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NADH-ubiquinone oxidoreductase chain 4L

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) which catalyzes electron transfer from NADH through the respiratory chain, using ubiquinone as an electron acceptor. Part of the enzyme membrane arm which is embedded in the lipid bilayer and involved in proton translocation.

AlphaFold DB , UniProt , Accession A0A059RP56, Species HUMAN (Homo sapiens, Human), Gene ND4L, Length 79 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
1L40.6Very low63.7Low203 Ų20392.8 Ų92.8100%1.06346%0.46SS*.  0-21.40-115.8150.3000113.9
2V48.3Very low65.3Low131 Ų13194.4 Ų94.479%0.79447%0.471SS*.  trans-91.1-18.2-172.3-177.10000115R4V2-R4 PolarHBondContact O-N 3.45Å
3Y49.1Very low66.9Low172 Ų17293.4 Ų93.468%0.67548%0.477SS*.  trans-76.765.2166.8-95.1-88.2000110.2S5 V71Y3-S5 VanDerWaalsContact C-N 3.27Å; Y3-S5 PolarHBondContact O-N 3.39Å; Y3-V71 HydrophobicContact CD1-CG2 4.39Å
4R50.6Low68.2Low190 Ų19093.1 Ų93.172%0.71748%0.476SS*.  trans-74.389.1172.6-98.3-99.5177.4123.5-3.3107.5V2 H6V2-R4 PolarHBondContact O-N 3.45Å; R4-H6 PolarHBondContact O-N 3.41Å
5S56.3Low69.4Low35 Ų3593.1 Ų93.125%0.24547%0.473CS..SBendtrans55.3-24158.647.70000120.5Y3 D69 Y70Y3-S5 VanDerWaalsContact C-N 3.27Å; Y3-S5 PolarHBondContact O-N 3.39Å; S5-D69 CarbonylContact O-C 3.53Å; S5-Y70 WeakPolarHBondContact O-CA 3.44Å
6H66.1Low70.5Confident79 Ų7989.9 Ų89.937%0.36647%0.471SS..  trans-120.1111.4-169.4-63.9-74.1000109.4R4 M8 S9R4-H6 PolarHBondContact O-N 3.41Å; H6-M8 PolarHBondContact O-N 3.4Å; H6-M8 VanDerWaalsContact O-N 3.12Å; H6-S9 PolarHBondContact O-N 3.4Å; H6-S9 PolarHBondContact O-OG 3.07Å
7L70.5Confident71.7Confident33 Ų3390.8 Ų90.817%0.17347%0.474CS..Hα-helixtrans-56.3-26.1175-149.3151.4000111.5S9 S10 L11 L59 I62 V71L7-S9 PolarHBondContact O-N 3.33Å; L7-S10 WeakPolarHBondContact CA-OG 3.46Å; L7-S10 PolarHBondContact O-N 2.65Å; L7-S10 PolarHBondContact O-OG 3.02Å; L7-L11 HydrophobicContact CD2-CD1 4.06Å; L7-L11 HydrophobicContact CD2-CG 4.28Å; L7-L11 PolarHBondContact O-N 3.09Å; L7-L59 HydrophobicContact CB-CD1 3.76Å; L7-L59 HydrophobicContact CB-CG 4.18Å; L7-L59 HydrophobicContact CD2-CB 4.25Å; L7-L59 HydrophobicContact CD2-CD1 3.77Å; L7-L59 HydrophobicContact CD2-CG 4.17Å; L7-L59 HydrophobicContact CG-CD1 4.35Å; L7-I62 HydrophobicContact CD1-CD1 3.88Å; L7-V71 HydrophobicContact CB-CG2 4.39Å; L7-V71 HydrophobicContact CD1-CG2 4.19Å; L7-V71 HydrophobicContact CG-CG2 4.44Å
8M76.3Confident72.7Confident83 Ų8388.6 Ų88.641%0.40946%0.461SS..Hα-helixtrans-57-42.2170.5-68.7-61-71.400113.5H6 L11 L12 L56 L59H6-M8 PolarHBondContact O-N 3.4Å; H6-M8 VanDerWaalsContact O-N 3.12Å; M8-L11 PolarHBondContact O-N 3.49Å; M8-L12 PolarHBondContact O-N 3.06Å; M8-L56 HydrophobicContact CE-CD2 4.49Å; M8-L56 HydrophobicContact SD-CD2 4.26Å; M8-L59 HydrophobicContact CB-CD1 4.45Å; M8-L59 HydrophobicContact CG-CD1 3.72Å; M8-L59 HydrophobicContact CG-CD2 4.42Å; M8-L59 HydrophobicContact SD-CD1 3.32Å; M8-L59 WeakPolarHBondContact SD-CD1 3.31Å; M8-L59 HydrophobicContact SD-CD2 4.05Å; M8-L59 HydrophobicContact SD-CG 4.34Å
9S79.2Confident73.6Confident50 Ų5089.5 Ų89.535%0.3547%0.467SS..Hα-helixtrans-69.2-35.8-178.866.30000112.1H6 L7 C13H6-S9 PolarHBondContact O-N 3.4Å; H6-S9 PolarHBondContact O-OG 3.07Å; L7-S9 PolarHBondContact O-N 3.33Å; S9-C13 PolarHBondContact O-N 3.13Å; S9-C13 VanDerWaalsContact O-N 3.1Å
10S80.9Confident74.5Confident22 Ų2288.4 Ų88.415%0.15447%0.466CS..Hα-helixtrans-67.8-37172.4460000112.7L7 C13 L14L7-S10 WeakPolarHBondContact CA-OG 3.46Å; L7-S10 PolarHBondContact O-N 2.65Å; L7-S10 PolarHBondContact O-OG 3.02Å; S10-C13 PolarHBondContact O-N 3.38Å; S10-L14 PolarHBondContact O-N 3.04Å
11L82.9Confident75.2Confident23 Ų2388.2 Ų88.212%0.1247%0.466CS..Hα-helixtrans-63.6-44.9175.3-77.3165.8000111.3L7 M8 C13 L14 E15 L56 L59L7-L11 HydrophobicContact CD2-CD1 4.06Å; L7-L11 HydrophobicContact CD2-CG 4.28Å; L7-L11 PolarHBondContact O-N 3.09Å; M8-L11 PolarHBondContact O-N 3.49Å; L11-C13 VanDerWaalsContact C-N 3.32Å; L11-C13 PolarHBondContact O-N 3.22Å; L11-L14 WeakPolarHBondContact O-CB 3.5Å; L11-L14 PolarHBondContact O-N 2.95Å; L11-L14 VanDerWaalsContact O-N 3.12Å; L11-E15 PolarHBondContact O-N 3.02Å; L11-L56 HydrophobicContact CD1-CD2 3.97Å; L11-L56 HydrophobicContact CD1-CG 4.37Å; L11-L59 HydrophobicContact CD1-CB 4.44Å; L11-L59 HydrophobicContact CD1-CD1 3.5Å; L11-L59 VanDerWaalsContact CD1-CD1 3.5Å
12L83.2Confident77.6Confident112 Ų11281.8 Ų81.859%0.58643%0.429SS*.Hα-helixtrans-61.6-38.3175.4-73.8170.1000112.6M8 E15 G16M8-L12 PolarHBondContact O-N 3.06Å; L12-E15 PolarHBondContact O-N 2.96Å; L12-G16 PolarHBondContact O-N 2.89Å
13C85.8Confident79.7Confident81 Ų8179.5 Ų79.555%0.54741%0.412SS..Hα-helixtrans-64.5-39.6173.5-79.40000112.3S9 S10 L11 G16 M17S9-C13 PolarHBondContact O-N 3.13Å; S9-C13 VanDerWaalsContact O-N 3.1Å; S10-C13 PolarHBondContact O-N 3.38Å; L11-C13 VanDerWaalsContact C-N 3.32Å; L11-C13 PolarHBondContact O-N 3.22Å; C13-G16 PolarHBondContact O-N 2.92Å; C13-M17 WeakPolarHBondContact O-CG 3.39Å; C13-M17 PolarHBondContact O-N 3.08Å
14L84.6Confident81.6Confident89 Ų8976.6 Ų76.647%0.46641%0.405SS..Hα-helixtrans-62.3-45.1174.5-95.7160.1000111.6S10 L11 G16 M17 M18S10-L14 PolarHBondContact O-N 3.04Å; L11-L14 WeakPolarHBondContact O-CB 3.5Å; L11-L14 PolarHBondContact O-N 2.95Å; L11-L14 VanDerWaalsContact O-N 3.12Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 3.28Å; L14-M17 HydrophobicContact CB-CE 4.47Å; L14-M17 HydrophobicContact CD2-CE 3.76Å; L14-M17 HydrophobicContact CG-CE 3.92Å; L14-M17 PolarHBondContact O-N 3.08Å; L14-M18 WeakPolarHBondContact O-CG 3.18Å; L14-M18 PolarHBondContact O-N 3.15Å
15E86.5Confident83.4Confident93 Ų9368.9 Ų68.944%0.43538%0.383SS..Hα-helixtrans-59.1-42.3174.2-72.4-175.2167.100111.9L11 L12 M17 M18 L19L11-E15 PolarHBondContact O-N 3.02Å; L12-E15 PolarHBondContact O-N 2.96Å; E15-M17 PolarHBondContact O-N 3.08Å; E15-M18 PolarHBondContact O-N 3.27Å; E15-L19 WeakPolarHBondContact O-CB 3.47Å; E15-L19 PolarHBondContact O-N 2.98Å
16G87.8Confident84.9Confident43 Ų4368.5 Ų68.544%0.44338%0.379SS..Hα-helixtrans-60.6-41.7175.300000113.4L12 C13 L14 L19 S20L12-G16 PolarHBondContact O-N 2.89Å; C13-G16 PolarHBondContact O-N 2.92Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 3.28Å; G16-L19 PolarHBondContact O-N 3.28Å; G16-S20 PolarHBondContact O-N 2.96Å
17M89.6Confident86Confident104 Ų10469.3 Ų69.351%0.51239%0.385SS..Hα-helixtrans-64.2-45.1175.3-70.9-173.1-66.800111.8C13 L14 E15 L19 S20 L21C13-M17 WeakPolarHBondContact O-CG 3.39Å; C13-M17 PolarHBondContact O-N 3.08Å; L14-M17 HydrophobicContact CB-CE 4.47Å; L14-M17 HydrophobicContact CD2-CE 3.76Å; L14-M17 HydrophobicContact CG-CE 3.92Å; L14-M17 PolarHBondContact O-N 3.08Å; E15-M17 PolarHBondContact O-N 3.08Å; M17-L19 VanDerWaalsContact C-N 3.3Å; M17-L19 PolarHBondContact O-N 3.32Å; M17-S20 PolarHBondContact O-N 3.5Å; M17-S20 PolarHBondContact O-OG 3.31Å; M17-L21 PolarHBondContact O-N 3.02Å; M17-L21 VanDerWaalsContact O-N 3.07Å
18M90.4Very high86.8Confident51 Ų5173.1 Ų73.125%0.25140%0.403SS..Hα-helixtrans-62.3-38.5177.6-65.2-57.6-79.400112L14 E15 L21 F22 A48L14-M18 WeakPolarHBondContact O-CG 3.18Å; L14-M18 PolarHBondContact O-N 3.15Å; E15-M18 PolarHBondContact O-N 3.27Å; M18-L21 PolarHBondContact O-N 2.86Å; M18-L21 HydrophobicContact SD-CD1 4.35Å; M18-F22 PolarHBondContact O-N 3.49Å; M18-A48 HydrophobicContact CB-CB 4.11Å; M18-A48 HydrophobicContact CE-CB 3.34Å; M18-A48 HydrophobicContact CG-CB 4.12Å
19L89.6Confident87.2Confident107 Ų10770 Ų7056%0.5639%0.389SS*.Hα-helixtrans-66.4-40.2176.6-160.5149.7000111.6E15 G16 M17 L21 F22 I23E15-L19 WeakPolarHBondContact O-CB 3.47Å; E15-L19 PolarHBondContact O-N 2.98Å; G16-L19 PolarHBondContact O-N 3.28Å; M17-L19 VanDerWaalsContact C-N 3.3Å; M17-L19 PolarHBondContact O-N 3.32Å; L19-L21 VanDerWaalsContact C-N 3.35Å; L19-L21 PolarHBondContact O-N 3.46Å; L19-F22 WeakPolarHBondContact O-CB 3.34Å; L19-F22 PolarHBondContact O-N 3.35Å; L19-I23 HydrophobicContact CD2-CD1 3.61Å; L19-I23 HydrophobicContact CD2-CG1 4.24Å; L19-I23 WeakPolarHBondContact O-CG1 3.46Å; L19-I23 PolarHBondContact O-N 3.05Å
20S91.1Very high87.5Confident66 Ų6673 Ų7346%0.46240%0.401SS..Hα-helixtrans-62.6-40.1174.776.80000112.9G16 M17 F22 I23 M24G16-S20 PolarHBondContact O-N 2.96Å; M17-S20 PolarHBondContact O-N 3.5Å; M17-S20 PolarHBondContact O-OG 3.31Å; S20-F22 VanDerWaalsContact C-N 3.35Å; S20-I23 PolarHBondContact O-N 3.47Å; S20-M24 PolarHBondContact O-N 2.94Å
21L89.1Confident87.7Confident86 Ų8677.8 Ų77.845%0.4543%0.425SS..Hα-helixtrans-65.6-39.3176.3-77.2168.1000111.3M17 M18 L19 M24 A25M17-L21 PolarHBondContact O-N 3.02Å; M17-L21 VanDerWaalsContact O-N 3.07Å; M18-L21 PolarHBondContact O-N 2.86Å; M18-L21 HydrophobicContact SD-CD1 4.35Å; L19-L21 VanDerWaalsContact C-N 3.35Å; L19-L21 PolarHBondContact O-N 3.46Å; L21-M24 PolarHBondContact O-N 2.96Å; L21-A25 VanDerWaalsContact O-CB 3.3Å; L21-A25 WeakPolarHBondContact O-CB 3.4Å; L21-A25 PolarHBondContact O-N 3.49Å
22F91.4Very high87.7Confident68 Ų6881.1 Ų81.130%0.29845%0.446SS..Hα-helixtrans-61.8-45.7174.6177.3-97.4000112.1M18 L19 S20 M24 A25 T26 P41 L45M18-F22 PolarHBondContact O-N 3.49Å; L19-F22 WeakPolarHBondContact O-CB 3.34Å; L19-F22 PolarHBondContact O-N 3.35Å; S20-F22 VanDerWaalsContact C-N 3.35Å; F22-M24 PolarHBondContact O-N 3.16Å; F22-A25 PolarHBondContact O-N 2.88Å; F22-T26 HydrophobicContact CD1-CG2 4.25Å; F22-T26 HydrophobicContact CD2-CG2 4.25Å; F22-T26 HydrophobicContact CE1-CG2 3.84Å; F22-T26 HydrophobicContact CE2-CG2 3.86Å; F22-T26 HydrophobicContact CG-CG2 4.44Å; F22-T26 HydrophobicContact CZ-CG2 3.63Å; F22-T26 WeakPolarHBondContact O-CB 3.5Å; F22-T26 VanDerWaalsContact O-CG2 3.31Å; F22-T26 WeakPolarHBondContact O-CG2 3.42Å; F22-T26 PolarHBondContact O-N 2.96Å; F22-T26 PolarHBondContact O-OG1 3.29Å; F22-P41 HydrophobicContact CD2-CB 3.83Å; F22-P41 WeakPolarHBondContact CD2-O 3.44Å; F22-P41 HydrophobicContact CE2-CB 3.74Å; F22-L45 HydrophobicContact CD1-CD1 4.48Å; F22-L45 HydrophobicContact CD2-CB 4.29Å; F22-L45 HydrophobicContact CD2-CD1 3.78Å; F22-L45 HydrophobicContact CE1-CD1 4.39Å; F22-L45 HydrophobicContact CE2-CB 4.41Å; F22-L45 HydrophobicContact CE2-CD1 3.65Å; F22-L45 HydrophobicContact CG-CD1 4.19Å; F22-L45 HydrophobicContact CZ-CD1 3.98Å
23I91.9Very high87.5Confident83 Ų8384 Ų8443%0.42646%0.456SS..Hα-helixtrans-61.6-44.8176.6-66.3170.7000110.8L19 S20 A25 T26 L27L19-I23 HydrophobicContact CD2-CD1 3.61Å; L19-I23 HydrophobicContact CD2-CG1 4.24Å; L19-I23 WeakPolarHBondContact O-CG1 3.46Å; L19-I23 PolarHBondContact O-N 3.05Å; S20-I23 PolarHBondContact O-N 3.47Å; I23-A25 PolarHBondContact O-N 3.37Å; I23-T26 WeakPolarHBondContact CA-OG1 3.21Å; I23-T26 PolarHBondContact O-N 3.17Å; I23-T26 PolarHBondContact O-OG1 3.4Å; I23-L27 HydrophobicContact CG2-CD1 3.89Å; I23-L27 HydrophobicContact CG2-CG 4.45Å; I23-L27 WeakPolarHBondContact O-CB 3.39Å; I23-L27 VanDerWaalsContact O-CG 3.3Å; I23-L27 WeakPolarHBondContact O-CG 3.39Å; I23-L27 PolarHBondContact O-N 3.42Å
24M90.6Very high87Confident110 Ų11082.1 Ų82.154%0.54244%0.444SS..Hα-helixtrans-63.1-44.8178.6-166.3-164.178.700111.7S20 L21 F22 L27 M28S20-M24 PolarHBondContact O-N 2.94Å; L21-M24 PolarHBondContact O-N 2.96Å; F22-M24 PolarHBondContact O-N 3.16Å; M24-L27 PolarHBondContact O-N 3.03Å; M24-M28 WeakPolarHBondContact O-CG 3.44Å; M24-M28 PolarHBondContact O-N 3.42Å
25A87.4Confident86.4Confident29 Ų2985.3 Ų85.324%0.2446%0.46CS..Hα-helixtrans-63.2-47.1179.400000111.6L21 F22 I23 L27 M28 T29 P41L21-A25 VanDerWaalsContact O-CB 3.3Å; L21-A25 WeakPolarHBondContact O-CB 3.4Å; L21-A25 PolarHBondContact O-N 3.49Å; F22-A25 PolarHBondContact O-N 2.88Å; I23-A25 PolarHBondContact O-N 3.37Å; A25-L27 PolarHBondContact O-N 2.89Å; A25-M28 PolarHBondContact O-N 3.42Å; A25-T29 WeakPolarHBondContact O-CG2 3.45Å; A25-T29 PolarHBondContact O-N 3.06Å; A25-P41 HydrophobicContact CB-CB 4.27Å
26T87.9Confident86Confident27 Ų2787.9 Ų87.917%0.16648%0.477CS..Hα-helixtrans-61-44.6178.150.80000111.8F22 I23 M28 T29 L30 P41F22-T26 HydrophobicContact CD1-CG2 4.25Å; F22-T26 HydrophobicContact CD2-CG2 4.25Å; F22-T26 HydrophobicContact CE1-CG2 3.84Å; F22-T26 HydrophobicContact CE2-CG2 3.86Å; F22-T26 HydrophobicContact CG-CG2 4.44Å; F22-T26 HydrophobicContact CZ-CG2 3.63Å; F22-T26 WeakPolarHBondContact O-CB 3.5Å; F22-T26 VanDerWaalsContact O-CG2 3.31Å; F22-T26 WeakPolarHBondContact O-CG2 3.42Å; F22-T26 PolarHBondContact O-N 2.96Å; F22-T26 PolarHBondContact O-OG1 3.29Å; I23-T26 WeakPolarHBondContact CA-OG1 3.21Å; I23-T26 PolarHBondContact O-N 3.17Å; I23-T26 PolarHBondContact O-OG1 3.4Å; T26-M28 VanDerWaalsContact C-N 3.31Å; T26-M28 PolarHBondContact O-N 3.27Å; T26-T29 WeakPolarHBondContact CA-OG1 3.48Å; T26-T29 PolarHBondContact O-N 3.36Å; T26-T29 PolarHBondContact O-OG1 3.34Å; T26-L30 WeakPolarHBondContact O-CG 3.44Å; T26-L30 PolarHBondContact O-N 3.37Å; T26-P41 HydrophobicContact CG2-CB 3.77Å; T26-P41 HydrophobicContact CG2-CG 4.02Å
27L89.5Confident85.6Confident95 Ų9587.3 Ų87.350%0.49747%0.467SS..Hα-helixtrans-58.5-41174.4-74.4169.7000112.5I23 M24 A25 L30 N31I23-L27 HydrophobicContact CG2-CD1 3.89Å; I23-L27 HydrophobicContact CG2-CG 4.45Å; I23-L27 WeakPolarHBondContact O-CB 3.39Å; I23-L27 VanDerWaalsContact O-CG 3.3Å; I23-L27 WeakPolarHBondContact O-CG 3.39Å; I23-L27 PolarHBondContact O-N 3.42Å; M24-L27 PolarHBondContact O-N 3.03Å; A25-L27 PolarHBondContact O-N 2.89Å; L27-L30 PolarHBondContact O-N 3.49Å; L27-N31 WeakPolarHBondContact O-CB 3.46Å; L27-N31 PolarHBondContact O-N 2.95Å; L27-N31 PolarHBondContact O-ND2 3.48Å; L27-N31 VanDerWaalsContact O-ND2 3.12Å
28M86.8Confident85.1Confident113 Ų11385.7 Ų85.756%0.55746%0.461SS*.Hα-helixtrans-65.9-40.8175.9-71.6-63.1-159.400112.6M24 A25 T26 L30 N31 T32M24-M28 WeakPolarHBondContact O-CG 3.44Å; M24-M28 PolarHBondContact O-N 3.42Å; A25-M28 PolarHBondContact O-N 3.42Å; T26-M28 VanDerWaalsContact C-N 3.31Å; T26-M28 PolarHBondContact O-N 3.27Å; M28-L30 VanDerWaalsContact C-N 3.35Å; M28-N31 PolarHBondContact O-N 3.45Å; M28-T32 WeakPolarHBondContact O-CG2 3.39Å; M28-T32 PolarHBondContact O-N 2.98Å; M28-T32 VanDerWaalsContact O-N 3.14Å; M28-T32 PolarHBondContact O-OG1 3.12Å
29T85.9Confident84.9Confident17 Ų1788.6 Ų88.610%0.10448%0.476CS..Hα-helixtrans-65.9-37.6176.461.60000112.4A25 T26 T32 H33 S34 A37 P41A25-T29 WeakPolarHBondContact O-CG2 3.45Å; A25-T29 PolarHBondContact O-N 3.06Å; T26-T29 WeakPolarHBondContact CA-OG1 3.48Å; T26-T29 PolarHBondContact O-N 3.36Å; T26-T29 PolarHBondContact O-OG1 3.34Å; T29-T32 PolarHBondContact O-N 2.9Å; T29-T32 PolarHBondContact O-OG1 2.7Å; T29-H33 PolarHBondContact O-N 3.34Å; T29-S34 PolarHBondContact O-N 2.95Å; T29-A37 HydrophobicContact CG2-CB 3.79Å; T29-P41 HydrophobicContact CG2-CG 4.48Å
30L85.3Confident84.8Confident115 Ų11587.7 Ų87.760%0.60248%0.475SS*.Hα-helixtrans-66.5-44.7176.2-71.4169.3000111.3T26 L27 M28 T32 H33T26-L30 WeakPolarHBondContact O-CG 3.44Å; T26-L30 PolarHBondContact O-N 3.37Å; L27-L30 PolarHBondContact O-N 3.49Å; M28-L30 VanDerWaalsContact C-N 3.35Å; L30-T32 VanDerWaalsContact C-N 3.27Å; L30-T32 PolarHBondContact O-N 3.49Å; L30-H33 PolarHBondContact O-N 3.43Å
31N85.3Confident84.6Confident122 Ų12284.6 Ų84.665%0.65245%0.453SS*.Hα-helixtrans-62.2-33.2177.8-81.4-39.6000113.1L27 M28 H33L27-N31 WeakPolarHBondContact O-CB 3.46Å; L27-N31 PolarHBondContact O-N 2.95Å; L27-N31 PolarHBondContact O-ND2 3.48Å; L27-N31 VanDerWaalsContact O-ND2 3.12Å; M28-N31 PolarHBondContact O-N 3.45Å; N31-H33 VanDerWaalsContact C-N 3.33Å
32T82.1Confident84.6Confident92 Ų9285.4 Ų85.456%0.56446%0.457SS*.THydrogen-bonded Turntrans-88.71.4-179.154.60000113.5M28 T29 L30 S34M28-T32 WeakPolarHBondContact O-CG2 3.39Å; M28-T32 PolarHBondContact O-N 2.98Å; M28-T32 VanDerWaalsContact O-N 3.14Å; M28-T32 PolarHBondContact O-OG1 3.12Å; T29-T32 PolarHBondContact O-N 2.9Å; T29-T32 PolarHBondContact O-OG1 2.7Å; L30-T32 VanDerWaalsContact C-N 3.27Å; L30-T32 PolarHBondContact O-N 3.49Å; T32-S34 PolarHBondContact O-N 3.44Å; T32-S34 PolarHBondContact OG1-OG 3.25Å
33H78.1Confident84.6Confident172 Ų17284.1 Ų84.180%0.79646%0.459SS*.THydrogen-bonded Turntrans47.229.7-176.3-69.2-72.6000114T29 L30 N31 L35T29-H33 PolarHBondContact O-N 3.34Å; L30-H33 PolarHBondContact O-N 3.43Å; N31-H33 VanDerWaalsContact C-N 3.33Å; H33-L35 PolarHBondContact O-N 3.05Å
34S75Confident84.5Confident42 Ų4284.6 Ų84.629%0.29446%0.461SS..  trans-9890.9-174.357.80000110.3T29 T32 L36 A37T29-S34 PolarHBondContact O-N 2.95Å; T32-S34 PolarHBondContact O-N 3.44Å; T32-S34 PolarHBondContact OG1-OG 3.25Å; S34-L36 PolarHBondContact O-N 3.1Å; S34-A37 WeakPolarHBondContact O-CB 3.32Å; S34-A37 PolarHBondContact O-N 3.09Å; S34-A37 WeakPolarHBondContact OG-CB 3.45Å
35L73.8Confident84.5Confident156 Ų15683.8 Ų83.882%0.81746%0.458SS*.G310 helixtrans-58.5-32.6-178.6-69171000113.1H33 A37 N38H33-L35 PolarHBondContact O-N 3.05Å; L35-A37 VanDerWaalsContact C-N 3.34Å; L35-N38 WeakPolarHBondContact O-CB 3.5Å; L35-N38 PolarHBondContact O-N 3.39Å
36L77.6Confident84.8Confident148 Ų14886.4 Ų86.478%0.77547%0.471SS*.G310 helixtrans-67.9-30.8175.4-81.8159.9000112.9S34 N38 I39S34-L36 PolarHBondContact O-N 3.1Å; L36-N38 PolarHBondContact O-N 2.95Å; L36-I39 PolarHBondContact O-N 2.92Å
37A79.3Confident84.9Confident30 Ų3092 Ų9225%0.24849%0.493CS..G310 helixtrans-71.8-15.2179.700000112.4T29 S34 L35 I39 V40 P41T29-A37 HydrophobicContact CG2-CB 3.79Å; S34-A37 WeakPolarHBondContact O-CB 3.32Å; S34-A37 PolarHBondContact O-N 3.09Å; S34-A37 WeakPolarHBondContact OG-CB 3.45Å; L35-A37 VanDerWaalsContact C-N 3.34Å; A37-I39 PolarHBondContact O-N 3.16Å; A37-V40 WeakPolarHBondContact O-CB 3.37Å; A37-V40 PolarHBondContact O-N 3.02Å; A37-P41 WeakPolarHBondContact O-CD 3.44Å
38N78.9Confident84.9Confident70 Ų7088.3 Ų88.337%0.37448%0.476SS..G310 helixtrans-67.1-15.8178.8-143.923.1000113.1L35 L36 V40 P41 I42L35-N38 WeakPolarHBondContact O-CB 3.5Å; L35-N38 PolarHBondContact O-N 3.39Å; L36-N38 PolarHBondContact O-N 2.95Å; N38-V40 VanDerWaalsContact C-N 3.28Å; N38-V40 PolarHBondContact O-N 3.37Å; N38-P41 VanDerWaalsContact O-CD 3.31Å; N38-P41 WeakPolarHBondContact O-CD 3.15Å; N38-P41 WeakPolarHBondContact O-CG 3.39Å; N38-I42 WeakPolarHBondContact O-CD1 3.34Å; N38-I42 WeakPolarHBondContact O-CG1 3.4Å
39I86.2Confident85.1Confident113 Ų11385.6 Ų85.658%0.57947%0.472SS*.Hα-helixtrans-66.4-32.9171.8-62.6172.6000111L36 A37 I42 A43L36-I39 PolarHBondContact O-N 2.92Å; A37-I39 PolarHBondContact O-N 3.16Å; I39-I42 PolarHBondContact O-N 3.38Å; I39-A43 WeakPolarHBondContact O-CB 3.31Å; I39-A43 PolarHBondContact O-N 3.05Å
40V86.6Confident85.3Confident88 Ų8888.1 Ų88.153%0.53349%0.49SS..Hα-helixtrans-62.3-53.4-177.5-179.20000112.8A37 N38 I42 A43 M44A37-V40 WeakPolarHBondContact O-CB 3.37Å; A37-V40 PolarHBondContact O-N 3.02Å; N38-V40 VanDerWaalsContact C-N 3.28Å; N38-V40 PolarHBondContact O-N 3.37Å; V40-I42 VanDerWaalsContact C-N 3.27Å; V40-I42 PolarHBondContact O-N 3.06Å; V40-A43 PolarHBondContact O-N 2.95Å; V40-M44 HydrophobicContact CG1-CG 4.48Å; V40-M44 WeakPolarHBondContact O-CB 3.46Å; V40-M44 VanDerWaalsContact O-CG 3.29Å; V40-M44 WeakPolarHBondContact O-CG 3.46Å; V40-M44 PolarHBondContact O-N 3Å
41P87.3Confident85.4Confident1 Ų188.8 Ų88.81%0.00649%0.489CS..Hα-helixtrans-63.8-31.4178.223.2-32.5000112.7F22 A25 T26 T29 A37 N38 L45F22-P41 HydrophobicContact CD2-CB 3.83Å; F22-P41 WeakPolarHBondContact CD2-O 3.44Å; F22-P41 HydrophobicContact CE2-CB 3.74Å; A25-P41 HydrophobicContact CB-CB 4.27Å; T26-P41 HydrophobicContact CG2-CB 3.77Å; T26-P41 HydrophobicContact CG2-CG 4.02Å; T29-P41 HydrophobicContact CG2-CG 4.48Å; A37-P41 WeakPolarHBondContact O-CD 3.44Å; N38-P41 VanDerWaalsContact O-CD 3.31Å; N38-P41 WeakPolarHBondContact O-CD 3.15Å; N38-P41 WeakPolarHBondContact O-CG 3.39Å; P41-L45 WeakPolarHBondContact O-CB 3.47Å; P41-L45 PolarHBondContact O-N 3.1Å
42I89.4Confident85.6Confident103 Ų10383.9 Ų83.953%0.52847%0.466SS..Hα-helixtrans-68.1-47.9175.3-62.8166.1000110.8N38 I39 V40 M44 L45 V46N38-I42 WeakPolarHBondContact O-CD1 3.34Å; N38-I42 WeakPolarHBondContact O-CG1 3.4Å; I39-I42 PolarHBondContact O-N 3.38Å; V40-I42 VanDerWaalsContact C-N 3.27Å; V40-I42 PolarHBondContact O-N 3.06Å; I42-M44 VanDerWaalsContact C-N 3.32Å; I42-M44 PolarHBondContact O-N 3.34Å; I42-L45 PolarHBondContact O-N 3.42Å; I42-L45 VanDerWaalsContact O-N 3.16Å; I42-V46 WeakPolarHBondContact O-CG2 3.35Å; I42-V46 PolarHBondContact O-N 2.93Å; I42-V46 VanDerWaalsContact O-N 3.09Å
43A91.2Very high86Confident41 Ų4182.3 Ų82.334%0.33946%0.463SS..Hα-helixtrans-60.4-42.8176.900000111.6I39 V40 L45 V46 F47I39-A43 WeakPolarHBondContact O-CB 3.31Å; I39-A43 PolarHBondContact O-N 3.05Å; V40-A43 PolarHBondContact O-N 2.95Å; A43-L45 VanDerWaalsContact C-N 3.31Å; A43-L45 PolarHBondContact O-N 3.12Å; A43-V46 PolarHBondContact O-N 3.4Å; A43-F47 WeakPolarHBondContact O-CD2 3.48Å; A43-F47 PolarHBondContact O-N 3.29Å; A43-F47 VanDerWaalsContact O-N 3.1Å
44M90Very high86.6Confident93 Ų9378.5 Ų78.546%0.45845%0.451SS..Hα-helixtrans-56.9-42.3173.9-75.3-71.8-69.300112.3V40 I42 F47 A48V40-M44 HydrophobicContact CG1-CG 4.48Å; V40-M44 WeakPolarHBondContact O-CB 3.46Å; V40-M44 VanDerWaalsContact O-CG 3.29Å; V40-M44 WeakPolarHBondContact O-CG 3.46Å; V40-M44 PolarHBondContact O-N 3Å; I42-M44 VanDerWaalsContact C-N 3.32Å; I42-M44 PolarHBondContact O-N 3.34Å; M44-F47 PolarHBondContact O-N 2.98Å; M44-A48 WeakPolarHBondContact O-CB 3.29Å; M44-A48 PolarHBondContact O-N 2.74Å
45L90.7Very high87.2Confident92 Ų9277.2 Ų77.248%0.48245%0.445SS..Hα-helixtrans-67.2-37.7179.8-161.7152.4000111.8F22 P41 I42 A43 A48 A49F22-L45 HydrophobicContact CD1-CD1 4.48Å; F22-L45 HydrophobicContact CD2-CB 4.29Å; F22-L45 HydrophobicContact CD2-CD1 3.78Å; F22-L45 HydrophobicContact CE1-CD1 4.39Å; F22-L45 HydrophobicContact CE2-CB 4.41Å; F22-L45 HydrophobicContact CE2-CD1 3.65Å; F22-L45 HydrophobicContact CG-CD1 4.19Å; F22-L45 HydrophobicContact CZ-CD1 3.98Å; P41-L45 WeakPolarHBondContact O-CB 3.47Å; P41-L45 PolarHBondContact O-N 3.1Å; I42-L45 PolarHBondContact O-N 3.42Å; I42-L45 VanDerWaalsContact O-N 3.16Å; A43-L45 VanDerWaalsContact C-N 3.31Å; A43-L45 PolarHBondContact O-N 3.12Å; L45-A48 WeakPolarHBondContact O-CB 3.44Å; L45-A48 PolarHBondContact O-N 2.94Å; L45-A49 PolarHBondContact O-N 2.66Å
46V93.8Very high87.8Confident84 Ų8473.3 Ų73.351%0.50942%0.424SS..Hα-helixtrans-62.8-47.4174.7176.20000110.9I42 A43 A48 A49 C50I42-V46 WeakPolarHBondContact O-CG2 3.35Å; I42-V46 PolarHBondContact O-N 2.93Å; I42-V46 VanDerWaalsContact O-N 3.09Å; A43-V46 PolarHBondContact O-N 3.4Å; V46-A48 VanDerWaalsContact C-N 3.33Å; V46-A48 PolarHBondContact O-N 3.06Å; V46-A49 PolarHBondContact O-N 3.5Å; V46-C50 PolarHBondContact O-N 3.2Å; V46-C50 PolarHBondContact O-SG 2.87Å
47F90.3Very high88.3Confident144 Ų14469.2 Ų69.263%0.63241%0.412SS*.Hα-helixtrans-62.7-39.8176.5-77.1-68000112.3A43 M44 A49 C50 E51A43-F47 WeakPolarHBondContact O-CD2 3.48Å; A43-F47 PolarHBondContact O-N 3.29Å; A43-F47 VanDerWaalsContact O-N 3.1Å; M44-F47 PolarHBondContact O-N 2.98Å; F47-A49 VanDerWaalsContact C-N 3.33Å; F47-A49 PolarHBondContact O-N 3.45Å; F47-C50 WeakPolarHBondContact O-CB 3.45Å; F47-C50 PolarHBondContact O-N 3.29Å; F47-E51 PolarHBondContact O-N 3.34Å
48A90.1Very high88.5Confident18 Ų1872.5 Ų72.515%0.14942%0.424CS..Hα-helixtrans-58-44.6175.100000112.3M18 M44 L45 V46 C50 E51 A52M18-A48 HydrophobicContact CB-CB 4.11Å; M18-A48 HydrophobicContact CE-CB 3.34Å; M18-A48 HydrophobicContact CG-CB 4.12Å; M44-A48 WeakPolarHBondContact O-CB 3.29Å; M44-A48 PolarHBondContact O-N 2.74Å; L45-A48 WeakPolarHBondContact O-CB 3.44Å; L45-A48 PolarHBondContact O-N 2.94Å; V46-A48 VanDerWaalsContact C-N 3.33Å; V46-A48 PolarHBondContact O-N 3.06Å; A48-C50 VanDerWaalsContact C-N 3.33Å; A48-C50 PolarHBondContact O-N 3.4Å; A48-E51 PolarHBondContact O-N 3.38Å; A48-A52 WeakPolarHBondContact O-CB 3.36Å; A48-A52 PolarHBondContact O-N 3.31Å
49A89.9Confident88.7Confident57 Ų5769.7 Ų69.747%0.47141%0.41SS..Hα-helixtrans-65.4-37.1177.500000112L45 V46 F47 A52 A53L45-A49 PolarHBondContact O-N 2.66Å; V46-A49 PolarHBondContact O-N 3.5Å; F47-A49 VanDerWaalsContact C-N 3.33Å; F47-A49 PolarHBondContact O-N 3.45Å; A49-A52 PolarHBondContact O-N 3.07Å; A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.22Å
50C90.9Very high88.6Confident70 Ų7068.1 Ų68.147%0.47341%0.405SS..Hα-helixtrans-64-44.8174.3-65.80000112.1V46 F47 A48 A53 V54V46-C50 PolarHBondContact O-N 3.2Å; V46-C50 PolarHBondContact O-SG 2.87Å; F47-C50 WeakPolarHBondContact O-CB 3.45Å; F47-C50 PolarHBondContact O-N 3.29Å; A48-C50 VanDerWaalsContact C-N 3.33Å; A48-C50 PolarHBondContact O-N 3.4Å; C50-A53 PolarHBondContact O-N 2.7Å; C50-V54 WeakPolarHBondContact O-CG2 3.15Å; C50-V54 PolarHBondContact O-N 3.44Å
51E88.1Confident88.4Confident128 Ų12866.6 Ų66.660%0.59840%0.398SS*.Hα-helixtrans-62.5-43176.1-71.3-175.3170.500111.8F47 A48 A53 V54 G55F47-E51 PolarHBondContact O-N 3.34Å; A48-E51 PolarHBondContact O-N 3.38Å; E51-A53 PolarHBondContact O-N 3.29Å; E51-V54 PolarHBondContact O-N 2.95Å; E51-G55 PolarHBondContact O-N 3.21Å
52A89Confident87.9Confident20 Ų2067.9 Ų67.917%0.16541%0.405CS..Hα-helixtrans-61.9-42.717600000111.9A48 A49 V54 G55 L56A48-A52 WeakPolarHBondContact O-CB 3.36Å; A48-A52 PolarHBondContact O-N 3.31Å; A49-A52 PolarHBondContact O-N 3.07Å; A52-V54 PolarHBondContact O-N 3.32Å; A52-G55 PolarHBondContact O-N 3.01Å; A52-L56 WeakPolarHBondContact O-CB 3.44Å; A52-L56 WeakPolarHBondContact O-CG 3.48Å; A52-L56 PolarHBondContact O-N 3.05Å
53A90.1Very high87.4Confident59 Ų5964.5 Ų64.549%0.48839%0.39SS..Hα-helixtrans-61.8-43.8176.800000112.2A49 C50 E51 L56 A57A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.22Å; C50-A53 PolarHBondContact O-N 2.7Å; E51-A53 PolarHBondContact O-N 3.29Å; A53-L56 PolarHBondContact O-N 2.99Å; A53-A57 WeakPolarHBondContact O-CB 3.39Å; A53-A57 PolarHBondContact O-N 3.41Å
54V89.8Confident86.8Confident92 Ų9268.7 Ų68.756%0.55841%0.407SS*.Hα-helixtrans-65.9-41.6175.5175.10000111C50 E51 A52 L56 A57 L58C50-V54 WeakPolarHBondContact O-CG2 3.15Å; C50-V54 PolarHBondContact O-N 3.44Å; E51-V54 PolarHBondContact O-N 2.95Å; A52-V54 PolarHBondContact O-N 3.32Å; V54-L56 PolarHBondContact O-N 3.01Å; V54-A57 PolarHBondContact O-N 3.32Å; V54-L58 HydrophobicContact CG1-CD1 4.34Å; V54-L58 WeakPolarHBondContact O-CG 3.3Å; V54-L58 PolarHBondContact O-N 3.46Å
55G87.8Confident86.1Confident15 Ų1569 Ų6916%0.15541%0.414CS..Hα-helixtrans-60.3-42.2176.400000113.1E51 A52 L58 L59E51-G55 PolarHBondContact O-N 3.21Å; A52-G55 PolarHBondContact O-N 3.01Å; G55-L58 PolarHBondContact O-N 3.2Å; G55-L59 PolarHBondContact O-N 2.95Å
56L86.2Confident85.1Confident73 Ų7368.2 Ų68.238%0.38241%0.405SS..Hα-helixtrans-67.5-41.6174.4-73.9166.3000112.1M8 L11 A52 A53 V54 L58 L59 V60M8-L56 HydrophobicContact CE-CD2 4.49Å; M8-L56 HydrophobicContact SD-CD2 4.26Å; L11-L56 HydrophobicContact CD1-CD2 3.97Å; L11-L56 HydrophobicContact CD1-CG 4.37Å; A52-L56 WeakPolarHBondContact O-CB 3.44Å; A52-L56 WeakPolarHBondContact O-CG 3.48Å; A52-L56 PolarHBondContact O-N 3.05Å; A53-L56 PolarHBondContact O-N 2.99Å; V54-L56 PolarHBondContact O-N 3.01Å; L56-L58 VanDerWaalsContact C-N 3.3Å; L56-L58 PolarHBondContact O-N 2.87Å; L56-L59 WeakPolarHBondContact O-CB 3.35Å; L56-L59 PolarHBondContact O-N 3.18Å; L56-L59 VanDerWaalsContact O-N 3.16Å; L56-V60 WeakPolarHBondContact O-CG2 3.43Å; L56-V60 PolarHBondContact O-N 3.47Å
57A88.4Confident83.7Confident63 Ų6367 Ų6752%0.52141%0.41SS..Hα-helixtrans-60.3-41.4176.200000111.8A53 V54 V60 S61A53-A57 WeakPolarHBondContact O-CB 3.39Å; A53-A57 PolarHBondContact O-N 3.41Å; V54-A57 PolarHBondContact O-N 3.32Å; A57-V60 PolarHBondContact O-N 2.98Å; A57-S61 PolarHBondContact O-N 3.06Å
58L84.6Confident82.3Confident98 Ų9865 Ų6551%0.51341%0.405SS..Hα-helixtrans-63.3-43.1173.4-74.6171.6000111.7V54 G55 L56 V60 S61 I62V54-L58 HydrophobicContact CG1-CD1 4.34Å; V54-L58 WeakPolarHBondContact O-CG 3.3Å; V54-L58 PolarHBondContact O-N 3.46Å; G55-L58 PolarHBondContact O-N 3.2Å; L56-L58 VanDerWaalsContact C-N 3.3Å; L56-L58 PolarHBondContact O-N 2.87Å; L58-V60 VanDerWaalsContact C-N 3.32Å; L58-V60 PolarHBondContact O-N 2.9Å; L58-S61 PolarHBondContact O-N 3.46Å; L58-S61 VanDerWaalsContact O-N 3.09Å; L58-S61 PolarHBondContact O-OG 3.35Å; L58-I62 WeakPolarHBondContact O-CG1 3.41Å; L58-I62 PolarHBondContact O-N 2.74Å
59L83.4Confident80.9Confident12 Ų1266.6 Ų66.66%0.06341%0.411CS..Hα-helixtrans-59.4-44.5177-164.2157.9000111.5L7 M8 L11 G55 L56 S61 I62 S63L7-L59 HydrophobicContact CB-CD1 3.76Å; L7-L59 HydrophobicContact CB-CG 4.18Å; L7-L59 HydrophobicContact CD2-CB 4.25Å; L7-L59 HydrophobicContact CD2-CD1 3.77Å; L7-L59 HydrophobicContact CD2-CG 4.17Å; L7-L59 HydrophobicContact CG-CD1 4.35Å; M8-L59 HydrophobicContact CB-CD1 4.45Å; M8-L59 HydrophobicContact CG-CD1 3.72Å; M8-L59 HydrophobicContact CG-CD2 4.42Å; M8-L59 HydrophobicContact SD-CD1 3.32Å; M8-L59 WeakPolarHBondContact SD-CD1 3.31Å; M8-L59 HydrophobicContact SD-CD2 4.05Å; M8-L59 HydrophobicContact SD-CG 4.34Å; L11-L59 HydrophobicContact CD1-CB 4.44Å; L11-L59 HydrophobicContact CD1-CD1 3.5Å; L11-L59 VanDerWaalsContact CD1-CD1 3.5Å; G55-L59 PolarHBondContact O-N 2.95Å; L56-L59 WeakPolarHBondContact O-CB 3.35Å; L56-L59 PolarHBondContact O-N 3.18Å; L56-L59 VanDerWaalsContact O-N 3.16Å; L59-S61 VanDerWaalsContact C-N 3.3Å; L59-S61 PolarHBondContact O-N 3.4Å; L59-I62 PolarHBondContact O-N 2.94Å; L59-S63 WeakPolarHBondContact O-CB 3.47Å; L59-S63 PolarHBondContact O-N 3.5Å; L59-S63 PolarHBondContact O-OG 3.18Å
60V84Confident79.5Confident80 Ų8068.7 Ų68.749%0.48541%0.408SS..Hα-helixtrans-61.7-37.3174.8174.10000111.7L56 A57 L58 S63 N64L56-V60 WeakPolarHBondContact O-CG2 3.43Å; L56-V60 PolarHBondContact O-N 3.47Å; A57-V60 PolarHBondContact O-N 2.98Å; L58-V60 VanDerWaalsContact C-N 3.32Å; L58-V60 PolarHBondContact O-N 2.9Å; V60-S63 WeakPolarHBondContact CA-OG 3.33Å; V60-S63 PolarHBondContact O-OG 3.49Å; V60-N64 WeakPolarHBondContact O-CB 3.45Å; V60-N64 VanDerWaalsContact O-CG 3.32Å; V60-N64 PolarHBondContact O-N 2.9Å; V60-N64 PolarHBondContact O-ND2 3.37Å
61S82.3Confident77.9Confident55 Ų5568.1 Ų68.139%0.38540%0.402SS..Hα-helixtrans-66.3-41.6175.674.90000112.3A57 L58 L59 N64 T65A57-S61 PolarHBondContact O-N 3.06Å; L58-S61 PolarHBondContact O-N 3.46Å; L58-S61 VanDerWaalsContact O-N 3.09Å; L58-S61 PolarHBondContact O-OG 3.35Å; L59-S61 VanDerWaalsContact C-N 3.3Å; L59-S61 PolarHBondContact O-N 3.4Å; S61-N64 PolarHBondContact O-N 2.92Å; S61-T65 PolarHBondContact O-N 3.47Å; S61-T65 PolarHBondContact O-OG1 3.02Å; S61-T65 VanDerWaalsContact O-OG1 3.13Å
62I76.8Confident76.3Confident28 Ų2869.8 Ų69.814%0.14441%0.409CS..Hα-helixtrans-66.8-42.9178.7-66.7164.4000110.4L7 L58 L59 N64 T65 Y66 L74L7-I62 HydrophobicContact CD1-CD1 3.88Å; L58-I62 WeakPolarHBondContact O-CG1 3.41Å; L58-I62 PolarHBondContact O-N 2.74Å; L59-I62 PolarHBondContact O-N 2.94Å; I62-N64 VanDerWaalsContact C-N 3.33Å; I62-N64 PolarHBondContact O-N 2.88Å; I62-T65 PolarHBondContact O-N 3.48Å; I62-T65 PolarHBondContact O-OG1 3.02Å; I62-T65 VanDerWaalsContact O-OG1 3.07Å; I62-Y66 HydrophobicContact CG2-CD2 4.09Å; I62-Y66 PolarHBondContact O-N 3.36Å; I62-L74 HydrophobicContact CD1-CD1 4.39Å
63S77.8Confident74.7Confident33 Ų3372.5 Ų72.523%0.23142%0.421CS..Hα-helixtrans-65.6-36.6177.970.20000111.8L59 V60 G67 D69L59-S63 WeakPolarHBondContact O-CB 3.47Å; L59-S63 PolarHBondContact O-N 3.5Å; L59-S63 PolarHBondContact O-OG 3.18Å; V60-S63 WeakPolarHBondContact CA-OG 3.33Å; V60-S63 PolarHBondContact O-OG 3.49Å; S63-G67 WeakPolarHBondContact O-CA 3.44Å; S63-G67 PolarHBondContact O-N 2.99Å; S63-D69 WeakPolarHBondContact CB-OD1 3.45Å
64N79.7Confident73.3Confident129 Ų12972.6 Ų72.669%0.6941%0.413SS*.Hα-helixtrans-67.6-35.7173.4-78.5-42.8000113.4V60 S61 I62V60-N64 WeakPolarHBondContact O-CB 3.45Å; V60-N64 VanDerWaalsContact O-CG 3.32Å; V60-N64 PolarHBondContact O-N 2.9Å; V60-N64 PolarHBondContact O-ND2 3.37Å; S61-N64 PolarHBondContact O-N 2.92Å; I62-N64 VanDerWaalsContact C-N 3.33Å; I62-N64 PolarHBondContact O-N 2.88Å
65T74.6Confident71.8Confident100 Ų10073 Ų7361%0.61341%0.412SS*.Hα-helixtrans-82.5-35.2-179.150.50000113.9S61 I62S61-T65 PolarHBondContact O-N 3.47Å; S61-T65 PolarHBondContact O-OG1 3.02Å; S61-T65 VanDerWaalsContact O-OG1 3.13Å; I62-T65 PolarHBondContact O-N 3.48Å; I62-T65 PolarHBondContact O-OG1 3.02Å; I62-T65 VanDerWaalsContact O-OG1 3.07Å
66Y69.4Low70.5Confident74 Ų7478.3 Ų78.329%0.2944%0.436SS..Hα-helixtrans-111.4-3.8-173.2-66.2-76.8000113.8I62 L68 N73 L74 L76I62-Y66 HydrophobicContact CG2-CD2 4.09Å; I62-Y66 PolarHBondContact O-N 3.36Å; Y66-L68 PolarHBondContact O-N 3.03Å; Y66-N73 HydrophobicContact CD1-CB 3.69Å; Y66-N73 HydrophobicContact CE1-CB 4.23Å; Y66-N73 WeakPolarHBondContact CE1-O 3.3Å; Y66-N73 HydrophobicContact CG-CB 3.95Å; Y66-L74 HydrophobicContact CE2-CD2 3.82Å; Y66-L76 HydrophobicContact CE1-CD1 4.21Å; Y66-L76 WeakPolarHBondContact OH-CD1 3.45Å
67G64.9Low69.3Low59 Ų5982.3 Ų82.361%0.60846%0.457SS*.SBendtrans68.3-9.4177.900000115.3S63S63-G67 WeakPolarHBondContact O-CA 3.44Å; S63-G67 PolarHBondContact O-N 2.99Å
68L60.9Low67.8Low102 Ų10286.4 Ų86.453%0.53447%0.466SS..SBendtrans-145.7140.6-176.9-60.4167.8000110.3Y66 Y70Y66-L68 PolarHBondContact O-N 3.03Å; L68-Y70 HydrophobicContact CB-CD2 3.67Å; L68-Y70 HydrophobicContact CB-CE2 4.18Å; L68-Y70 HydrophobicContact CD1-CD2 4.27Å; L68-Y70 HydrophobicContact CD1-CE2 4.39Å; L68-Y70 HydrophobicContact CG-CD2 4.5Å; L68-Y70 PolarHBondContact O-N 3.47Å
69D60.7Low66.5Low51 Ų5190.4 Ų90.427%0.27350%0.5SS..  trans-69.814.3-175.6-61.2-34.7000115.4S5 S63 V71S5-D69 CarbonylContact O-C 3.53Å; S63-D69 WeakPolarHBondContact CB-OD1 3.45Å; D69-V71 PolarHBondContact O-N 3.21Å
70Y59.8Low65.6Low102 Ų10294.3 Ų94.340%0.452%0.521SS..  trans-78.2116.4-175.7-68.5-83.8000111.6S5 L68 H72 N73S5-Y70 WeakPolarHBondContact O-CA 3.44Å; L68-Y70 HydrophobicContact CB-CD2 3.67Å; L68-Y70 HydrophobicContact CB-CE2 4.18Å; L68-Y70 HydrophobicContact CD1-CD2 4.27Å; L68-Y70 HydrophobicContact CD1-CE2 4.39Å; L68-Y70 HydrophobicContact CG-CD2 4.5Å; L68-Y70 PolarHBondContact O-N 3.47Å; Y70-H72 PolarHBondContact O-N 3.43Å; Y70-N73 PolarHBondContact O-N 3.33Å; Y70-N73 VanDerWaalsContact O-N 3.15Å
71V58.3Low64.7Low57 Ų5795.1 Ų95.135%0.34552%0.523SS..G310 helixtrans-54-23.4170.2-176.30000112.3Y3 L7 D69 N73 L74Y3-V71 HydrophobicContact CD1-CG2 4.39Å; L7-V71 HydrophobicContact CB-CG2 4.39Å; L7-V71 HydrophobicContact CD1-CG2 4.19Å; L7-V71 HydrophobicContact CG-CG2 4.44Å; D69-V71 PolarHBondContact O-N 3.21Å; V71-N73 VanDerWaalsContact C-N 3.26Å; V71-N73 PolarHBondContact O-N 3.19Å; V71-L74 PolarHBondContact O-N 2.94Å
72H54.3Low63.7Low163 Ų16397.3 Ų97.376%0.75553%0.531SS*.G310 helixtrans-70.2-16.8-178.4-14936.2000114.3Y70 L74Y70-H72 PolarHBondContact O-N 3.43Å; H72-L74 VanDerWaalsContact C-N 3.31Å; H72-L74 PolarHBondContact O-N 3.45Å
73N55.8Low62.9Low77 Ų77101.4 Ų101.441%0.41255%0.554SS.*G310 helixtrans-78.8-9.7176.2-90.620.1000113.8Y66 Y70 V71 N75Y66-N73 HydrophobicContact CD1-CB 3.69Å; Y66-N73 HydrophobicContact CE1-CB 4.23Å; Y66-N73 WeakPolarHBondContact CE1-O 3.3Å; Y66-N73 HydrophobicContact CG-CB 3.95Å; Y70-N73 PolarHBondContact O-N 3.33Å; Y70-N73 VanDerWaalsContact O-N 3.15Å; V71-N73 VanDerWaalsContact C-N 3.26Å; V71-N73 PolarHBondContact O-N 3.19Å; N73-N75 PolarHBondContact O-N 3.34Å; N73-N75 VanDerWaalsContact O-N 3.08Å
74L59.2Low62Low62 Ų62105.6 Ų105.633%0.32557%0.574SS.*  trans-80.525.7179.8-66.3168000113.7I62 Y66 V71 H72 L76I62-L74 HydrophobicContact CD1-CD1 4.39Å; Y66-L74 HydrophobicContact CE2-CD2 3.82Å; V71-L74 PolarHBondContact O-N 2.94Å; H72-L74 VanDerWaalsContact C-N 3.31Å; H72-L74 PolarHBondContact O-N 3.45Å; L74-L76 VanDerWaalsContact C-N 3.25Å; L74-L76 PolarHBondContact O-N 3.14Å
75N59.9Low60.8Low99 Ų99104.1 Ų104.153%0.52957%0.566SS.*G310 helixtrans-82.73.2-176.3-132.133.7000114.4N73 L77 Q78N73-N75 PolarHBondContact O-N 3.34Å; N73-N75 VanDerWaalsContact O-N 3.08Å; N75-L77 VanDerWaalsContact C-N 3.27Å; N75-L77 PolarHBondContact O-N 3.44Å; N75-Q78 PolarHBondContact ND2-OE1 2.98Å; N75-Q78 VanDerWaalsContact ND2-OE1 3.08Å; N75-Q78 PolarHBondContact O-N 3.36Å; N75-Q78 PolarHBondContact OD1-OE1 3.44Å; N75-Q78 VanDerWaalsContact OD1-OE1 3.08Å
76L59.2Low59.8Low127 Ų127104.4 Ų104.467%0.66556%0.563SS**G310 helixtrans-69.6-19.8176.9-83.6160.2000113.8Y66 L74 Q78Y66-L76 HydrophobicContact CE1-CD1 4.21Å; Y66-L76 WeakPolarHBondContact OH-CD1 3.45Å; L74-L76 VanDerWaalsContact C-N 3.25Å; L74-L76 PolarHBondContact O-N 3.14Å; L76-Q78 VanDerWaalsContact C-N 3.33Å
77L60.7Low59.1Low158 Ų158106.7 Ų106.783%0.82758%0.584SS**G310 helixtrans-88.62.9178-81.4148.4000113.5N75 C79N75-L77 VanDerWaalsContact C-N 3.27Å; N75-L77 PolarHBondContact O-N 3.44Å; L77-C79 PolarHBondContact O-N 3.12Å
78Q57.7Low58.6Low149 Ų149110.7 Ų110.770%0.69658%0.582SS**G310 helixtrans-84.67.3175.9-149.7-176.7-15.700112.8N75 L76N75-Q78 PolarHBondContact ND2-OE1 2.98Å; N75-Q78 VanDerWaalsContact ND2-OE1 3.08Å; N75-Q78 PolarHBondContact O-N 3.36Å; N75-Q78 PolarHBondContact OD1-OE1 3.44Å; N75-Q78 VanDerWaalsContact OD1-OE1 3.08Å; L76-Q78 VanDerWaalsContact C-N 3.33Å
79C56.7Low58.4Low181 Ų181111.5 Ų111.5100%1.22359%0.586SS**  trans-840173.1-72.30000112.2L77L77-C79 PolarHBondContact O-N 3.12Å

Retrieved 79 of 79 residues in 71.5 ms (Link to these results)