarHBondContact CE-OE1 3.35Å; K106-E120 IonicContact NZ-OE1 3.33Å; K106-E120 PolarHBondContact NZ-OE1 2.99Å; K106-E120 IonicContact NZ-OE2 2.69Å; K106-E120 PolarHBondContact NZ-OE2 2.98Å
107K94.1Very high93.3Very high152 Ų15268.8 Ų68.866%0.66136%0.359SS*.Hα-helixtrans-61.6-45.4175.7-73.5171.6-175.9175.90112.3N103 N104 L105 G111N103-K107 VanDerWaalsContact O-CG 3.29Å; N103-K107 WeakPolarHBondContact O-CG 3.29Å; N103-K107 PolarHBondContact O-N 2.99Å; N104-K107 PolarHBondContact O-N 3.46Å; L105-K107 PolarHBondContact O-N 3.28Å; K107-G111 PolarHBondContact O-N 2.88Å
108E93.5Very high92.8Very high98 Ų9870.9 Ų70.946%0.45837%0.37SS..Hα-helixtrans-62.4-45.9178.6-71.7179.5-160.500111.8R14 N104 L105 G111 K112R14-E108 VanDerWaalsContact CD-OE2 3.3Å; R14-E108 WeakPolarHBondContact CD-OE2 3.03Å; R14-E108 IonicContact CZ-OE2 2.99Å; R14-E108 IonicContact NE-OE2 2.71Å; R14-E108 PolarHBondContact NE-OE2 3.24Å; R14-E108 IonicContact NH2-OE2 3.22Å; N104-E108 WeakPolarHBondContact O-CG 3.26Å; N104-E108 PolarHBondContact O-N 2.89Å; N104-E108 VanDerWaalsContact O-N 3.08Å; L105-E108 PolarHBondContact O-N 2.72Å; E108-G111 PolarHBondContact O-N 3.47Å; E108-K112 PolarHBondContact O-N 3.27Å
109L93.7Very high92.2Very high1 Ų171.5 Ų71.51%0.00537%0.373CS..Hα-helixtrans-70.1-46-178-70.8170000112R14 I15 F18 L105 K106 G111 K112 F113 I117 L119R14-L109 HydrophobicContact CB-CD1 4.42Å; R14-L109 HydrophobicContact CB-CD2 3.91Å; R14-L109 HydrophobicContact CB-CG 4.29Å; I15-L109 HydrophobicContact CD1-CD2 4.48Å; I15-L109 HydrophobicContact CG1-CD1 4.08Å; I15-L109 HydrophobicContact CG1-CD2 3.71Å; F18-L109 HydrophobicContact CB-CD1 4.34Å; L105-L109 WeakPolarHBondContact O-CB 3.49Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.46Å; L105-L109 PolarHBondContact O-N 3.46Å; K106-L109 PolarHBondContact O-N 2.86Å; L109-G111 VanDerWaalsContact C-N 3.29Å; L109-G111 PolarHBondContact O-N 3.17Å; L109-K112 PolarHBondContact O-N 2.74Å; L109-F113 HydrophobicContact CD2-CD2 4.16Å; L109-F113 HydrophobicContact CD2-CE2 3.88Å; L109-F113 WeakPolarHBondContact O-CB 3.33Å; L109-F113 WeakPolarHBondContact O-CD2 3.43Å; L109-F113 PolarHBondContact O-N 2.9Å; L109-I117 HydrophobicContact CB-CD1 4.32Å; L109-I117 HydrophobicContact CD1-CD1 4.45Å; L109-I117 HydrophobicContact CD2-CD1 4.44Å; L109-L119 HydrophobicContact CB-CD1 3.67Å; L109-L119 HydrophobicContact CD1-CD1 3.66Å; L109-L119 HydrophobicContact CD1-CD2 4.27Å; L109-L119 HydrophobicContact CG-CD1 4.31Å
110Y93.8Very high91.4Very high67 Ų6771.9 Ų71.926%0.26338%0.376SS..Hα-helixtrans-65.4-32.6174-82.1-63.5000112.4K106 K112 G114 I117 L119 E120K106-Y110 HydrophobicContact CD-CE2 4.14Å; K106-Y110 HydrophobicContact CG-CD2 3.52Å; K106-Y110 HydrophobicContact CG-CE2 3.5Å; K106-Y110 WeakPolarHBondContact O-CB 3.38Å; K106-Y110 VanDerWaalsContact O-CD2 3.26Å; K106-Y110 WeakPolarHBondContact O-CD2 3.4Å; K106-Y110 PolarHBondContact O-N 2.76Å; Y110-K112 PolarHBondContact O-N 3.34Å; Y110-G114 WeakPolarHBondContact CD1-O 3.34Å; Y110-G114 WeakPolarHBondContact O-CA 3.35Å; Y110-G114 PolarHBondContact O-N 2.79Å; Y110-I117 HydrophobicContact CD1-CG2 4.02Å; Y110-I117 HydrophobicContact CE1-CG2 4.11Å; Y110-I117 WeakPolarHBondContact CE1-O 3.29Å; Y110-L119 HydrophobicContact CD2-CD1 4.35Å; Y110-L119 HydrophobicContact CE2-CB 4.12Å; Y110-L119 HydrophobicContact CE2-CD1 4.22Å; Y110-L119 HydrophobicContact CE2-CG 4.47Å; Y110-L119 PolarHBondContact OH-N 3.04Å; Y110-E120 PolarHBondContact OH-OE1 2.73Å
111G91.6Very high89.8Confident71 Ų7172.7 Ų72.773%0.73238%0.375SS*.Hα-helixtrans-62.2-30.9174.200000113.2K107 E108 L109K107-G111 PolarHBondContact O-N 2.88Å; E108-G111 PolarHBondContact O-N 3.47Å; L109-G111 VanDerWaalsContact C-N 3.29Å; L109-G111 PolarHBondContact O-N 3.17Å
112K89.8Confident87.6Confident92 Ų9279.4 Ų79.440%0.441%0.414SS..Hα-helixtrans-93.5-43.9-179.9-173.6167.9-176.5169.90113.9D11 E108 L109 Y110D11-K112 VanDerWaalsContact OD1-CD 3.26Å; D11-K112 WeakPolarHBondContact OD1-CD 3.48Å; D11-K112 IonicContact OD1-NZ 2.74Å; D11-K112 PolarHBondContact OD1-NZ 3.08Å; D11-K112 VanDerWaalsContact OD2-CE 3.28Å; D11-K112 WeakPolarHBondContact OD2-CE 3.38Å; D11-K112 IonicContact OD2-NZ 3.06Å; D11-K112 PolarHBondContact OD2-NZ 3.42Å; E108-K112 PolarHBondContact O-N 3.27Å; L109-K112 PolarHBondContact O-N 2.74Å; Y110-K112 PolarHBondContact O-N 3.34Å
113F92Very high87.2Confident12 Ų1282.5 Ų82.55%0.05343%0.43CS..Hα-helixtrans-97.9-19.3-173.5-65-75.2000113.2I5 V7 D11 L109 N115 H116 I117I5-F113 HydrophobicContact CB-CD1 4.4Å; I5-F113 HydrophobicContact CG2-CD1 3.54Å; I5-F113 HydrophobicContact CG2-CE1 3.6Å; V7-F113 HydrophobicContact CG1-CZ 4.39Å; V7-F113 HydrophobicContact CG2-CE1 3.84Å; V7-F113 HydrophobicContact CG2-CZ 4.24Å; D11-F113 HydrophobicContact CB-CE2 3.87Å; D11-F113 HydrophobicContact CB-CZ 3.71Å; L109-F113 HydrophobicContact CD2-CD2 4.16Å; L109-F113 HydrophobicContact CD2-CE2 3.88Å; L109-F113 WeakPolarHBondContact O-CB 3.33Å; L109-F113 WeakPolarHBondContact O-CD2 3.43Å; L109-F113 PolarHBondContact O-N 2.9Å; F113-N115 PolarHBondContact O-N 3.35Å; F113-H116 WeakPolarHBondContact O-CB 3.38Å; F113-H116 PolarHBondContact O-N 3.17Å; F113-H116 VanDerWaalsContact O-N 3.07Å; F113-H116 PolarHBondContact O-ND1 3.42Å; F113-I117 HydrophobicContact CB-CB 3.86Å; F113-I117 HydrophobicContact CB-CG2 3.65Å; F113-I117 HydrophobicContact CD2-CD1 4.28Å; F113-I117 HydrophobicContact CG-CB 4.38Å; F113-I117 HydrophobicContact CG-CG2 4.44Å
114G86.9Confident86.7Confident29 Ų2982.4 Ų82.430%0.29943%0.429SS..G310 helixtrans53.5-128.1-173.800000111.2Y110 H116Y110-G114 WeakPolarHBondContact CD1-O 3.34Å; Y110-G114 WeakPolarHBondContact O-CA 3.35Å; Y110-G114 PolarHBondContact O-N 2.79Å; G114-H116 PolarHBondContact O-N 2.88Å
115N86Confident86.2Confident166 Ų16682.7 Ų82.789%0.88843%0.43SS*.G310 helixtrans-76.91.5-178.4-60.7-17.7000114.3F113 I117F113-N115 PolarHBondContact O-N 3.35Å; N115-I117 VanDerWaalsContact C-N 3.3Å
116H86.4Confident85.7Confident147 Ų14786.2 Ų86.268%0.68145%0.448SS*.G310 helixtrans-85.5-3.3179.2-56.688.5000113.1I5 F113 G114I5-H116 HydrophobicContact CD1-CB 4.04Å; I5-H116 WeakPolarHBondContact CD1-ND1 3.2Å; F113-H116 WeakPolarHBondContact O-CB 3.38Å; F113-H116 PolarHBondContact O-N 3.17Å; F113-H116 VanDerWaalsContact O-N 3.07Å; F113-H116 PolarHBondContact O-ND1 3.42Å; G114-H116 PolarHBondContact O-N 2.88Å
117I87.9Confident85.2Confident30 Ų3088.6 Ų88.615%0.15446%0.463CS..  trans-126144.7174.1-162.5169.9000110I15 L109 Y110 F113 N115 L119I15-I117 HydrophobicContact CD1-CD1 3.97Å; I15-I117 HydrophobicContact CG1-CD1 3.96Å; L109-I117 HydrophobicContact CB-CD1 4.32Å; L109-I117 HydrophobicContact CD1-CD1 4.45Å; L109-I117 HydrophobicContact CD2-CD1 4.44Å; Y110-I117 HydrophobicContact CD1-CG2 4.02Å; Y110-I117 HydrophobicContact CE1-CG2 4.11Å; Y110-I117 WeakPolarHBondContact CE1-O 3.29Å; F113-I117 HydrophobicContact CB-CB 3.86Å; F113-I117 HydrophobicContact CB-CG2 3.65Å; F113-I117 HydrophobicContact CD2-CD1 4.28Å; F113-I117 HydrophobicContact CG-CB 4.38Å; F113-I117 HydrophobicContact CG-CG2 4.44Å; N115-I117 VanDerWaalsContact C-N 3.3Å; I117-L119 HydrophobicContact CD1-CD1 4.34Å; I117-L119 HydrophobicContact CD1-CD2 3.82Å; I117-L119 HydrophobicContact CD1-CG 4.14Å; I117-L119 HydrophobicContact CG1-CD2 4.02Å; I117-L119 HydrophobicContact CG1-CG 4.11Å
118N86.9Confident84.6Confident120 Ų12084.4 Ų84.464%0.64245%0.45SS*.  trans-119.1124.8170.3-174.413.1000109.1E120N118-E120 PolarHBondContact OD1-N 2.84Å; N118-E120 VanDerWaalsContact OD1-N 3.12Å
119L86Confident84Confident15 Ų1583.4 Ų83.48%0.07945%0.45CS..  trans-126.111.5-178.7-60.5176.1000112F18 K106 L109 Y110 I117F18-L119 HydrophobicContact CD1-CD2 3.8Å; F18-L119 HydrophobicContact CE1-CB 3.87Å; F18-L119 HydrophobicContact CE1-CD2 3.97Å; F18-L119 HydrophobicContact CE1-CG 4.44Å; F18-L119 HydrophobicContact CE2-CB 4.4Å; F18-L119 HydrophobicContact CG-CD2 4.28Å; F18-L119 HydrophobicContact CZ-CB 3.82Å; F18-L119 VanDerWaalsContact CZ-O 3.28Å; F18-L119 WeakPolarHBondContact CZ-O 3.33Å; K106-L119 HydrophobicContact CB-CD1 4.43Å; K106-L119 HydrophobicContact CG-CB 4.46Å; K106-L119 HydrophobicContact CG-CD1 4.24Å; L109-L119 HydrophobicContact CB-CD1 3.67Å; L109-L119 HydrophobicContact CD1-CD1 3.66Å; L109-L119 HydrophobicContact CD1-CD2 4.27Å; L109-L119 HydrophobicContact CG-CD1 4.31Å; Y110-L119 HydrophobicContact CD2-CD1 4.35Å; Y110-L119 HydrophobicContact CE2-CB 4.12Å; Y110-L119 HydrophobicContact CE2-CD1 4.22Å; Y110-L119 HydrophobicContact CE2-CG 4.47Å; Y110-L119 PolarHBondContact OH-N 3.04Å; I117-L119 HydrophobicContact CD1-CD1 4.34Å; I117-L119 HydrophobicContact CD1-CD2 3.82Å; I117-L119 HydrophobicContact CD1-CG 4.14Å; I117-L119 HydrophobicContact CG1-CD2 4.02Å; I117-L119 HydrophobicContact CG1-CG 4.11Å
120E78.2Confident83.2Confident108 Ų10889.8 Ų89.851%0.50548%0.484SS..  trans-74.7152.1175.1-56.9-52.3138.300111.3K106 Y110 N118K106-E120 WeakPolarHBondContact CE-OE1 3.35Å; K106-E120 IonicContact NZ-OE1 3.33Å; K106-E120 PolarHBondContact NZ-OE1 2.99Å; K106-E120 IonicContact NZ-OE2 2.69Å; K106-E120 PolarHBondContact NZ-OE2 2.98Å; Y110-E120 PolarHBondContact OH-OE1 2.73Å; N118-E120 PolarHBondContact OD1-N 2.84Å; N118-E120 VanDerWaalsContact OD1-N 3.12Å
121E65.5Low82.3Confident91 Ų9191.7 Ų91.743%0.42550%0.502SS..  trans-78.6130.1172-66.5-175.49900109.8N22 K26N22-E121 PolarHBondContact OD1-OE1 2.76Å; K26-E121 WeakPolarHBondContact CE-OE1 3.38Å
122D50.8Low81.5Confident219 Ų21993.5 Ų93.5100%1.17148%0.481SS*.  trans-74.90155.4-73.2-40.5000110.5

Retrieved 122 of 122 residues in 39.6 ms (Link to these results)

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