A0A087Y8X3_POEFO Loading...

Cytochrome c oxidase subunit NDUFA4

AlphaFold DB (A0A3B3VQ47), UniProt , Accession A0A087Y8X3, Species POEFO (Poecilia formosa, Amazon molly), Gene NDUFA4, Length 82 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
1M76.7Confident89.6Confident193 Ų193119.9 Ų119.995%0.95158%0.579SS**  0-58.40-154.8174.9-169.800112.7L3 T4 I5M1-L3 PolarHBondContact O-N 3.16Å; M1-T4 WeakPolarHBondContact O-CB 3.33Å; M1-T4 PolarHBondContact O-N 3.02Å; M1-T4 VanDerWaalsContact O-N 3.14Å; M1-I5 PolarHBondContact O-N 2.84Å; M1-I5 VanDerWaalsContact O-N 3.16Å
2L86.2Confident90.1Very high146 Ų146118.1 Ų118.176%0.76457%0.568SS**Hα-helixtrans-60.6-38.6-179.7-71.7168.8000114.5T4 I5 R6L2-T4 VanDerWaalsContact C-N 3.3Å; L2-T4 PolarHBondContact O-N 3.12Å; L2-I5 PolarHBondContact O-N 3.28Å; L2-R6 PolarHBondContact O-N 3.06Å
3L90.8Very high90.3Very high141 Ų141115.7 Ų115.774%0.73857%0.568SS**Hα-helixtrans-62.8-37175.8-65.5175.5000112.3M1 R6 K7M1-L3 PolarHBondContact O-N 3.16Å; L3-R6 PolarHBondContact O-N 3.35Å; L3-K7 PolarHBondContact O-N 3.4Å
4T91.8Very high90.6Very high87 Ų87113.3 Ų113.353%0.53458%0.576SS.*Hα-helixtrans-65.2-45176-440000110.8M1 L2 R6 K7 Q8M1-T4 WeakPolarHBondContact O-CB 3.33Å; M1-T4 PolarHBondContact O-N 3.02Å; M1-T4 VanDerWaalsContact O-N 3.14Å; L2-T4 VanDerWaalsContact C-N 3.3Å; L2-T4 PolarHBondContact O-N 3.12Å; T4-R6 PolarHBondContact O-N 3.1Å; T4-K7 PolarHBondContact O-N 3.29Å; T4-Q8 WeakPolarHBondContact O-CG 3.35Å; T4-Q8 PolarHBondContact O-N 3.02Å
5I87.9Confident90.8Very high59 Ų59109.1 Ų109.130%0.30356%0.555SS.*Hα-helixtrans-62.3-43.9176.8-63.9169.8000110.7M1 L2 K7 Q8 L9M1-I5 PolarHBondContact O-N 2.84Å; M1-I5 VanDerWaalsContact O-N 3.16Å; L2-I5 PolarHBondContact O-N 3.28Å; I5-K7 VanDerWaalsContact C-N 3.32Å; I5-K7 PolarHBondContact O-N 3.35Å; I5-Q8 PolarHBondContact O-N 3.32Å; I5-L9 HydrophobicContact CG2-CD1 3.84Å; I5-L9 HydrophobicContact CG2-CG 4.45Å; I5-L9 WeakPolarHBondContact O-CG 3.42Å; I5-L9 PolarHBondContact O-N 3.09Å
6R91.7Very high91Very high147 Ų147108.1 Ų108.156%0.55555%0.55SS**Hα-helixtrans-60.6-40.6176.2-175.4179.5177.8178.50.6112.3L2 L3 T4 R10L2-R6 PolarHBondContact O-N 3.06Å; L3-R6 PolarHBondContact O-N 3.35Å; T4-R6 PolarHBondContact O-N 3.1Å; R6-R10 PolarHBondContact O-N 2.98Å
7K92.2Very high91.3Very high157 Ų157105.8 Ų105.868%0.68354%0.544SS*.Hα-helixtrans-63.2-44.1175.5-171.2178.3178.4-178.90110.8L3 T4 I5 R10 S11L3-K7 PolarHBondContact O-N 3.4Å; T4-K7 PolarHBondContact O-N 3.29Å; I5-K7 VanDerWaalsContact C-N 3.32Å; I5-K7 PolarHBondContact O-N 3.35Å; K7-R10 PolarHBondContact O-N 3.38Å; K7-S11 PolarHBondContact O-N 3.3Å; K7-S11 VanDerWaalsContact O-N 3.12Å; K7-S11 PolarHBondContact O-OG 2.89Å
8Q90.9Very high91.5Very high82 Ų82105.1 Ų105.138%0.38354%0.541SS..Hα-helixtrans-64.4-40.5178-70.5-61.3-2900113.3T4 I5 R10 S11 H12 L15T4-Q8 WeakPolarHBondContact O-CG 3.35Å; T4-Q8 PolarHBondContact O-N 3.02Å; I5-Q8 PolarHBondContact O-N 3.32Å; Q8-R10 VanDerWaalsContact C-N 3.28Å; Q8-R10 PolarHBondContact O-N 3.27Å; Q8-S11 PolarHBondContact O-N 2.96Å; Q8-S11 PolarHBondContact O-OG 3.39Å; Q8-H12 WeakPolarHBondContact O-CB 3.43Å; Q8-H12 PolarHBondContact O-N 3.16Å; Q8-H12 PolarHBondContact OE1-ND1 3.34Å; Q8-H12 VanDerWaalsContact OE1-ND1 3.1Å; Q8-L15 HydrophobicContact CB-CD1 4.37Å
9L91.1Very high91.6Very high52 Ų52104.3 Ų104.327%0.27253%0.533SS..Hα-helixtrans-64.1-31.8176.6-77.8161.1000112.8I5 L15 I16 F19I5-L9 HydrophobicContact CG2-CD1 3.84Å; I5-L9 HydrophobicContact CG2-CG 4.45Å; I5-L9 WeakPolarHBondContact O-CG 3.42Å; I5-L9 PolarHBondContact O-N 3.09Å; L9-L15 HydrophobicContact CD2-CB 4.21Å; L9-I16 HydrophobicContact CD2-CB 4.32Å; L9-I16 HydrophobicContact CD2-CG1 3.63Å; L9-F19 HydrophobicContact CD2-CD2 3.92Å
10R91.2Very high91.8Very high186 Ų186106.4 Ų106.470%0.70254%0.539SS*.Hα-helixtrans-75.6-39.5175.4-76.4-176.2174.3-177.8-5.1112.7R6 K7 Q8R6-R10 PolarHBondContact O-N 2.98Å; K7-R10 PolarHBondContact O-N 3.38Å; Q8-R10 VanDerWaalsContact C-N 3.28Å; Q8-R10 PolarHBondContact O-N 3.27Å
11S95.4Very high92.1Very high69 Ų69108.5 Ų108.548%0.48355%0.545SS..Hα-helixtrans-78.4-27.3179.4590000112.9K7 Q8K7-S11 PolarHBondContact O-N 3.3Å; K7-S11 VanDerWaalsContact O-N 3.12Å; K7-S11 PolarHBondContact O-OG 2.89Å; Q8-S11 PolarHBondContact O-N 2.96Å; Q8-S11 PolarHBondContact O-OG 3.39Å
12H94.9Very high93Very high98 Ų98104 Ų10445%0.45452%0.524SS..  trans-131.181.1-177.2-56.8106.9000110.5Q8 A14 L15Q8-H12 WeakPolarHBondContact O-CB 3.43Å; Q8-H12 PolarHBondContact O-N 3.16Å; Q8-H12 PolarHBondContact OE1-ND1 3.34Å; Q8-H12 VanDerWaalsContact OE1-ND1 3.1Å; H12-A14 PolarHBondContact O-N 3.12Å; H12-A14 VanDerWaalsContact O-N 3.12Å; H12-L15 HydrophobicContact CB-CD1 3.82Å; H12-L15 HydrophobicContact CB-CG 3.97Å; H12-L15 WeakPolarHBondContact O-CB 3.36Å; H12-L15 PolarHBondContact O-N 3.18Å
13P93.8Very high93.5Very high87 Ų8799 Ų9957%0.56551%0.507SS*.THydrogen-bonded Turntrans-61.9-22.2-177.123-33000113.5L15 I16P13-L15 PolarHBondContact O-N 2.99Å; P13-L15 VanDerWaalsContact O-N 3.16Å; P13-I16 HydrophobicContact CB-CD1 4.22Å; P13-I16 WeakPolarHBondContact O-CB 3.47Å; P13-I16 WeakPolarHBondContact O-CG1 3.39Å; P13-I16 PolarHBondContact O-N 3.4Å; P13-I16 VanDerWaalsContact O-N 3.09Å
14A94.1Very high93.9Very high82 Ų8293.5 Ų93.568%0.67848%0.484SS*.THydrogen-bonded Turntrans-60.9-19.8173.400000113.8H12 I16 P17H12-A14 PolarHBondContact O-N 3.12Å; H12-A14 VanDerWaalsContact O-N 3.12Å; A14-I16 VanDerWaalsContact C-N 3.32Å; A14-P17 WeakPolarHBondContact O-CD 3.3Å; A14-P17 WeakPolarHBondContact O-CG 3.06Å
15L93.8Very high94.2Very high50 Ų5090.6 Ų90.626%0.26247%0.472SS..Hα-helixtrans-76.3-19176.3-63.9177.9000113.1Q8 L9 H12 P13 L18 F19Q8-L15 HydrophobicContact CB-CD1 4.37Å; L9-L15 HydrophobicContact CD2-CB 4.21Å; H12-L15 HydrophobicContact CB-CD1 3.82Å; H12-L15 HydrophobicContact CB-CG 3.97Å; H12-L15 WeakPolarHBondContact O-CB 3.36Å; H12-L15 PolarHBondContact O-N 3.18Å; P13-L15 PolarHBondContact O-N 2.99Å; P13-L15 VanDerWaalsContact O-N 3.16Å; L15-L18 HydrophobicContact CD2-CD2 4.08Å; L15-L18 WeakPolarHBondContact O-CB 3.35Å; L15-L18 PolarHBondContact O-N 3.16Å; L15-F19 HydrophobicContact CB-CD2 4.05Å; L15-F19 HydrophobicContact CB-CE2 4.05Å; L15-F19 HydrophobicContact CD1-CE2 4.45Å; L15-F19 VanDerWaalsContact O-CD2 3.25Å; L15-F19 WeakPolarHBondContact O-CD2 3.46Å; L15-F19 PolarHBondContact O-N 2.75Å
16I93.3Very high94.6Very high94 Ų9490.3 Ų90.348%0.48248%0.478SS..Hα-helixtrans-57.1-55.4-179.9-62.9166000111.6L9 P13 A14 L18 F19 F20L9-I16 HydrophobicContact CD2-CB 4.32Å; L9-I16 HydrophobicContact CD2-CG1 3.63Å; P13-I16 HydrophobicContact CB-CD1 4.22Å; P13-I16 WeakPolarHBondContact O-CB 3.47Å; P13-I16 WeakPolarHBondContact O-CG1 3.39Å; P13-I16 PolarHBondContact O-N 3.4Å; P13-I16 VanDerWaalsContact O-N 3.09Å; A14-I16 VanDerWaalsContact C-N 3.32Å; I16-L18 VanDerWaalsContact C-N 3.28Å; I16-L18 PolarHBondContact O-N 2.85Å; I16-F19 PolarHBondContact O-N 3.25Å; I16-F20 WeakPolarHBondContact O-CB 3.47Å; I16-F20 PolarHBondContact O-N 3Å
17P96.2Very high94.9Very high68 Ų6886.1 Ų86.144%0.44248%0.475SS..Hα-helixtrans-62.1-35.9178.422.9-34.1000112.5A14 F20 F21A14-P17 WeakPolarHBondContact O-CD 3.3Å; A14-P17 WeakPolarHBondContact O-CG 3.06Å; P17-F20 WeakPolarHBondContact O-CB 3.35Å; P17-F20 PolarHBondContact O-N 3.49Å; P17-F21 HydrophobicContact CB-CE2 4.42Å; P17-F21 WeakPolarHBondContact O-CD2 3.35Å; P17-F21 PolarHBondContact O-N 3.29Å
18L94.9Very high95.2Very high93 Ų9384.7 Ų84.749%0.48747%0.472SS..Hα-helixtrans-60.1-53177.2179.166.5000111.7L15 I16 F20 F21 I22L15-L18 HydrophobicContact CD2-CD2 4.08Å; L15-L18 WeakPolarHBondContact O-CB 3.35Å; L15-L18 PolarHBondContact O-N 3.16Å; I16-L18 VanDerWaalsContact C-N 3.28Å; I16-L18 PolarHBondContact O-N 2.85Å; L18-F20 VanDerWaalsContact C-N 3.28Å; L18-F20 PolarHBondContact O-N 3.38Å; L18-F21 PolarHBondContact O-N 2.79Å; L18-I22 HydrophobicContact CD1-CD1 3.9Å; L18-I22 HydrophobicContact CG-CD1 3.88Å; L18-I22 VanDerWaalsContact O-CG1 3.3Å; L18-I22 WeakPolarHBondContact O-CG1 3.25Å; L18-I22 PolarHBondContact O-N 2.97Å
19F93.3Very high95.5Very high91 Ų9184.1 Ų84.140%0.39948%0.477SS..Hα-helixtrans-66.5-31.2178.4-78.4-66.5000112.6L9 L15 I16 G23L9-F19 HydrophobicContact CD2-CD2 3.92Å; L15-F19 HydrophobicContact CB-CD2 4.05Å; L15-F19 HydrophobicContact CB-CE2 4.05Å; L15-F19 HydrophobicContact CD1-CE2 4.45Å; L15-F19 VanDerWaalsContact O-CD2 3.25Å; L15-F19 WeakPolarHBondContact O-CD2 3.46Å; L15-F19 PolarHBondContact O-N 2.75Å; I16-F19 PolarHBondContact O-N 3.25Å; F19-G23 PolarHBondContact O-N 3.48Å
20F96.1Very high95.9Very high146 Ų14687.4 Ų87.464%0.6449%0.494SS*.Hα-helixtrans-61.4-49.8174.1178.4-96.5000111.6I16 P17 L18 G24I16-F20 WeakPolarHBondContact O-CB 3.47Å; I16-F20 PolarHBondContact O-N 3Å; P17-F20 WeakPolarHBondContact O-CB 3.35Å; P17-F20 PolarHBondContact O-N 3.49Å; L18-F20 VanDerWaalsContact C-N 3.28Å; L18-F20 PolarHBondContact O-N 3.38Å; F20-G24 WeakPolarHBondContact O-CA 3.43Å; F20-G24 PolarHBondContact O-N 2.93Å
21F97.3Very high96.1Very high151 Ų15184.7 Ų84.766%0.66249%0.491SS*.Hα-helixtrans-68.9-38179.7-71.6-62.5000112.9P17 L18 G25P17-F21 HydrophobicContact CB-CE2 4.42Å; P17-F21 WeakPolarHBondContact O-CD2 3.35Å; P17-F21 PolarHBondContact O-N 3.29Å; L18-F21 PolarHBondContact O-N 2.79Å; F21-G25 PolarHBondContact O-N 3.44Å
22I96.7Very high96.2Very high99 Ų9986.7 Ų86.751%0.50849%0.489SS..Hα-helixtrans-64.8-52.2176-66.3168.3000110.4L18 G25 A26L18-I22 HydrophobicContact CD1-CD1 3.9Å; L18-I22 HydrophobicContact CG-CD1 3.88Å; L18-I22 VanDerWaalsContact O-CG1 3.3Å; L18-I22 WeakPolarHBondContact O-CG1 3.25Å; L18-I22 PolarHBondContact O-N 2.97Å; I22-G25 PolarHBondContact O-N 2.93Å; I22-A26 WeakPolarHBondContact O-CB 3.35Å; I22-A26 PolarHBondContact O-N 3.37Å
23G96.6Very high96.2Very high40 Ų4087.3 Ų87.341%0.41250%0.495SS..Hα-helixtrans-63.4-44.2-179.700000111.8F19 A26 A27F19-G23 PolarHBondContact O-N 3.48Å; G23-A26 PolarHBondContact O-N 3.42Å; G23-A27 VanDerWaalsContact O-CB 3.26Å; G23-A27 WeakPolarHBondContact O-CB 3.44Å; G23-A27 PolarHBondContact O-N 2.96Å
24G97.9Very high96.4Very high25 Ų2585.6 Ų85.626%0.25849%0.488SS..Hα-helixtrans-60.2-47.9175.200000112F20 A27 M28F20-G24 WeakPolarHBondContact O-CA 3.43Å; F20-G24 PolarHBondContact O-N 2.93Å; G24-A27 PolarHBondContact O-N 2.86Å; G24-M28 WeakPolarHBondContact O-CB 3.35Å; G24-M28 WeakPolarHBondContact O-CE 3.34Å; G24-M28 VanDerWaalsContact O-CG 3.27Å; G24-M28 WeakPolarHBondContact O-CG 3.27Å; G24-M28 PolarHBondContact O-N 3.44Å
25G98.3Very high96.4Very high27 Ų2783.5 Ų83.528%0.27846%0.463SS..Hα-helixtrans-61-45.817800000113F21 I22 S29F21-G25 PolarHBondContact O-N 3.44Å; I22-G25 PolarHBondContact O-N 2.93Å; G25-S29 WeakPolarHBondContact O-CB 3.37Å; G25-S29 PolarHBondContact O-N 3.14Å; G25-S29 PolarHBondContact O-OG 3.4Å
26A98.1Very high96.4Very high52 Ų5283.8 Ų83.843%0.4346%0.464SS..Hα-helixtrans-63.6-46.6177.300000111.8I22 G23 S29 L30I22-A26 WeakPolarHBondContact O-CB 3.35Å; I22-A26 PolarHBondContact O-N 3.37Å; G23-A26 PolarHBondContact O-N 3.42Å; A26-S29 PolarHBondContact O-N 3.42Å; A26-L30 WeakPolarHBondContact O-CG 3.42Å; A26-L30 PolarHBondContact O-N 2.89Å
27A98Very high96.3Very high59 Ų5980.2 Ų80.249%0.48845%0.45SS..Hα-helixtrans-62.9-45.8178.700000112G23 G24 S29 L30 M31G23-A27 VanDerWaalsContact O-CB 3.26Å; G23-A27 WeakPolarHBondContact O-CB 3.44Å; G23-A27 PolarHBondContact O-N 2.96Å; G24-A27 PolarHBondContact O-N 2.86Å; A27-S29 VanDerWaalsContact C-N 3.34Å; A27-S29 PolarHBondContact O-N 3Å; A27-L30 PolarHBondContact O-N 3.42Å; A27-M31 VanDerWaalsContact O-CB 3.29Å; A27-M31 WeakPolarHBondContact O-CB 3.26Å; A27-M31 PolarHBondContact O-N 3.02Å
28M97.6Very high96.1Very high127 Ų12783.1 Ų83.163%0.62646%0.461SS*.Hα-helixtrans-62.4-40.5177.1-74.4-172.8-67.700112.1G24 M31 Y32G24-M28 WeakPolarHBondContact O-CB 3.35Å; G24-M28 WeakPolarHBondContact O-CE 3.34Å; G24-M28 VanDerWaalsContact O-CG 3.27Å; G24-M28 WeakPolarHBondContact O-CG 3.27Å; G24-M28 PolarHBondContact O-N 3.44Å; M28-M31 PolarHBondContact O-N 2.89Å; M28-Y32 WeakPolarHBondContact O-CB 3.29Å; M28-Y32 PolarHBondContact O-N 2.88Å
29S97.6Very high95.9Very high70 Ų7087.1 Ų87.149%0.4947%0.47SS..Hα-helixtrans-63.3-48.1178.1-59.50000111.5G25 A26 A27 Y32 L33G25-S29 WeakPolarHBondContact O-CB 3.37Å; G25-S29 PolarHBondContact O-N 3.14Å; G25-S29 PolarHBondContact O-OG 3.4Å; A26-S29 PolarHBondContact O-N 3.42Å; A27-S29 VanDerWaalsContact C-N 3.34Å; A27-S29 PolarHBondContact O-N 3Å; S29-Y32 PolarHBondContact O-N 3.46Å; S29-L33 WeakPolarHBondContact O-CG 3.4Å; S29-L33 PolarHBondContact O-N 2.56Å
30L98.1Very high95.7Very high121 Ų12184.4 Ų84.463%0.63446%0.46SS*.Hα-helixtrans-62.4-44.5176.9-72.3170.8000111.8A26 A27 Y32 L33 A34A26-L30 WeakPolarHBondContact O-CG 3.42Å; A26-L30 PolarHBondContact O-N 2.89Å; A27-L30 PolarHBondContact O-N 3.42Å; L30-Y32 VanDerWaalsContact C-N 3.32Å; L30-Y32 PolarHBondContact O-N 3.36Å; L30-L33 PolarHBondContact O-N 3.22Å; L30-A34 WeakPolarHBondContact O-CB 3.49Å; L30-A34 PolarHBondContact O-N 3.42Å
31M97.1Very high95.4Very high129 Ų12978.1 Ų78.164%0.63543%0.434SS*.Hα-helixtrans-59.2-44.3176.7-178.5-173.2176.900111.4A27 M28 A34 R35A27-M31 VanDerWaalsContact O-CB 3.29Å; A27-M31 WeakPolarHBondContact O-CB 3.26Å; A27-M31 PolarHBondContact O-N 3.02Å; M28-M31 PolarHBondContact O-N 2.89Å; M31-A34 PolarHBondContact O-N 3.3Å; M31-R35 VanDerWaalsContact O-CB 3.3Å; M31-R35 WeakPolarHBondContact O-CB 3.3Å; M31-R35 PolarHBondContact O-N 3.43Å
32Y96Very high95Very high112 Ų11276.4 Ų76.444%0.43943%0.432SS..Hα-helixtrans-67.4-42.5-179.1-174.5-116.5000112M28 S29 L30 R35 L36 F65M28-Y32 WeakPolarHBondContact O-CB 3.29Å; M28-Y32 PolarHBondContact O-N 2.88Å; S29-Y32 PolarHBondContact O-N 3.46Å; L30-Y32 VanDerWaalsContact C-N 3.32Å; L30-Y32 PolarHBondContact O-N 3.36Å; Y32-R35 PolarHBondContact O-N 2.99Å; Y32-L36 HydrophobicContact CD1-CD1 3.85Å; Y32-L36 HydrophobicContact CD1-CG 4.42Å; Y32-L36 HydrophobicContact CE1-CD1 3.46Å; Y32-L36 VanDerWaalsContact CE1-CD1 3.46Å; Y32-L36 HydrophobicContact CE1-CG 4.09Å; Y32-L36 HydrophobicContact CE2-CD2 4.45Å; Y32-L36 HydrophobicContact CE2-CG 4.32Å; Y32-L36 WeakPolarHBondContact O-CG 3.25Å; Y32-L36 PolarHBondContact O-N 3.5Å; Y32-F65 HydrophobicContact CE2-CB 4.41Å
33L96.4Very high94.7Very high111 Ų11174.1 Ų74.158%0.58142%0.422SS*.Hα-helixtrans-61-46.3173.9-71.8174.7000111.9S29 L30 R35 L36 G37S29-L33 WeakPolarHBondContact O-CG 3.4Å; S29-L33 PolarHBondContact O-N 2.56Å; L30-L33 PolarHBondContact O-N 3.22Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.23Å; L33-L36 PolarHBondContact O-N 3.33Å; L33-G37 PolarHBondContact O-N 3.48Å
34A96.3Very high94.4Very high51 Ų5173.8 Ų73.842%0.42141%0.413SS..Hα-helixtrans-59.4-43.9176.300000111.3L30 M31 L36 G37 L38L30-A34 WeakPolarHBondContact O-CB 3.49Å; L30-A34 PolarHBondContact O-N 3.42Å; M31-A34 PolarHBondContact O-N 3.3Å; A34-L36 PolarHBondContact O-N 3.2Å; A34-G37 PolarHBondContact O-N 3.41Å; A34-L38 WeakPolarHBondContact O-CB 2.96Å; A34-L38 VanDerWaalsContact O-CG 3.25Å; A34-L38 WeakPolarHBondContact O-CG 3.38Å; A34-L38 PolarHBondContact O-N 2.88Å
35R94.4Very high94.1Very high38 Ų3881.1 Ų81.114%0.14343%0.433CS..Hα-helixtrans-62.4-41.3176.2173.6-90.4-178.7-158.2-10.2112.1M31 Y32 L33 R39 Y63 K64M31-R35 VanDerWaalsContact O-CB 3.3Å; M31-R35 WeakPolarHBondContact O-CB 3.3Å; M31-R35 PolarHBondContact O-N 3.43Å; Y32-R35 PolarHBondContact O-N 2.99Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.23Å; R35-R39 WeakPolarHBondContact O-CB 3.37Å; R35-R39 PolarHBondContact O-N 3.31Å; R35-Y63 PolarHBondContact NH2-O 2.92Å; R35-K64 VanDerWaalsContact NH2-CA 3.32Å
36L93.4Very high93.7Very high55 Ų5582.8 Ų82.829%0.28844%0.436SS..Hα-helixtrans-63.7-45.3176.1-75.1173.6000111Y32 L33 A34 N40Y32-L36 HydrophobicContact CD1-CD1 3.85Å; Y32-L36 HydrophobicContact CD1-CG 4.42Å; Y32-L36 HydrophobicContact CE1-CD1 3.46Å; Y32-L36 VanDerWaalsContact CE1-CD1 3.46Å; Y32-L36 HydrophobicContact CE1-CG 4.09Å; Y32-L36 HydrophobicContact CE2-CD2 4.45Å; Y32-L36 HydrophobicContact CE2-CG 4.32Å; Y32-L36 WeakPolarHBondContact O-CG 3.25Å; Y32-L36 PolarHBondContact O-N 3.5Å; L33-L36 PolarHBondContact O-N 3.33Å; A34-L36 PolarHBondContact O-N 3.2Å; L36-N40 WeakPolarHBondContact O-CB 3.27Å; L36-N40 PolarHBondContact O-N 2.91Å
37G92.8Very high93.3Very high19 Ų1990.5 Ų90.520%0.19645%0.454CS..Hα-helixtrans-62.8-45.8177.600000112.5L33 A34 V43 W45L33-G37 PolarHBondContact O-N 3.48Å; A34-G37 PolarHBondContact O-N 3.41Å; G37-V43 WeakPolarHBondContact O-CG1 3.35Å; G37-W45 PolarHBondContact O-NE1 2.91Å
38L91.7Very high92.9Very high129 Ų12996.4 Ų96.468%0.67547%0.469SS*.Hα-helixtrans-84.6-27.5-170.2-65172.9000114.6A34A34-L38 WeakPolarHBondContact O-CB 2.96Å; A34-L38 VanDerWaalsContact O-CG 3.25Å; A34-L38 WeakPolarHBondContact O-CG 3.38Å; A34-L38 PolarHBondContact O-N 2.88Å
39R89.3Confident92.5Very high177 Ų17796 Ų9667%0.66847%0.469SS*.Hα-helixtrans-115.6-4.1-173.1-61.5-167.4175.7-172.2-0.2114.4R35 P41R35-R39 WeakPolarHBondContact O-CB 3.37Å; R35-R39 PolarHBondContact O-N 3.31Å; R39-P41 WeakPolarHBondContact O-CD 3.39Å
40N89.9Confident92Very high34 Ų3494.6 Ų94.618%0.18246%0.456CS..  trans-77.9122.2175.5-172.512.7000110.1L36 D42 V43 Y63L36-N40 WeakPolarHBondContact O-CB 3.27Å; L36-N40 PolarHBondContact O-N 2.91Å; N40-D42 PolarHBondContact ND2-OD2 2.59Å; N40-D42 PolarHBondContact O-N 2.73Å; N40-D42 VanDerWaalsContact O-N 3.16Å; N40-D42 PolarHBondContact OD1-N 3.44Å; N40-D42 PolarHBondContact OD1-OD2 3.1Å; N40-V43 HydrophobicContact CB-CG2 4.12Å; N40-V43 PolarHBondContact O-N 3.49Å; N40-Y63 WeakPolarHBondContact OD1-CE2 3.06Å
41P89.9Confident91.5Very high15 Ų1592.1 Ų92.110%0.09745%0.447CS..THydrogen-bonded Turntrans-57.3-25.6175.917-30000114.8R39 V43 W54 L57 Y63R39-P41 WeakPolarHBondContact O-CD 3.39Å; P41-V43 PolarHBondContact O-N 2.91Å; P41-W54 HydrophobicContact CB-CB 4.07Å; P41-L57 HydrophobicContact CB-CD1 3.52Å; P41-L57 HydrophobicContact CG-CD1 3.66Å; P41-Y63 HydrophobicContact CG-CD2 4.34Å; P41-Y63 HydrophobicContact CG-CE2 4.38Å; P41-Y63 HydrophobicContact CG-CG 4.42Å
42D88.2Confident91.2Very high115 Ų11590.3 Ų90.362%0.61544%0.437SS*.THydrogen-bonded Turntrans-70.2-13.3178.6-51.3-38.1000112.6N40N40-D42 PolarHBondContact ND2-OD2 2.59Å; N40-D42 PolarHBondContact O-N 2.73Å; N40-D42 VanDerWaalsContact O-N 3.16Å; N40-D42 PolarHBondContact OD1-N 3.44Å; N40-D42 PolarHBondContact OD1-OD2 3.1Å
43V91.1Very high90.8Very high50 Ų5085.9 Ų85.930%0.30342%0.422SS..  trans-102.2112.2179.7-174.80000109.3G37 N40 P41 W45G37-V43 WeakPolarHBondContact O-CG1 3.35Å; N40-V43 HydrophobicContact CB-CG2 4.12Å; N40-V43 PolarHBondContact O-N 3.49Å; P41-V43 PolarHBondContact O-N 2.91Å; V43-W45 HydrophobicContact CG1-CD2 4.34Å; V43-W45 HydrophobicContact CG1-CZ2 3.88Å
44S91Very high90.3Very high33 Ų3386 Ų8623%0.23142%0.415CS..  trans-100108.8176.9-172.30000111.3P51S44-P51 WeakPolarHBondContact CB-O 3.47Å; S44-P51 PolarHBondContact OG-O 3.04Å
45W91.4Very high89.8Confident180 Ų18087.6 Ų87.668%0.68242%0.416SS*.SBendtrans-89.3-36.4174.5-64.2104.3000112.6G37 V43G37-W45 PolarHBondContact O-NE1 2.91Å; V43-W45 HydrophobicContact CG1-CD2 4.34Å; V43-W45 HydrophobicContact CG1-CZ2 3.88Å
46D90Very high89.3Confident62 Ų6292.6 Ų92.633%0.33244%0.439SS..  trans-102.992.3178.1-178-3.4000110.3K48 N49 N50D46-K48 PolarHBondContact O-N 3.28Å; D46-K48 PolarHBondContact OD1-N 3.21Å; D46-N49 PolarHBondContact OD1-N 2.99Å; D46-N49 PolarHBondContact OD1-ND2 3.16Å; D46-N49 VanDerWaalsContact OD2-CB 3.29Å; D46-N49 WeakPolarHBondContact OD2-CB 3.29Å; D46-N49 PolarHBondContact OD2-ND2 3.26Å; D46-N50 HydrophobicContact CB-CB 4.29Å; D46-N50 CarbonylContact O-C 2.91Å; D46-N50 WeakPolarHBondContact O-CA 3.48Å; D46-N50 PolarHBondContact O-N 3.32Å
47R88.6Confident89Confident214 Ų21493 Ų9381%0.80844%0.441SS*.THydrogen-bonded Turntrans-74.7-9.2179.9-60.6-177.9-175162.80.3114
48K89.9Confident88.8Confident183 Ų18395.5 Ų95.580%0.79646%0.455SS*.THydrogen-bonded Turntrans-101.3-50.5-173.9-171.6178.5179.4-177.50111.9D46D46-K48 PolarHBondContact O-N 3.28Å; D46-K48 PolarHBondContact OD1-N 3.21Å
49N88.8Confident88.6Confident117 Ų11791.8 Ų91.863%0.62644%0.439SS*.THydrogen-bonded Turntrans-102.8-15.2-176-38.2-70.9000112.9D46D46-N49 PolarHBondContact OD1-N 2.99Å; D46-N49 PolarHBondContact OD1-ND2 3.16Å; D46-N49 VanDerWaalsContact OD2-CB 3.29Å; D46-N49 WeakPolarHBondContact OD2-CB 3.29Å; D46-N49 PolarHBondContact OD2-ND2 3.26Å
50N86.9Confident88.7Confident42 Ų4286.8 Ų86.823%0.22543%0.426CS..  trans-144.454.8178.6-16546.2000112.6D46 E52 K56D46-N50 HydrophobicContact CB-CB 4.29Å; D46-N50 CarbonylContact O-C 2.91Å; D46-N50 WeakPolarHBondContact O-CA 3.48Å; D46-N50 PolarHBondContact O-N 3.32Å; N50-E52 PolarHBondContact O-N 2.76Å; N50-E52 VanDerWaalsContact O-N 3.12Å; N50-K56 VanDerWaalsContact OD1-CD 3.25Å; N50-K56 WeakPolarHBondContact OD1-CD 3.47Å; N50-K56 WeakPolarHBondContact OD1-CE 3.47Å; N50-K56 PolarHBondContact OD1-NZ 3.25Å
51P89.1Confident88.7Confident69 Ų6990.7 Ų90.745%0.44844%0.439SS..SBendtrans-58.8-29.8-173.823.7-33.5000112.8S44 P53S44-P51 WeakPolarHBondContact CB-O 3.47Å; S44-P51 PolarHBondContact OG-O 3.04Å; P51-P53 WeakPolarHBondContact O-CD 3.38Å
52E89.5Confident88.7Confident90 Ų9093.8 Ų93.842%0.42145%0.452SS..  trans-120.379.8-177.2-60.6-173121.400110.9N50 W54 N55N50-E52 PolarHBondContact O-N 2.76Å; N50-E52 VanDerWaalsContact O-N 3.12Å; E52-W54 HydrophobicContact CB-CD2 4.3Å; E52-W54 HydrophobicContact CB-CH2 4.2Å; E52-W54 HydrophobicContact CB-CZ2 3.61Å; E52-W54 HydrophobicContact CG-CH2 4.1Å; E52-W54 HydrophobicContact CG-CZ2 3.54Å; E52-W54 PolarHBondContact O-N 3.27Å; E52-W54 VanDerWaalsContact O-N 3.11Å; E52-N55 WeakPolarHBondContact CB-ND2 3.44Å; E52-N55 PolarHBondContact O-N 3.21Å; E52-N55 VanDerWaalsContact O-N 3.1Å; E52-N55 PolarHBondContact OE2-ND2 3.32Å
53P88.3Confident88.7Confident20 Ų2091.8 Ų91.813%0.1344%0.436CS..G310 helixtrans-58.7-29.2-173.4-2432.8000114.1P51 N55 K56P51-P53 WeakPolarHBondContact O-CD 3.38Å; P53-N55 VanDerWaalsContact C-N 3.26Å; P53-N55 PolarHBondContact O-N 3.07Å; P53-K56 PolarHBondContact O-N 2.74Å
54W86.7Confident88.6Confident114 Ų11494.1 Ų94.143%0.43244%0.442SS..G310 helixtrans-63.2-27.3178.854.182.3000113.6P41 E52 K56 L57P41-W54 HydrophobicContact CB-CB 4.07Å; E52-W54 HydrophobicContact CB-CD2 4.3Å; E52-W54 HydrophobicContact CB-CH2 4.2Å; E52-W54 HydrophobicContact CB-CZ2 3.61Å; E52-W54 HydrophobicContact CG-CH2 4.1Å; E52-W54 HydrophobicContact CG-CZ2 3.54Å; E52-W54 PolarHBondContact O-N 3.27Å; E52-W54 VanDerWaalsContact O-N 3.11Å; W54-K56 PolarHBondContact O-N 3.26Å; W54-L57 PolarHBondContact O-N 2.97Å; W54-L57 VanDerWaalsContact O-N 3.11Å
55N85.7Confident88.6Confident83 Ų8397.5 Ų97.544%0.44445%0.453SS..G310 helixtrans-64.8-24-179.1-71.3-13.2000112.8E52 P53E52-N55 WeakPolarHBondContact CB-ND2 3.44Å; E52-N55 PolarHBondContact O-N 3.21Å; E52-N55 VanDerWaalsContact O-N 3.1Å; E52-N55 PolarHBondContact OE2-ND2 3.32Å; P53-N55 VanDerWaalsContact C-N 3.26Å; P53-N55 PolarHBondContact O-N 3.07Å
56K83.4Confident88.6Confident144 Ų14496.1 Ų96.163%0.62645%0.452SS*.G310 helixtrans-88.4-2.6179.2-64.9-177.8179.61640113.4N50 P53 W54N50-K56 VanDerWaalsContact OD1-CD 3.25Å; N50-K56 WeakPolarHBondContact OD1-CD 3.47Å; N50-K56 WeakPolarHBondContact OD1-CE 3.47Å; N50-K56 PolarHBondContact OD1-NZ 3.25Å; P53-K56 PolarHBondContact O-N 2.74Å; W54-K56 PolarHBondContact O-N 3.26Å
57L87.1Confident88.5Confident64 Ų6496 Ų9634%0.33545%0.454SS..  trans-92.9131.4-177.5-64.1-178.9000111.3P41 W54 Y61P41-L57 HydrophobicContact CB-CD1 3.52Å; P41-L57 HydrophobicContact CG-CD1 3.66Å; W54-L57 PolarHBondContact O-N 2.97Å; W54-L57 VanDerWaalsContact O-N 3.11Å; L57-Y61 HydrophobicContact CD1-CD1 4.26Å; L57-Y61 HydrophobicContact CD2-CD1 3.54Å; L57-Y61 HydrophobicContact CD2-CE1 3.69Å; L57-Y61 HydrophobicContact CD2-CG 4.05Å; L57-Y61 HydrophobicContact CG-CD1 4.35Å
58S87.7Confident88.6Confident70 Ų7091.8 Ų91.849%0.4945%0.452SS..  trans-67.6146.8170.1173.20000110.3N60 Y61S58-N60 PolarHBondContact O-N 3.25Å; S58-N60 PolarHBondContact OG-N 3.04Å; S58-Y61 WeakPolarHBondContact O-CB 3.48Å; S58-Y61 PolarHBondContact O-N 3.33Å
59P88.1Confident88.7Confident52 Ų5290.6 Ų90.634%0.33845%0.454SS..THydrogen-bonded Turntrans-52.7-28.9171.2-24.131.5000113.4Y61 L75 K77P59-Y61 VanDerWaalsContact C-N 3.29Å; P59-L75 HydrophobicContact CB-CB 4.4Å; P59-L75 WeakPolarHBondContact O-CB 3.29Å; P59-L75 VanDerWaalsContact O-CD1 3.29Å; P59-L75 WeakPolarHBondContact O-CD1 2.97Å; P59-K77 HydrophobicContact CG-CB 3.61Å; P59-K77 HydrophobicContact CG-CG 4.05Å
60N90.9Very high88.7Confident72 Ų7289.8 Ų89.839%0.38545%0.447SS..THydrogen-bonded Turntrans-89.73.5-178.1-61.1-1.3000112.5S58 Q62 Y72 L75S58-N60 PolarHBondContact O-N 3.25Å; S58-N60 PolarHBondContact OG-N 3.04Å; N60-Q62 PolarHBondContact O-N 3.11Å; N60-Y72 VanDerWaalsContact CA-O 3.29Å; N60-Y72 WeakPolarHBondContact CA-O 3.15Å; N60-Y72 VanDerWaalsContact CB-O 3.27Å; N60-Y72 WeakPolarHBondContact CB-O 3.41Å; N60-Y72 WeakPolarHBondContact O-CB 3.29Å; N60-Y72 PolarHBondContact OD1-O 2.91Å; N60-L75 PolarHBondContact OD1-O 2.94Å
61Y89.9Confident88.9Confident115 Ų11591.1 Ų91.145%0.45145%0.454SS..  trans-77.8110.1-178.2-174.2-101.5000111.1L57 S58 P59 Y63 Y72L57-Y61 HydrophobicContact CD1-CD1 4.26Å; L57-Y61 HydrophobicContact CD2-CD1 3.54Å; L57-Y61 HydrophobicContact CD2-CE1 3.69Å; L57-Y61 HydrophobicContact CD2-CG 4.05Å; L57-Y61 HydrophobicContact CG-CD1 4.35Å; S58-Y61 WeakPolarHBondContact O-CB 3.48Å; S58-Y61 PolarHBondContact O-N 3.33Å; P59-Y61 VanDerWaalsContact C-N 3.29Å; Y61-Y63 VanDerWaalsContact CE1-CB 3.46Å; Y61-Y63 PolarHBondContact O-N 3.1Å; Y61-Y72 WeakPolarHBondContact O-CE1 3.36Å
62Q90.3Very high89Confident80 Ų8089 Ų8937%0.37444%0.438SS..  trans-77.988.4171.4-175.4-162.5-59.300110.5N60 K64 T67 Y72N60-Q62 PolarHBondContact O-N 3.11Å; Q62-K64 VanDerWaalsContact C-N 3.33Å; Q62-K64 PolarHBondContact NE2-O 3.2Å; Q62-T67 HydrophobicContact CG-CG2 3.35Å; Q62-T67 PolarHBondContact OE1-OG1 3.35Å; Q62-Y72 HydrophobicContact CB-CD1 4Å; Q62-Y72 HydrophobicContact CB-CD2 4.01Å; Q62-Y72 HydrophobicContact CB-CE1 4.14Å; Q62-Y72 HydrophobicContact CB-CE2 4.19Å; Q62-Y72 HydrophobicContact CB-CG 3.91Å; Q62-Y72 HydrophobicContact CG-CD2 4.06Å; Q62-Y72 HydrophobicContact CG-CE1 4.4Å; Q62-Y72 HydrophobicContact CG-CE2 3.85Å; Q62-Y72 HydrophobicContact CG-CG 4.46Å
63Y88.1Confident89Confident73 Ų7388.7 Ų88.729%0.28645%0.446SS..  trans-77-18.6174.684.9-83000113.2R35 N40 P41 Y61R35-Y63 PolarHBondContact NH2-O 2.92Å; N40-Y63 WeakPolarHBondContact OD1-CE2 3.06Å; P41-Y63 HydrophobicContact CG-CD2 4.34Å; P41-Y63 HydrophobicContact CG-CE2 4.38Å; P41-Y63 HydrophobicContact CG-CG 4.42Å; Y61-Y63 VanDerWaalsContact CE1-CB 3.46Å; Y61-Y63 PolarHBondContact O-N 3.1Å
64K90.1Very high89.2Confident100 Ų10095.1 Ų95.144%0.43547%0.471SS..SBendtrans-71.3153.7-177.5-67.9-177-177.5174.50112.3R35 Q62 F66R35-K64 VanDerWaalsContact NH2-CA 3.32Å; Q62-K64 VanDerWaalsContact C-N 3.33Å; Q62-K64 PolarHBondContact NE2-O 3.2Å; K64-F66 VanDerWaalsContact C-N 3.35Å; K64-F66 PolarHBondContact O-N 3.11Å
65F90.2Very high89.3Confident104 Ų10492.8 Ų92.846%0.45647%0.467SS..SBendtrans-69.8-37.9-171.3-170.8-117.1000110.9Y32Y32-F65 HydrophobicContact CE2-CB 4.41Å
66F90.3Very high89.4Confident151 Ų15197.7 Ų97.766%0.66249%0.485SS*.  trans-136.8155169.2-59-64.3000110.2K64K64-F66 VanDerWaalsContact C-N 3.35Å; K64-F66 PolarHBondContact O-N 3.11Å
67T89.8Confident89.4Confident59 Ų5996.1 Ų96.136%0.36248%0.478SS..  trans-113.2129.717140.50000109.1Q62 Y72Q62-T67 HydrophobicContact CG-CG2 3.35Å; Q62-T67 PolarHBondContact OE1-OG1 3.35Å; T67-Y72 HydrophobicContact CG2-CD2 3.8Å; T67-Y72 HydrophobicContact CG2-CE2 3.25Å
68V90.1Very high89.3Confident126 Ų126100.3 Ų100.376%0.76450%0.5SS*.SBendtrans-102.6-54.8-177.4-172.30000109.5
69N90.9Very high88.9Confident158 Ų158106.2 Ų106.285%0.84551%0.512SS*.SBendtrans-1281.7-171.2-62.6-33.6000114.5
70M89.6Confident88.5Confident99 Ų99108.9 Ų108.949%0.48853%0.529SS..  trans-108.3122-171-176.1170.9-79.800111Y72 L75M70-Y72 HydrophobicContact CB-CD2 4.36Å; M70-Y72 HydrophobicContact CB-CE2 3.91Å; M70-Y72 HydrophobicContact CG-CD2 3.99Å; M70-Y72 HydrophobicContact CG-CE2 3.71Å; M70-Y72 WeakPolarHBondContact O-CD2 3.47Å; M70-Y72 PolarHBondContact O-N 2.55Å; M70-Y72 HydrophobicContact SD-CE1 4.3Å; M70-Y72 HydrophobicContact SD-CE2 3.82Å; M70-L75 HydrophobicContact SD-CD1 4.29Å
71D91.5Very high87.8Confident70 Ų70111.9 Ų111.937%0.37455%0.546SS..  trans-91.598.3173.5-175.4-5.8000109.9S73 K74D71-S73 PolarHBondContact O-N 3.12Å; D71-S73 WeakPolarHBondContact OD1-CB 3.27Å; D71-S73 PolarHBondContact OD1-N 3.25Å; D71-S73 VanDerWaalsContact OD1-N 3.1Å; D71-S73 PolarHBondContact OD1-OG 3.32Å; D71-K74 HydrophobicContact CB-CD 4.29Å; D71-K74 PolarHBondContact O-N 2.92Å; D71-K74 VanDerWaalsContact OD2-CD 3.27Å; D71-K74 WeakPolarHBondContact OD2-CD 3.48Å; D71-K74 WeakPolarHBondContact OD2-CE 3.39Å; D71-K74 IonicContact OD2-NZ 2.73Å; D71-K74 PolarHBondContact OD2-NZ 2.85Å
72Y90.8Very high86.7Confident24 Ų24118.3 Ų118.39%0.09458%0.576CS.*G310 helixtrans-66.3-22.4-177.5-77.5-102.6000112.9N60 Y61 Q62 T67 M70 K74 L75N60-Y72 VanDerWaalsContact CA-O 3.29Å; N60-Y72 WeakPolarHBondContact CA-O 3.15Å; N60-Y72 VanDerWaalsContact CB-O 3.27Å; N60-Y72 WeakPolarHBondContact CB-O 3.41Å; N60-Y72 WeakPolarHBondContact O-CB 3.29Å; N60-Y72 PolarHBondContact OD1-O 2.91Å; Y61-Y72 WeakPolarHBondContact O-CE1 3.36Å; Q62-Y72 HydrophobicContact CB-CD1 4Å; Q62-Y72 HydrophobicContact CB-CD2 4.01Å; Q62-Y72 HydrophobicContact CB-CE1 4.14Å; Q62-Y72 HydrophobicContact CB-CE2 4.19Å; Q62-Y72 HydrophobicContact CB-CG 3.91Å; Q62-Y72 HydrophobicContact CG-CD2 4.06Å; Q62-Y72 HydrophobicContact CG-CE1 4.4Å; Q62-Y72 HydrophobicContact CG-CE2 3.85Å; Q62-Y72 HydrophobicContact CG-CG 4.46Å; T67-Y72 HydrophobicContact CG2-CD2 3.8Å; T67-Y72 HydrophobicContact CG2-CE2 3.25Å; M70-Y72 HydrophobicContact CB-CD2 4.36Å; M70-Y72 HydrophobicContact CB-CE2 3.91Å; M70-Y72 HydrophobicContact CG-CD2 3.99Å; M70-Y72 HydrophobicContact CG-CE2 3.71Å; M70-Y72 WeakPolarHBondContact O-CD2 3.47Å; M70-Y72 PolarHBondContact O-N 2.55Å; M70-Y72 HydrophobicContact SD-CE1 4.3Å; M70-Y72 HydrophobicContact SD-CE2 3.82Å; Y72-K74 PolarHBondContact O-N 2.8Å; Y72-L75 HydrophobicContact CD1-CD1 3.6Å; Y72-L75 HydrophobicContact CE1-CD1 4.1Å; Y72-L75 HydrophobicContact CG-CD1 4.03Å; Y72-L75 PolarHBondContact O-N 2.89Å
73S90Very high86.5Confident84 Ų84120.2 Ų120.259%0.58759%0.586SS**G310 helixtrans-66.7-23.218072.10000113.1D71D71-S73 PolarHBondContact O-N 3.12Å; D71-S73 WeakPolarHBondContact OD1-CB 3.27Å; D71-S73 PolarHBondContact OD1-N 3.25Å; D71-S73 VanDerWaalsContact OD1-N 3.1Å; D71-S73 PolarHBondContact OD1-OG 3.32Å
74K91.6Very high86.4Confident155 Ų155122.7 Ų122.767%0.67460%0.602SS**G310 helixtrans-94.1-5.8-178.6-65.6176.4-179.1139.30113.4D71 Y72D71-K74 HydrophobicContact CB-CD 4.29Å; D71-K74 PolarHBondContact O-N 2.92Å; D71-K74 VanDerWaalsContact OD2-CD 3.27Å; D71-K74 WeakPolarHBondContact OD2-CD 3.48Å; D71-K74 WeakPolarHBondContact OD2-CE 3.39Å; D71-K74 IonicContact OD2-NZ 2.73Å; D71-K74 PolarHBondContact OD2-NZ 2.85Å; Y72-K74 PolarHBondContact O-N 2.8Å
75L89.9Confident86.2Confident65 Ų65123.9 Ų123.934%0.3461%0.611SS.*  trans-67.6145.6177.3-66.2173.4000109.2P59 N60 M70 Y72P59-L75 HydrophobicContact CB-CB 4.4Å; P59-L75 WeakPolarHBondContact O-CB 3.29Å; P59-L75 VanDerWaalsContact O-CD1 3.29Å; P59-L75 WeakPolarHBondContact O-CD1 2.97Å; N60-L75 PolarHBondContact OD1-O 2.94Å; M70-L75 HydrophobicContact SD-CD1 4.29Å; Y72-L75 HydrophobicContact CD1-CD1 3.6Å; Y72-L75 HydrophobicContact CE1-CD1 4.1Å; Y72-L75 HydrophobicContact CG-CD1 4.03Å; Y72-L75 PolarHBondContact O-N 2.89Å
76K87.9Confident86Confident186 Ų186125.1 Ų125.181%0.80962%0.62SS**  trans-125.2152.5177.2-67-174-178.9-178.40108.5D78K76-D78 PolarHBondContact O-N 3.42Å
77K83.3Confident85.7Confident111 Ų111123.5 Ų123.548%0.48362%0.618SS.*  trans-67.7117.2172.7-162.5177.1172.7154.20108.1P59 R79 D81P59-K77 HydrophobicContact CG-CB 3.61Å; P59-K77 HydrophobicContact CG-CG 4.05Å; K77-R79 WeakPolarHBondContact CD-O 3.25Å; K77-R79 WeakPolarHBondContact CE-O 3.29Å; K77-R79 VanDerWaalsContact CG-O 3.29Å; K77-R79 WeakPolarHBondContact CG-O 3.04Å; K77-D81 IonicContact NZ-OD1 2.55Å; K77-D81 PolarHBondContact NZ-OD1 2.94Å
78D83.8Confident85.4Confident152 Ų152127.8 Ų127.881%0.81364%0.635SS**  trans-86.5-18-179.6-172.350.2000112.5K76K76-D78 PolarHBondContact O-N 3.42Å
79R80Confident85.1Confident194 Ų194127.9 Ų127.973%0.73263%0.626SS**SBendtrans-120.7155.1-172.2-61.1-178.6-176.9165.5-0.5112K77K77-R79 WeakPolarHBondContact CD-O 3.25Å; K77-R79 WeakPolarHBondContact CE-O 3.29Å; K77-R79 VanDerWaalsContact CG-O 3.29Å; K77-R79 WeakPolarHBondContact CG-O 3.04Å
80P80.1Confident84.6Confident108 Ų108125.6 Ų125.670%0.70161%0.609SS**  trans-60.8162.5174.1-19.131000112.8
81D75.8Confident84.2Confident136 Ų136127.8 Ų127.873%0.72762%0.619SS**  trans-65.5139.6163-64.8-57.3000109.8K77K77-D81 IonicContact NZ-OD1 2.55Å; K77-D81 PolarHBondContact NZ-OD1 2.94Å
82F66.3Low83.6Confident249 Ų249133.1 Ų133.1100%1.09264%0.641SS**  trans-97.40174.5-102.9-83.4000110.2

Retrieved 82 of 82 residues in 70.7 ms (Link to these results)