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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 A0A075XDQ3, Species HUMAN (Homo sapiens, Human), Gene ND4L, Length 84 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
1M66.1Low88.4Confident150 Ų15087.7 Ų87.774%0.73947%0.469SS*.  056.90-68.6-61.716200112I4 Y5M1-I4 HydrophobicContact SD-CD1 4.29Å; M1-Y5 WeakPolarHBondContact O-CD2 3.39Å
2P74.8Confident88.9Confident97 Ų9784.7 Ų84.763%0.6345%0.449SS*.Hα-helixtrans-72.4-34.4-172.229.4-34.6000113.5I4 Y5 M6P2-I4 VanDerWaalsContact C-N 3.33Å; P2-I4 PolarHBondContact O-N 2.65Å; P2-Y5 PolarHBondContact O-N 3.23Å; P2-M6 WeakPolarHBondContact O-CG 3.45Å; P2-M6 PolarHBondContact O-N 3.01Å; P2-M6 VanDerWaalsContact O-N 3.07Å
3L89Confident89.3Confident132 Ų13282.9 Ų82.969%0.69144%0.444SS*.Hα-helixtrans-61.2-39.3-178-103.9108000113.3M6 N7L3-M6 PolarHBondContact O-N 3.03Å; L3-N7 PolarHBondContact O-N 3.39Å
4I91.3Very high89.5Confident76 Ų7685 Ų8539%0.3945%0.453SS..Hα-helixtrans-66.6-42.4-179.2-62.2169.6000110M1 P2 M6 N7 I8 L46M1-I4 HydrophobicContact SD-CD1 4.29Å; P2-I4 VanDerWaalsContact C-N 3.33Å; P2-I4 PolarHBondContact O-N 2.65Å; I4-M6 VanDerWaalsContact C-N 3.35Å; I4-M6 PolarHBondContact O-N 2.93Å; I4-N7 PolarHBondContact O-N 3.04Å; I4-I8 HydrophobicContact CG2-CD1 3.67Å; I4-I8 HydrophobicContact CG2-CG1 4.42Å; I4-I8 WeakPolarHBondContact O-CD1 3.42Å; I4-I8 VanDerWaalsContact O-CG1 3.31Å; I4-I8 WeakPolarHBondContact O-CG1 3.39Å; I4-I8 PolarHBondContact O-N 3.41Å; I4-L46 HydrophobicContact CG2-CD1 3.49Å; I4-L46 VanDerWaalsContact CG2-CD1 3.49Å
5Y89.6Confident89.7Confident38 Ų3880.5 Ų80.515%0.14943%0.431CS..Hα-helixtrans-62-41.6175.2-69.2-64.3000112.1M1 P2 N7 I8 M9 M43 L46 M47 N50M1-Y5 WeakPolarHBondContact O-CD2 3.39Å; P2-Y5 PolarHBondContact O-N 3.23Å; Y5-N7 VanDerWaalsContact C-N 3.34Å; Y5-N7 PolarHBondContact O-N 3.29Å; Y5-I8 PolarHBondContact O-N 3.46Å; Y5-M9 WeakPolarHBondContact O-CB 3.34Å; Y5-M9 VanDerWaalsContact O-CG 3.26Å; Y5-M9 WeakPolarHBondContact O-CG 3.39Å; Y5-M9 PolarHBondContact O-N 3.22Å; Y5-M43 HydrophobicContact CD1-CG 4.06Å; Y5-M43 HydrophobicContact CE1-CG 4.16Å; Y5-L46 HydrophobicContact CE1-CB 4.01Å; Y5-L46 PolarHBondContact OH-O 3.48Å; Y5-M47 HydrophobicContact CD1-CE 3.97Å; Y5-M47 HydrophobicContact CE1-CE 3.48Å; Y5-M47 VanDerWaalsContact CE1-CE 3.48Å; Y5-M47 HydrophobicContact CE1-CG 3.93Å; Y5-M47 HydrophobicContact CE1-SD 3.85Å; Y5-M47 HydrophobicContact CE2-CE 4.16Å; Y5-M47 HydrophobicContact CE2-SD 4.39Å; Y5-M47 VanDerWaalsContact CZ-SD 3.57Å; Y5-M47 PolarHBondContact OH-N 2.92Å; Y5-M47 PolarHBondContact OH-SD 3.42Å; Y5-N50 PolarHBondContact OH-ND2 3.11Å
6M92.4Very high89.9Confident125 Ų12579.3 Ų79.362%0.61642%0.424SS*.Hα-helixtrans-59.6-44.1175.4-66.6-64.3-70.800111.8P2 L3 I4 M9 L10P2-M6 WeakPolarHBondContact O-CG 3.45Å; P2-M6 PolarHBondContact O-N 3.01Å; P2-M6 VanDerWaalsContact O-N 3.07Å; L3-M6 PolarHBondContact O-N 3.03Å; I4-M6 VanDerWaalsContact C-N 3.35Å; I4-M6 PolarHBondContact O-N 2.93Å; M6-M9 PolarHBondContact O-N 3.24Å; M6-L10 WeakPolarHBondContact O-CB 3.41Å; M6-L10 WeakPolarHBondContact O-CG 3.49Å; M6-L10 PolarHBondContact O-N 2.88Å
7N94.4Very high90Very high99 Ų9980.6 Ų80.653%0.52943%0.431SS..Hα-helixtrans-66.2-39.1178.6-72.7-4.1000112.6L3 I4 Y5 L10 A11L3-N7 PolarHBondContact O-N 3.39Å; I4-N7 PolarHBondContact O-N 3.04Å; Y5-N7 VanDerWaalsContact C-N 3.34Å; Y5-N7 PolarHBondContact O-N 3.29Å; N7-L10 WeakPolarHBondContact O-CB 3.35Å; N7-L10 PolarHBondContact O-N 3.15Å; N7-A11 PolarHBondContact O-N 3.04Å
8I94.1Very high90Very high17 Ų1777.9 Ų77.99%0.08743%0.425CS..Hα-helixtrans-69.7-40.4178-65.9162.5000110.8I4 Y5 L10 A11 F12 S39 I42 M43 L46I4-I8 HydrophobicContact CG2-CD1 3.67Å; I4-I8 HydrophobicContact CG2-CG1 4.42Å; I4-I8 WeakPolarHBondContact O-CD1 3.42Å; I4-I8 VanDerWaalsContact O-CG1 3.31Å; I4-I8 WeakPolarHBondContact O-CG1 3.39Å; I4-I8 PolarHBondContact O-N 3.41Å; Y5-I8 PolarHBondContact O-N 3.46Å; I8-L10 VanDerWaalsContact C-N 3.32Å; I8-L10 PolarHBondContact O-N 3.39Å; I8-A11 WeakPolarHBondContact O-CB 3.5Å; I8-A11 PolarHBondContact O-N 3Å; I8-F12 PolarHBondContact O-N 2.96Å; I8-S39 VanDerWaalsContact CG2-O 3.26Å; I8-S39 WeakPolarHBondContact CG2-O 3.43Å; I8-I42 HydrophobicContact CD1-CB 4.34Å; I8-I42 HydrophobicContact CD1-CG2 3.52Å; I8-I42 HydrophobicContact CG1-CG2 4.23Å; I8-M43 HydrophobicContact CG2-CB 4.04Å; I8-L46 HydrophobicContact CD1-CD1 3.33Å
9M92.5Very high89.9Confident87 Ų8775.9 Ų75.943%0.42941%0.413SS..Hα-helixtrans-62.8-40.7173.9-71-58.7-66.500111.3Y5 M6 F12 T13 M43Y5-M9 WeakPolarHBondContact O-CB 3.34Å; Y5-M9 VanDerWaalsContact O-CG 3.26Å; Y5-M9 WeakPolarHBondContact O-CG 3.39Å; Y5-M9 PolarHBondContact O-N 3.22Å; M6-M9 PolarHBondContact O-N 3.24Å; M9-F12 PolarHBondContact O-N 3.37Å; M9-T13 WeakPolarHBondContact O-CG2 3.39Å; M9-T13 PolarHBondContact O-N 3.44Å; M9-T13 PolarHBondContact O-OG1 3.47Å; M9-M43 HydrophobicContact CG-SD 4.37Å; M9-M43 HydrophobicContact SD-CE 4.01Å; M9-M43 HydrophobicContact SD-SD 3.58Å
10L94.4Very high89.8Confident95 Ų9577.3 Ų77.350%0.49742%0.419SS..Hα-helixtrans-58.9-47.6171.5-85.5157.1000111.4M6 N7 I8 F12 T13 I14M6-L10 WeakPolarHBondContact O-CB 3.41Å; M6-L10 WeakPolarHBondContact O-CG 3.49Å; M6-L10 PolarHBondContact O-N 2.88Å; N7-L10 WeakPolarHBondContact O-CB 3.35Å; N7-L10 PolarHBondContact O-N 3.15Å; I8-L10 VanDerWaalsContact C-N 3.32Å; I8-L10 PolarHBondContact O-N 3.39Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.43Å; L10-T13 WeakPolarHBondContact CA-OG1 3.31Å; L10-T13 PolarHBondContact O-N 3.12Å; L10-T13 VanDerWaalsContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.32Å; L10-I14 VanDerWaalsContact O-CG1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 3.4Å
11A94.2Very high89.7Confident49 Ų4978.2 Ų78.241%0.40543%0.427SS..Hα-helixtrans-58.1-42.7176.700000112.4N7 I8 I14 S15N7-A11 PolarHBondContact O-N 3.04Å; I8-A11 WeakPolarHBondContact O-CB 3.5Å; I8-A11 PolarHBondContact O-N 3Å; A11-I14 PolarHBondContact O-N 3.44Å; A11-S15 PolarHBondContact O-N 3.24Å; A11-S15 PolarHBondContact O-OG 3.09Å; A11-S15 VanDerWaalsContact O-OG 3.08Å
12F94.1Very high89.9Confident51 Ų5179.4 Ų79.422%0.22443%0.425CS..Hα-helixtrans-61.9-43.5174.2-179.3-96.4000112.2I8 M9 L10 I14 S15 L16 M36 S39 L40I8-F12 PolarHBondContact O-N 2.96Å; M9-F12 PolarHBondContact O-N 3.37Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.43Å; F12-I14 VanDerWaalsContact C-N 3.34Å; F12-I14 PolarHBondContact O-N 3.01Å; F12-S15 PolarHBondContact O-N 2.98Å; F12-S15 PolarHBondContact O-OG 2.92Å; F12-L16 HydrophobicContact CE1-CD1 4.06Å; F12-L16 HydrophobicContact CZ-CD1 4.18Å; F12-L16 VanDerWaalsContact O-CB 3.25Å; F12-L16 WeakPolarHBondContact O-CB 3.37Å; F12-L16 PolarHBondContact O-N 3.46Å; F12-M36 HydrophobicContact CD2-CB 4.19Å; F12-M36 HydrophobicContact CD2-CG 4.21Å; F12-M36 HydrophobicContact CE2-CB 4.03Å; F12-M36 HydrophobicContact CE2-CG 4.11Å; F12-M36 HydrophobicContact CE2-SD 4.38Å; F12-S39 WeakPolarHBondContact CD2-OG 3.26Å; F12-L40 HydrophobicContact CD2-CD2 4.26Å; F12-L40 HydrophobicContact CD2-CG 4.1Å; F12-L40 HydrophobicContact CE2-CD1 4.01Å; F12-L40 HydrophobicContact CE2-CD2 4.14Å; F12-L40 HydrophobicContact CE2-CG 3.97Å
13T93.5Very high89.7Confident62 Ų6284.2 Ų84.238%0.3843%0.43SS..Hα-helixtrans-66.3-35.617858.20000112.7M9 L10 L17M9-T13 WeakPolarHBondContact O-CG2 3.39Å; M9-T13 PolarHBondContact O-N 3.44Å; M9-T13 PolarHBondContact O-OG1 3.47Å; L10-T13 WeakPolarHBondContact CA-OG1 3.31Å; L10-T13 PolarHBondContact O-N 3.12Å; L10-T13 VanDerWaalsContact O-N 3.14Å; L10-T13 PolarHBondContact O-OG1 3.32Å; T13-L17 WeakPolarHBondContact O-CB 3.47Å; T13-L17 WeakPolarHBondContact O-CD1 3.48Å; T13-L17 VanDerWaalsContact O-CG 3.23Å; T13-L17 WeakPolarHBondContact O-CG 3.39Å; T13-L17 PolarHBondContact O-N 2.98Å
14I93.3Very high88.9Confident112 Ų11283.4 Ų83.457%0.57444%0.436SS*.Hα-helixtrans-69.6-43178.2-66.3161.9000110.7L10 A11 F12 L17 G18L10-I14 VanDerWaalsContact O-CG1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 3.4Å; A11-I14 PolarHBondContact O-N 3.44Å; F12-I14 VanDerWaalsContact C-N 3.34Å; F12-I14 PolarHBondContact O-N 3.01Å; I14-L17 PolarHBondContact O-N 3.01Å; I14-G18 PolarHBondContact O-N 3.15Å
15S92.1Very high88.4Confident18 Ų1886 Ų8613%0.12645%0.446CS..Hα-helixtrans-68.2-36.5176.654.70000112.2A11 F12 G18 M19 M36A11-S15 PolarHBondContact O-N 3.24Å; A11-S15 PolarHBondContact O-OG 3.09Å; A11-S15 VanDerWaalsContact O-OG 3.08Å; F12-S15 PolarHBondContact O-N 2.98Å; F12-S15 PolarHBondContact O-OG 2.92Å; S15-G18 PolarHBondContact O-N 2.67Å; S15-M19 PolarHBondContact O-N 3.47Å; S15-M36 WeakPolarHBondContact OG-CG 3.49Å
16L92.2Very high88Confident60 Ų6087.9 Ų87.931%0.31446%0.458SS..Hα-helixtrans-63.9-45172.4-175.7128.9000112.1F12 G18 M19 L20 M36F12-L16 HydrophobicContact CE1-CD1 4.06Å; F12-L16 HydrophobicContact CZ-CD1 4.18Å; F12-L16 VanDerWaalsContact O-CB 3.25Å; F12-L16 WeakPolarHBondContact O-CB 3.37Å; F12-L16 PolarHBondContact O-N 3.46Å; L16-G18 VanDerWaalsContact C-N 3.3Å; L16-G18 PolarHBondContact O-N 3.35Å; L16-M19 PolarHBondContact O-N 3.44Å; L16-L20 HydrophobicContact CD2-CD1 3.74Å; L16-L20 HydrophobicContact CG-CD1 4.38Å; L16-L20 WeakPolarHBondContact O-CG 3.25Å; L16-L20 PolarHBondContact O-N 2.97Å; L16-M36 HydrophobicContact CB-SD 3.85Å; L16-M36 HydrophobicContact CD1-SD 4.2Å; L16-M36 HydrophobicContact CG-SD 4.36Å
17L92.1Very high87.6Confident103 Ų10387 Ų8754%0.53945%0.454SS..Hα-helixtrans-61.3-40173.2-75.2165.5000111.5T13 I14 M19 L20 V21T13-L17 WeakPolarHBondContact O-CB 3.47Å; T13-L17 WeakPolarHBondContact O-CD1 3.48Å; T13-L17 VanDerWaalsContact O-CG 3.23Å; T13-L17 WeakPolarHBondContact O-CG 3.39Å; T13-L17 PolarHBondContact O-N 2.98Å; I14-L17 PolarHBondContact O-N 3.01Å; L17-M19 VanDerWaalsContact C-N 3.32Å; L17-M19 PolarHBondContact O-N 3.31Å; L17-L20 PolarHBondContact O-N 3.32Å; L17-V21 WeakPolarHBondContact O-CG2 3.23Å; L17-V21 PolarHBondContact O-N 3.32Å
18G89.8Confident87.1Confident32 Ų3284.4 Ų84.433%0.3344%0.444SS..Hα-helixtrans-61.7-36.1175.500000113.6I14 S15 L16I14-G18 PolarHBondContact O-N 3.15Å; S15-G18 PolarHBondContact O-N 2.67Å; L16-G18 VanDerWaalsContact C-N 3.3Å; L16-G18 PolarHBondContact O-N 3.35Å
19M88.1Confident86.8Confident40 Ų4084.4 Ų84.420%0.19745%0.445CS..Hα-helixtrans-72.8-41.9175.2-178.5-91.6-76.300112.3S15 L16 L17 V21 C32 M36S15-M19 PolarHBondContact O-N 3.47Å; L16-M19 PolarHBondContact O-N 3.44Å; L17-M19 VanDerWaalsContact C-N 3.32Å; L17-M19 PolarHBondContact O-N 3.31Å; M19-V21 VanDerWaalsContact C-N 3.32Å; M19-V21 PolarHBondContact O-N 2.97Å; M19-C32 HydrophobicContact CB-CB 4.11Å; M19-M36 HydrophobicContact CB-CE 4.16Å; M19-M36 HydrophobicContact CE-CE 3.91Å; M19-M36 HydrophobicContact CG-CE 4.28Å
20L88.1Confident86.6Confident102 Ų10281.6 Ų81.653%0.53443%0.432SS..Hα-helixtrans-66.7-33178.4-70173.2000112.6L16 L17 Y22L16-L20 HydrophobicContact CD2-CD1 3.74Å; L16-L20 HydrophobicContact CG-CD1 4.38Å; L16-L20 WeakPolarHBondContact O-CG 3.25Å; L16-L20 PolarHBondContact O-N 2.97Å; L17-L20 PolarHBondContact O-N 3.32Å; L20-Y22 PolarHBondContact O-N 3.17Å
21V88.3Confident86.2Confident98 Ų9882.3 Ų82.359%0.59444%0.435SS*.SBendtrans-82.475.3172.1-176.40000108.5L17 M19 R23L17-V21 WeakPolarHBondContact O-CG2 3.23Å; L17-V21 PolarHBondContact O-N 3.32Å; M19-V21 VanDerWaalsContact C-N 3.32Å; M19-V21 PolarHBondContact O-N 2.97Å; V21-R23 PolarHBondContact O-N 3.17Å
22Y70.1Confident86Confident174 Ų17481.5 Ų81.568%0.68243%0.426SS*.  trans-55.6110.2176.4-72.8-75.6000110.7L20L20-Y22 PolarHBondContact O-N 3.17Å
23R70.1Confident85.8Confident198 Ų19882.4 Ų82.475%0.74743%0.433SS*.  trans-86.8158.4161.4-73.7-156.9163165.7-1.5109.9V21 H25V21-R23 PolarHBondContact O-N 3.17Å; R23-H25 PolarHBondContact O-N 2.67Å
24S72.7Confident85.6Confident115 Ų11584.3 Ų84.380%0.80444%0.438SS*.SBendtrans-51.7-22.9-177.251.70000114.9
25H81Confident85.5Confident130 Ų13080.4 Ų80.460%0.60243%0.426SS*.  trans-97.2109.5-178.9-62.6-69.8000111.9R23 M27 S28R23-H25 PolarHBondContact O-N 2.67Å; H25-M27 PolarHBondContact O-N 3.21Å; H25-S28 WeakPolarHBondContact O-CB 3.38Å; H25-S28 PolarHBondContact O-N 3.34Å; H25-S28 PolarHBondContact O-OG 3.1Å
26L79.7Confident85.5Confident79 Ų7980.2 Ų80.241%0.41442%0.423SS..Hα-helixtrans-62.7-25.5177.7-164142.1000112.7S28 S29 L30 L78 I81L26-S28 VanDerWaalsContact C-N 3.29Å; L26-S28 PolarHBondContact O-N 3.2Å; L26-S29 PolarHBondContact O-N 3.48Å; L26-S29 PolarHBondContact O-OG 2.95Å; L26-L30 HydrophobicContact CD2-CG 4.4Å; L26-L30 PolarHBondContact O-N 3.48Å; L26-L30 VanDerWaalsContact O-N 3.15Å; L26-L78 HydrophobicContact CB-CD2 3.69Å; L26-L78 HydrophobicContact CD2-CD1 4.1Å; L26-L78 HydrophobicContact CD2-CD2 3.23Å; L26-L78 HydrophobicContact CD2-CG 3.41Å; L26-L78 VanDerWaalsContact CD2-CG 3.41Å; L26-L78 HydrophobicContact CG-CD2 4Å; L26-I81 HydrophobicContact CD1-CD1 4.35Å
27M84.4Confident85.6Confident105 Ų10579.4 Ų79.452%0.51742%0.418SS..Hα-helixtrans-54-41.5168-72.4-66.1-6700113.2H25 S29 L30 L31 L78H25-M27 PolarHBondContact O-N 3.21Å; M27-S29 VanDerWaalsContact C-N 3.33Å; M27-S29 PolarHBondContact O-N 3.42Å; M27-L30 PolarHBondContact O-N 2.88Å; M27-L31 PolarHBondContact O-N 2.96Å; M27-L78 HydrophobicContact CG-CD1 4.18Å; M27-L78 HydrophobicContact SD-CD1 3.31Å; M27-L78 WeakPolarHBondContact SD-CD1 3.39Å
28S84.9Confident85.6Confident46 Ų4679.3 Ų79.332%0.32242%0.417SS..Hα-helixtrans-68.1-34.6-179.666.50000112.2H25 L26 L31 C32H25-S28 WeakPolarHBondContact O-CB 3.38Å; H25-S28 PolarHBondContact O-N 3.34Å; H25-S28 PolarHBondContact O-OG 3.1Å; L26-S28 VanDerWaalsContact C-N 3.29Å; L26-S28 PolarHBondContact O-N 3.2Å; S28-L31 PolarHBondContact O-N 3.48Å; S28-C32 PolarHBondContact O-N 2.99Å; S28-C32 VanDerWaalsContact O-N 3.11Å; S28-C32 PolarHBondContact O-SG 3.48Å; S28-C32 VanDerWaalsContact O-SG 3.34Å
29S86.6Confident85.8Confident16 Ų1678.1 Ų78.111%0.11240%0.404CS..Hα-helixtrans-68.7-34.7175.468.70000112.8L26 M27 C32 L33L26-S29 PolarHBondContact O-N 3.48Å; L26-S29 PolarHBondContact O-OG 2.95Å; M27-S29 VanDerWaalsContact C-N 3.33Å; M27-S29 PolarHBondContact O-N 3.42Å; S29-C32 WeakPolarHBondContact O-CB 3.49Å; S29-C32 PolarHBondContact O-N 3.49Å; S29-L33 PolarHBondContact O-N 3.35Å
30L87.9Confident85.9Confident28 Ų2878.9 Ų78.915%0.14741%0.409CS..Hα-helixtrans-66.6-41.3174.2-70.9-171.5000112.1L26 M27 C32 L33 E34 L75 L78L26-L30 HydrophobicContact CD2-CG 4.4Å; L26-L30 PolarHBondContact O-N 3.48Å; L26-L30 VanDerWaalsContact O-N 3.15Å; M27-L30 PolarHBondContact O-N 2.88Å; L30-C32 VanDerWaalsContact C-N 3.27Å; L30-C32 PolarHBondContact O-N 3.34Å; L30-L33 HydrophobicContact CD2-CD1 4.23Å; L30-L33 WeakPolarHBondContact O-CB 3.08Å; L30-L33 PolarHBondContact O-N 2.9Å; L30-L33 VanDerWaalsContact O-N 3.1Å; L30-E34 PolarHBondContact O-N 2.93Å; L30-L75 HydrophobicContact CD1-CD2 4.13Å; L30-L75 HydrophobicContact CD1-CG 4.38Å; L30-L78 HydrophobicContact CD1-CD1 3.2Å; L30-L78 HydrophobicContact CD1-CG 4.09Å; L30-L78 HydrophobicContact CG-CD1 4.22Å
31L88.1Confident86.2Confident110 Ų11076.8 Ų76.858%0.57640%0.395SS*.Hα-helixtrans-62.7-36174.3-68174.2000111.8M27 S28 E34 G35M27-L31 PolarHBondContact O-N 2.96Å; S28-L31 PolarHBondContact O-N 3.48Å; L31-E34 PolarHBondContact O-N 3.46Å; L31-G35 PolarHBondContact O-N 3.46Å
32C89.8Confident86.4Confident32 Ų3275.3 Ų75.322%0.21638%0.383CS..Hα-helixtrans-65.4-37.9172.7-68.10000112.3M19 S28 S29 L30 G35 M36M19-C32 HydrophobicContact CB-CB 4.11Å; S28-C32 PolarHBondContact O-N 2.99Å; S28-C32 VanDerWaalsContact O-N 3.11Å; S28-C32 PolarHBondContact O-SG 3.48Å; S28-C32 VanDerWaalsContact O-SG 3.34Å; S29-C32 WeakPolarHBondContact O-CB 3.49Å; S29-C32 PolarHBondContact O-N 3.49Å; L30-C32 VanDerWaalsContact C-N 3.27Å; L30-C32 PolarHBondContact O-N 3.34Å; C32-G35 PolarHBondContact O-N 3.1Å; C32-M36 WeakPolarHBondContact O-CG 3.26Å; C32-M36 PolarHBondContact O-N 3.37Å
33L88.6Confident87.4Confident70 Ų7069.4 Ų69.437%0.36636%0.362SS..Hα-helixtrans-62.6-45.9172.5-87.8160.3000112.1S29 L30 G35 M36 M37S29-L33 PolarHBondContact O-N 3.35Å; L30-L33 HydrophobicContact CD2-CD1 4.23Å; L30-L33 WeakPolarHBondContact O-CB 3.08Å; L30-L33 PolarHBondContact O-N 2.9Å; L30-L33 VanDerWaalsContact O-N 3.1Å; L33-G35 VanDerWaalsContact C-N 3.3Å; L33-G35 PolarHBondContact O-N 3.42Å; L33-M36 HydrophobicContact CB-CE 4.38Å; L33-M36 HydrophobicContact CD2-CE 3.51Å; L33-M36 HydrophobicContact CG-CE 3.86Å; L33-M36 PolarHBondContact O-N 2.94Å; L33-M37 WeakPolarHBondContact O-CG 3.48Å; L33-M37 PolarHBondContact O-N 3.09Å
34E90.4Very high88.3Confident102 Ų10261.4 Ų61.448%0.47734%0.339SS..Hα-helixtrans-60.2-40.8174.4-71.4-175.2168.100111.8L30 L31 M36 M37 L38L30-E34 PolarHBondContact O-N 2.93Å; L31-E34 PolarHBondContact O-N 3.46Å; E34-M36 PolarHBondContact O-N 3.14Å; E34-M37 PolarHBondContact O-N 2.73Å; E34-L38 WeakPolarHBondContact O-CB 3.41Å; E34-L38 PolarHBondContact O-N 3.04Å
35G90.6Very high89.1Confident31 Ų3157.1 Ų57.132%0.3231%0.308SS..Hα-helixtrans-62-39.6174.600000113.6L31 C32 L33 S39L31-G35 PolarHBondContact O-N 3.46Å; C32-G35 PolarHBondContact O-N 3.1Å; L33-G35 VanDerWaalsContact C-N 3.3Å; L33-G35 PolarHBondContact O-N 3.42Å; G35-S39 PolarHBondContact O-N 3.23Å; G35-S39 VanDerWaalsContact O-N 3.1Å; G35-S39 PolarHBondContact O-OG 3.39Å
36M92.5Very high89.5Confident14 Ų1453 Ų537%0.06929%0.29CS..Hα-helixtrans-63.1-48.2173.3-75.3-173.6-66.600111.2F12 S15 L16 M19 C32 L33 E34 L38 S39 L40F12-M36 HydrophobicContact CD2-CB 4.19Å; F12-M36 HydrophobicContact CD2-CG 4.21Å; F12-M36 HydrophobicContact CE2-CB 4.03Å; F12-M36 HydrophobicContact CE2-CG 4.11Å; F12-M36 HydrophobicContact CE2-SD 4.38Å; S15-M36 WeakPolarHBondContact OG-CG 3.49Å; L16-M36 HydrophobicContact CB-SD 3.85Å; L16-M36 HydrophobicContact CD1-SD 4.2Å; L16-M36 HydrophobicContact CG-SD 4.36Å; M19-M36 HydrophobicContact CB-CE 4.16Å; M19-M36 HydrophobicContact CE-CE 3.91Å; M19-M36 HydrophobicContact CG-CE 4.28Å; C32-M36 WeakPolarHBondContact O-CG 3.26Å; C32-M36 PolarHBondContact O-N 3.37Å; L33-M36 HydrophobicContact CB-CE 4.38Å; L33-M36 HydrophobicContact CD2-CE 3.51Å; L33-M36 HydrophobicContact CG-CE 3.86Å; L33-M36 PolarHBondContact O-N 2.94Å; E34-M36 PolarHBondContact O-N 3.14Å; M36-L38 VanDerWaalsContact C-N 3.32Å; M36-L38 PolarHBondContact O-N 2.93Å; M36-S39 PolarHBondContact O-N 2.99Å; M36-S39 PolarHBondContact O-OG 2.89Å; M36-L40 PolarHBondContact O-N 3.28Å; M36-L40 VanDerWaalsContact O-N 3.09Å
37M93.3Very high89.9Confident42 Ų4253.8 Ų53.821%0.20729%0.293CS..Hα-helixtrans-62.5-39.1-179.8-65.7-58-79.400112.2L33 E34 L40 F41 A67L33-M37 WeakPolarHBondContact O-CG 3.48Å; L33-M37 PolarHBondContact O-N 3.09Å; E34-M37 PolarHBondContact O-N 2.73Å; M37-L40 PolarHBondContact O-N 3.48Å; M37-F41 WeakPolarHBondContact O-CB 3.43Å; M37-F41 PolarHBondContact O-N 2.97Å; M37-A67 HydrophobicContact CB-CB 3.97Å; M37-A67 HydrophobicContact CE-CB 3.32Å; M37-A67 HydrophobicContact CG-CB 3.93Å; M37-A67 HydrophobicContact SD-CB 4.48Å
38L92.1Very high90.1Very high101 Ų10149.6 Ų49.653%0.52927%0.273SS..Hα-helixtrans-64.9-42.9176.4-170.9150.5000111.8E34 M36 L40 F41 I42E34-L38 WeakPolarHBondContact O-CB 3.41Å; E34-L38 PolarHBondContact O-N 3.04Å; M36-L38 VanDerWaalsContact C-N 3.32Å; M36-L38 PolarHBondContact O-N 2.93Å; L38-L40 PolarHBondContact O-N 3.19Å; L38-F41 WeakPolarHBondContact O-CB 3.46Å; L38-F41 PolarHBondContact O-N 3.35Å; L38-I42 HydrophobicContact CD2-CD1 3.47Å; L38-I42 VanDerWaalsContact CD2-CD1 3.47Å; L38-I42 HydrophobicContact CD2-CG1 4.19Å; L38-I42 WeakPolarHBondContact O-CG1 3.41Å; L38-I42 PolarHBondContact O-N 3.39Å
39S93.8Very high90.2Very high7 Ų753 Ų535%0.04929%0.287CS..Hα-helixtrans-63.8-39.1177.368.70000112.7I8 F12 G35 M36 I42 M43I8-S39 VanDerWaalsContact CG2-O 3.26Å; I8-S39 WeakPolarHBondContact CG2-O 3.43Å; F12-S39 WeakPolarHBondContact CD2-OG 3.26Å; G35-S39 PolarHBondContact O-N 3.23Å; G35-S39 VanDerWaalsContact O-N 3.1Å; G35-S39 PolarHBondContact O-OG 3.39Å; M36-S39 PolarHBondContact O-N 2.99Å; M36-S39 PolarHBondContact O-OG 2.89Å; S39-I42 PolarHBondContact O-N 3.27Å; S39-M43 PolarHBondContact O-N 3.3Å
40L91.5Very high90.1Very high57 Ų5756.1 Ų56.130%0.29830%0.302SS..Hα-helixtrans-65.1-39.7173.7-71.4174.7000111.9F12 M36 M37 L38 M43 A44F12-L40 HydrophobicContact CD2-CD2 4.26Å; F12-L40 HydrophobicContact CD2-CG 4.1Å; F12-L40 HydrophobicContact CE2-CD1 4.01Å; F12-L40 HydrophobicContact CE2-CD2 4.14Å; F12-L40 HydrophobicContact CE2-CG 3.97Å; M36-L40 PolarHBondContact O-N 3.28Å; M36-L40 VanDerWaalsContact O-N 3.09Å; M37-L40 PolarHBondContact O-N 3.48Å; L38-L40 PolarHBondContact O-N 3.19Å; L40-M43 HydrophobicContact CD2-CE 4.16Å; L40-M43 PolarHBondContact O-N 3.13Å; L40-A44 WeakPolarHBondContact O-CB 3.42Å; L40-A44 PolarHBondContact O-N 3.17Å
41F93.3Very high89.9Confident58 Ų5859.2 Ų59.225%0.25432%0.322SS..Hα-helixtrans-61.5-46.2175.2175.7-100.8000112.1M37 L38 M43 A44 T45 P60 L64M37-F41 WeakPolarHBondContact O-CB 3.43Å; M37-F41 PolarHBondContact O-N 2.97Å; L38-F41 WeakPolarHBondContact O-CB 3.46Å; L38-F41 PolarHBondContact O-N 3.35Å; F41-M43 VanDerWaalsContact C-N 3.33Å; F41-M43 PolarHBondContact O-N 3.42Å; F41-A44 PolarHBondContact O-N 3.05Å; F41-T45 HydrophobicContact CD1-CG2 4.32Å; F41-T45 HydrophobicContact CD2-CG2 4.17Å; F41-T45 HydrophobicContact CE1-CG2 3.88Å; F41-T45 HydrophobicContact CE2-CG2 3.71Å; F41-T45 HydrophobicContact CG-CG2 4.46Å; F41-T45 HydrophobicContact CZ-CG2 3.56Å; F41-T45 WeakPolarHBondContact O-CB 3.39Å; F41-T45 WeakPolarHBondContact O-CG2 3.46Å; F41-T45 PolarHBondContact O-N 3.34Å; F41-T45 PolarHBondContact O-OG1 2.96Å; F41-P60 HydrophobicContact CD2-CB 3.67Å; F41-P60 WeakPolarHBondContact CD2-O 3.12Å; F41-P60 HydrophobicContact CE2-CB 3.48Å; F41-P60 VanDerWaalsContact CE2-CB 3.48Å; F41-L64 HydrophobicContact CD1-CD1 4.42Å; F41-L64 HydrophobicContact CD2-CD1 3.55Å; F41-L64 HydrophobicContact CD2-CD2 4.3Å; F41-L64 HydrophobicContact CD2-CG 3.56Å; F41-L64 HydrophobicContact CE1-CD1 4.2Å; F41-L64 HydrophobicContact CE2-CD1 3.26Å; F41-L64 HydrophobicContact CE2-CG 3.81Å; F41-L64 HydrophobicContact CG-CD1 4.12Å; F41-L64 HydrophobicContact CG-CD2 4.33Å; F41-L64 HydrophobicContact CG-CG 4.08Å; F41-L64 HydrophobicContact CZ-CD1 3.62Å
42I92.7Very high89.7Confident66 Ų6662 Ų6234%0.33833%0.332SS..Hα-helixtrans-63.7-40.9177.6-62174.2000110.4I8 L38 S39 T45 L46I8-I42 HydrophobicContact CD1-CB 4.34Å; I8-I42 HydrophobicContact CD1-CG2 3.52Å; I8-I42 HydrophobicContact CG1-CG2 4.23Å; L38-I42 HydrophobicContact CD2-CD1 3.47Å; L38-I42 VanDerWaalsContact CD2-CD1 3.47Å; L38-I42 HydrophobicContact CD2-CG1 4.19Å; L38-I42 WeakPolarHBondContact O-CG1 3.41Å; L38-I42 PolarHBondContact O-N 3.39Å; S39-I42 PolarHBondContact O-N 3.27Å; I42-T45 WeakPolarHBondContact CA-OG1 3.26Å; I42-T45 PolarHBondContact O-OG1 3.31Å; I42-L46 HydrophobicContact CG2-CD1 3.88Å; I42-L46 HydrophobicContact CG2-CG 4.35Å; I42-L46 WeakPolarHBondContact O-CB 3.47Å; I42-L46 VanDerWaalsContact O-CG 3.26Å; I42-L46 WeakPolarHBondContact O-CG 3.43Å; I42-L46 PolarHBondContact O-N 3.02Å
43M91.4Very high89.2Confident50 Ų5062.6 Ų62.625%0.24634%0.337CS..Hα-helixtrans-63.7-45.2177.7-171.516274.200112Y5 I8 M9 S39 L40 F41 L46 M47Y5-M43 HydrophobicContact CD1-CG 4.06Å; Y5-M43 HydrophobicContact CE1-CG 4.16Å; I8-M43 HydrophobicContact CG2-CB 4.04Å; M9-M43 HydrophobicContact CG-SD 4.37Å; M9-M43 HydrophobicContact SD-CE 4.01Å; M9-M43 HydrophobicContact SD-SD 3.58Å; S39-M43 PolarHBondContact O-N 3.3Å; L40-M43 HydrophobicContact CD2-CE 4.16Å; L40-M43 PolarHBondContact O-N 3.13Å; F41-M43 VanDerWaalsContact C-N 3.33Å; F41-M43 PolarHBondContact O-N 3.42Å; M43-L46 PolarHBondContact O-N 2.93Å; M43-M47 WeakPolarHBondContact O-CG 3.29Å; M43-M47 PolarHBondContact O-N 3.42Å
44A89.3Confident88.8Confident30 Ų3066.9 Ų66.925%0.24836%0.359CS..Hα-helixtrans-64.2-45.917900000111.5L40 F41 L46 M47 T48 P60L40-A44 WeakPolarHBondContact O-CB 3.42Å; L40-A44 PolarHBondContact O-N 3.17Å; F41-A44 PolarHBondContact O-N 3.05Å; A44-L46 PolarHBondContact O-N 3.4Å; A44-M47 PolarHBondContact O-N 2.92Å; A44-T48 WeakPolarHBondContact O-CG2 3.47Å; A44-T48 PolarHBondContact O-N 3.18Å; A44-T48 PolarHBondContact O-OG1 3.3Å; A44-P60 HydrophobicContact CB-CB 4.45Å; A44-P60 HydrophobicContact CB-CG 4Å
45T89.6Confident88.4Confident25 Ų2569.3 Ų69.315%0.15338%0.375CS..Hα-helixtrans-63.3-40.1177.4520000112.5F41 I42 M47 T48 L49 P60F41-T45 HydrophobicContact CD1-CG2 4.32Å; F41-T45 HydrophobicContact CD2-CG2 4.17Å; F41-T45 HydrophobicContact CE1-CG2 3.88Å; F41-T45 HydrophobicContact CE2-CG2 3.71Å; F41-T45 HydrophobicContact CG-CG2 4.46Å; F41-T45 HydrophobicContact CZ-CG2 3.56Å; F41-T45 WeakPolarHBondContact O-CB 3.39Å; F41-T45 WeakPolarHBondContact O-CG2 3.46Å; F41-T45 PolarHBondContact O-N 3.34Å; F41-T45 PolarHBondContact O-OG1 2.96Å; I42-T45 WeakPolarHBondContact CA-OG1 3.26Å; I42-T45 PolarHBondContact O-OG1 3.31Å; T45-M47 VanDerWaalsContact C-N 3.32Å; T45-M47 PolarHBondContact O-N 3.1Å; T45-T48 WeakPolarHBondContact CA-OG1 3.26Å; T45-T48 PolarHBondContact O-N 3.23Å; T45-T48 PolarHBondContact O-OG1 3.03Å; T45-L49 WeakPolarHBondContact O-CB 3.5Å; T45-L49 WeakPolarHBondContact O-CG 3.26Å; T45-L49 PolarHBondContact O-N 3.45Å; T45-P60 HydrophobicContact CG2-CB 3.69Å; T45-P60 HydrophobicContact CG2-CG 3.94Å
46L89.9Confident88Confident44 Ų4469.3 Ų69.323%0.2337%0.372CS..Hα-helixtrans-64.3-38174.7-74.3170.2000112.2I4 Y5 I8 I42 M43 A44 N50I4-L46 HydrophobicContact CG2-CD1 3.49Å; I4-L46 VanDerWaalsContact CG2-CD1 3.49Å; Y5-L46 HydrophobicContact CE1-CB 4.01Å; Y5-L46 PolarHBondContact OH-O 3.48Å; I8-L46 HydrophobicContact CD1-CD1 3.33Å; I42-L46 HydrophobicContact CG2-CD1 3.88Å; I42-L46 HydrophobicContact CG2-CG 4.35Å; I42-L46 WeakPolarHBondContact O-CB 3.47Å; I42-L46 VanDerWaalsContact O-CG 3.26Å; I42-L46 WeakPolarHBondContact O-CG 3.43Å; I42-L46 PolarHBondContact O-N 3.02Å; M43-L46 PolarHBondContact O-N 2.93Å; A44-L46 PolarHBondContact O-N 3.4Å; L46-N50 VanDerWaalsContact O-CB 3.3Å; L46-N50 WeakPolarHBondContact O-CB 3.36Å; L46-N50 PolarHBondContact O-N 2.95Å; L46-N50 PolarHBondContact O-ND2 3.34Å; L46-N50 VanDerWaalsContact O-ND2 3.08Å
47M87.9Confident87.5Confident96 Ų9672.2 Ų72.247%0.47339%0.387SS..Hα-helixtrans-66.7-43.1175.8-73.5-63.1-172.700112.2Y5 M43 A44 T45 N50 T51Y5-M47 HydrophobicContact CD1-CE 3.97Å; Y5-M47 HydrophobicContact CE1-CE 3.48Å; Y5-M47 VanDerWaalsContact CE1-CE 3.48Å; Y5-M47 HydrophobicContact CE1-CG 3.93Å; Y5-M47 HydrophobicContact CE1-SD 3.85Å; Y5-M47 HydrophobicContact CE2-CE 4.16Å; Y5-M47 HydrophobicContact CE2-SD 4.39Å; Y5-M47 VanDerWaalsContact CZ-SD 3.57Å; Y5-M47 PolarHBondContact OH-N 2.92Å; Y5-M47 PolarHBondContact OH-SD 3.42Å; M43-M47 WeakPolarHBondContact O-CG 3.29Å; M43-M47 PolarHBondContact O-N 3.42Å; A44-M47 PolarHBondContact O-N 2.92Å; T45-M47 VanDerWaalsContact C-N 3.32Å; T45-M47 PolarHBondContact O-N 3.1Å; M47-N50 PolarHBondContact O-N 3.39Å; M47-T51 WeakPolarHBondContact O-CG2 3.33Å; M47-T51 PolarHBondContact O-N 3.27Å; M47-T51 VanDerWaalsContact O-N 3.11Å; M47-T51 PolarHBondContact O-OG1 3.11Å
48T87.6Confident87.3Confident17 Ų1775.7 Ų75.710%0.10441%0.406CS..Hα-helixtrans-67.3-37.7178.659.80000111.9A44 T45 T51 H52 S53 A56 P60A44-T48 WeakPolarHBondContact O-CG2 3.47Å; A44-T48 PolarHBondContact O-N 3.18Å; A44-T48 PolarHBondContact O-OG1 3.3Å; T45-T48 WeakPolarHBondContact CA-OG1 3.26Å; T45-T48 PolarHBondContact O-N 3.23Å; T45-T48 PolarHBondContact O-OG1 3.03Å; T48-T51 PolarHBondContact O-OG1 3.38Å; T48-H52 PolarHBondContact O-N 3.14Å; T48-S53 PolarHBondContact O-N 3.39Å; T48-A56 HydrophobicContact CG2-CB 3.69Å; T48-P60 HydrophobicContact CG2-CG 4.25Å
49L86.6Confident87.1Confident116 Ų11675 Ų7561%0.60741%0.406SS*.Hα-helixtrans-68-43.5175.5-71.1170.7000111.9T45 T51 H52T45-L49 WeakPolarHBondContact O-CB 3.5Å; T45-L49 WeakPolarHBondContact O-CG 3.26Å; T45-L49 PolarHBondContact O-N 3.45Å; L49-T51 VanDerWaalsContact C-N 3.3Å; L49-T51 PolarHBondContact O-N 3.31Å; L49-H52 PolarHBondContact O-N 3.49Å
50N85.5Confident86.8Confident82 Ų8274.8 Ų74.844%0.43940%0.404SS..Hα-helixtrans-65.7-31.4178.9-84.6-41.7000113.1Y5 L46 M47Y5-N50 PolarHBondContact OH-ND2 3.11Å; L46-N50 VanDerWaalsContact O-CB 3.3Å; L46-N50 WeakPolarHBondContact O-CB 3.36Å; L46-N50 PolarHBondContact O-N 2.95Å; L46-N50 PolarHBondContact O-ND2 3.34Å; L46-N50 VanDerWaalsContact O-ND2 3.08Å; M47-N50 PolarHBondContact O-N 3.39Å
51T84.1Confident86.8Confident93 Ų9376.7 Ų76.757%0.57141%0.413SS*.THydrogen-bonded Turntrans-91.60.5179.953.10000113.2M47 T48 L49 S53M47-T51 WeakPolarHBondContact O-CG2 3.33Å; M47-T51 PolarHBondContact O-N 3.27Å; M47-T51 VanDerWaalsContact O-N 3.11Å; M47-T51 PolarHBondContact O-OG1 3.11Å; T48-T51 PolarHBondContact O-OG1 3.38Å; L49-T51 VanDerWaalsContact C-N 3.3Å; L49-T51 PolarHBondContact O-N 3.31Å; T51-S53 PolarHBondContact O-N 2.91Å; T51-S53 PolarHBondContact OG1-OG 2.74Å
52H82.9Confident86.8Confident169 Ų16975.9 Ų75.978%0.78242%0.417SS*.THydrogen-bonded Turntrans49.926.8-175.8-66.2-71.6000114.2T48 L49 L54T48-H52 PolarHBondContact O-N 3.14Å; L49-H52 PolarHBondContact O-N 3.49Å; H52-L54 PolarHBondContact O-N 3.41Å
53S80.5Confident86.7Confident44 Ų4476.7 Ų76.731%0.30842%0.421SS..  trans-90.390.8-178.362.90000110.6T48 T51 L55 A56T48-S53 PolarHBondContact O-N 3.39Å; T51-S53 PolarHBondContact O-N 2.91Å; T51-S53 PolarHBondContact OG1-OG 2.74Å; S53-L55 VanDerWaalsContact C-N 3.26Å; S53-L55 PolarHBondContact O-N 2.9Å; S53-A56 PolarHBondContact O-N 3.21Å; S53-A56 VanDerWaalsContact O-N 3.13Å; S53-A56 VanDerWaalsContact OG-CB 3.26Å; S53-A56 WeakPolarHBondContact OG-CB 3.5Å
54L78.6Confident86.7Confident161 Ų16178 Ų7884%0.84343%0.429SS*.G310 helixtrans-59.4-34.9-179.2-67169.8000113.1H52 A56 N57H52-L54 PolarHBondContact O-N 3.41Å; L54-A56 VanDerWaalsContact C-N 3.31Å; L54-A56 PolarHBondContact O-N 3.36Å; L54-N57 VanDerWaalsContact O-CB 3.27Å; L54-N57 WeakPolarHBondContact O-CB 3.47Å; L54-N57 PolarHBondContact O-N 2.91Å
55L82.2Confident86.9Confident153 Ų15380.7 Ų80.780%0.80144%0.441SS*.G310 helixtrans-64.7-34.1177.6-72.8166.3000112.7S53 N57 I58S53-L55 VanDerWaalsContact C-N 3.26Å; S53-L55 PolarHBondContact O-N 2.9Å; L55-N57 PolarHBondContact O-N 3.08Å; L55-I58 PolarHBondContact O-N 2.92Å
56A83.5Confident87Confident31 Ų3186.4 Ų86.426%0.25646%0.464SS..G310 helixtrans-72.4-11179.600000112.7T48 S53 L54 I58 V59 P60T48-A56 HydrophobicContact CG2-CB 3.69Å; S53-A56 PolarHBondContact O-N 3.21Å; S53-A56 VanDerWaalsContact O-N 3.13Å; S53-A56 VanDerWaalsContact OG-CB 3.26Å; S53-A56 WeakPolarHBondContact OG-CB 3.5Å; L54-A56 VanDerWaalsContact C-N 3.31Å; L54-A56 PolarHBondContact O-N 3.36Å; A56-I58 PolarHBondContact O-N 3.45Å; A56-V59 WeakPolarHBondContact O-CB 3.43Å; A56-V59 PolarHBondContact O-N 3.41Å; A56-P60 WeakPolarHBondContact O-CD 3.4Å
57N81.4Confident87.1Confident74 Ų7485 Ų8540%0.39646%0.459SS..G310 helixtrans-67.2-15.6177.1-158.138.5000113.2L54 L55 V59 P60 I61L54-N57 VanDerWaalsContact O-CB 3.27Å; L54-N57 WeakPolarHBondContact O-CB 3.47Å; L54-N57 PolarHBondContact O-N 2.91Å; L55-N57 PolarHBondContact O-N 3.08Å; N57-V59 PolarHBondContact O-N 2.99Å; N57-P60 WeakPolarHBondContact O-CD 3.38Å; N57-I61 WeakPolarHBondContact O-CD1 3.42Å; N57-I61 WeakPolarHBondContact O-CG1 3.38Å
58I88.3Confident87.2Confident116 Ų11683.4 Ų83.460%0.59546%0.461SS*.Hα-helixtrans-65.5-31.7171.1-60.7171.5000110.6L55 A56 I61 A62L55-I58 PolarHBondContact O-N 2.92Å; A56-I58 PolarHBondContact O-N 3.45Å; I58-I61 PolarHBondContact O-N 3.35Å; I58-A62 WeakPolarHBondContact O-CB 3.37Å; I58-A62 PolarHBondContact O-N 3.02Å
59V88.2Confident87.4Confident87 Ų8786 Ų8653%0.52748%0.479SS..Hα-helixtrans-65.8-51.5-175.3178.60000112.2A56 N57 I61 A62 M63A56-V59 WeakPolarHBondContact O-CB 3.43Å; A56-V59 PolarHBondContact O-N 3.41Å; N57-V59 PolarHBondContact O-N 2.99Å; V59-I61 PolarHBondContact O-N 2.94Å; V59-A62 PolarHBondContact O-N 2.92Å; V59-M63 HydrophobicContact CG1-CG 4.44Å; V59-M63 VanDerWaalsContact O-CG 3.26Å; V59-M63 WeakPolarHBondContact O-CG 3.48Å; V59-M63 PolarHBondContact O-N 3.41Å
60P88.2Confident87.5Confident1 Ų186.4 Ų86.41%0.00648%0.478CS..Hα-helixtrans-56.8-35.5174.3-2430.4000114F41 A44 T45 T48 A56 N57 L64F41-P60 HydrophobicContact CD2-CB 3.67Å; F41-P60 WeakPolarHBondContact CD2-O 3.12Å; F41-P60 HydrophobicContact CE2-CB 3.48Å; F41-P60 VanDerWaalsContact CE2-CB 3.48Å; A44-P60 HydrophobicContact CB-CB 4.45Å; A44-P60 HydrophobicContact CB-CG 4Å; T45-P60 HydrophobicContact CG2-CB 3.69Å; T45-P60 HydrophobicContact CG2-CG 3.94Å; T48-P60 HydrophobicContact CG2-CG 4.25Å; A56-P60 WeakPolarHBondContact O-CD 3.4Å; N57-P60 WeakPolarHBondContact O-CD 3.38Å; P60-L64 PolarHBondContact O-N 3.44Å; P60-L64 VanDerWaalsContact O-N 3.13Å
61I90.9Very high87.7Confident97 Ų9783.5 Ų83.550%0.49747%0.465SS..Hα-helixtrans-70.7-46.9179.9-59.2166.6000110.3N57 I58 V59 M63 L64 V65N57-I61 WeakPolarHBondContact O-CD1 3.42Å; N57-I61 WeakPolarHBondContact O-CG1 3.38Å; I58-I61 PolarHBondContact O-N 3.35Å; V59-I61 PolarHBondContact O-N 2.94Å; I61-M63 VanDerWaalsContact C-N 3.28Å; I61-M63 PolarHBondContact O-N 3.46Å; I61-L64 PolarHBondContact O-N 3.25Å; I61-L64 VanDerWaalsContact O-N 3.17Å; I61-V65 WeakPolarHBondContact O-CG2 3.41Å; I61-V65 PolarHBondContact O-N 2.96Å; I61-V65 VanDerWaalsContact O-N 3.14Å
62A92.6Very high88.1Confident41 Ų4181.9 Ų81.934%0.33946%0.461SS..Hα-helixtrans-59.1-41.5175.400000111.6I58 V59 L64 V65 F66I58-A62 WeakPolarHBondContact O-CB 3.37Å; I58-A62 PolarHBondContact O-N 3.02Å; V59-A62 PolarHBondContact O-N 2.92Å; A62-L64 VanDerWaalsContact C-N 3.34Å; A62-L64 PolarHBondContact O-N 3.46Å; A62-V65 PolarHBondContact O-N 3.24Å; A62-F66 VanDerWaalsContact O-CD2 3.26Å; A62-F66 WeakPolarHBondContact O-CD2 3.45Å; A62-F66 PolarHBondContact O-N 3.46Å
63M91.4Very high88.4Confident83 Ų8378.1 Ų78.141%0.40945%0.45SS..Hα-helixtrans-57.9-42.8174.8-72.8-71.2-66.700112.4V59 I61 A67V59-M63 HydrophobicContact CG1-CG 4.44Å; V59-M63 VanDerWaalsContact O-CG 3.26Å; V59-M63 WeakPolarHBondContact O-CG 3.48Å; V59-M63 PolarHBondContact O-N 3.41Å; I61-M63 VanDerWaalsContact C-N 3.28Å; I61-M63 PolarHBondContact O-N 3.46Å; M63-A67 WeakPolarHBondContact O-CB 3.48Å; M63-A67 PolarHBondContact O-N 3.1Å
64L91.2Very high88.9Confident79 Ų7976.7 Ų76.741%0.41444%0.442SS..Hα-helixtrans-65.1-38.5177-86.2174.7000113.1F41 P60 I61 A62 A67 A68F41-L64 HydrophobicContact CD1-CD1 4.42Å; F41-L64 HydrophobicContact CD2-CD1 3.55Å; F41-L64 HydrophobicContact CD2-CD2 4.3Å; F41-L64 HydrophobicContact CD2-CG 3.56Å; F41-L64 HydrophobicContact CE1-CD1 4.2Å; F41-L64 HydrophobicContact CE2-CD1 3.26Å; F41-L64 HydrophobicContact CE2-CG 3.81Å; F41-L64 HydrophobicContact CG-CD1 4.12Å; F41-L64 HydrophobicContact CG-CD2 4.33Å; F41-L64 HydrophobicContact CG-CG 4.08Å; F41-L64 HydrophobicContact CZ-CD1 3.62Å; P60-L64 PolarHBondContact O-N 3.44Å; P60-L64 VanDerWaalsContact O-N 3.13Å; I61-L64 PolarHBondContact O-N 3.25Å; I61-L64 VanDerWaalsContact O-N 3.17Å; A62-L64 VanDerWaalsContact C-N 3.34Å; A62-L64 PolarHBondContact O-N 3.46Å; L64-A67 WeakPolarHBondContact O-CB 3.33Å; L64-A67 PolarHBondContact O-N 3.33Å; L64-A68 PolarHBondContact O-N 3.21Å
65V94.8Very high89.4Confident85 Ų8573 Ų7352%0.51542%0.422SS..Hα-helixtrans-63.6-47.5179.51760000110.4I61 A62 A67 A68 C69I61-V65 WeakPolarHBondContact O-CG2 3.41Å; I61-V65 PolarHBondContact O-N 2.96Å; I61-V65 VanDerWaalsContact O-N 3.14Å; A62-V65 PolarHBondContact O-N 3.24Å; V65-A67 VanDerWaalsContact C-N 3.33Å; V65-A67 PolarHBondContact O-N 3.21Å; V65-A68 PolarHBondContact O-N 3.43Å; V65-C69 PolarHBondContact O-N 3.27Å; V65-C69 VanDerWaalsContact O-N 3.1Å; V65-C69 PolarHBondContact O-SG 3.03Å
66F91.2Very high89.8Confident146 Ų14668.7 Ų68.764%0.6441%0.409SS*.Hα-helixtrans-64-38176.4-74.4-68000112.4A62 A68 C69 E70A62-F66 VanDerWaalsContact O-CD2 3.26Å; A62-F66 WeakPolarHBondContact O-CD2 3.45Å; A62-F66 PolarHBondContact O-N 3.46Å; F66-A68 VanDerWaalsContact C-N 3.34Å; F66-A68 PolarHBondContact O-N 2.93Å; F66-C69 WeakPolarHBondContact O-CB 3.31Å; F66-C69 PolarHBondContact O-N 3.35Å; F66-E70 PolarHBondContact O-N 3.44Å
67A90.8Very high90Very high14 Ų1472 Ų7212%0.11642%0.422CS..Hα-helixtrans-57-46.4174.500000112.5M37 M63 L64 V65 C69 E70 A71M37-A67 HydrophobicContact CB-CB 3.97Å; M37-A67 HydrophobicContact CE-CB 3.32Å; M37-A67 HydrophobicContact CG-CB 3.93Å; M37-A67 HydrophobicContact SD-CB 4.48Å; M63-A67 WeakPolarHBondContact O-CB 3.48Å; M63-A67 PolarHBondContact O-N 3.1Å; L64-A67 WeakPolarHBondContact O-CB 3.33Å; L64-A67 PolarHBondContact O-N 3.33Å; V65-A67 VanDerWaalsContact C-N 3.33Å; V65-A67 PolarHBondContact O-N 3.21Å; A67-C69 VanDerWaalsContact C-N 3.32Å; A67-C69 PolarHBondContact O-N 3.07Å; A67-E70 PolarHBondContact O-N 3.33Å; A67-A71 PolarHBondContact O-N 3.06Å
68A90.3Very high90.3Very high63 Ų6369.8 Ų69.852%0.52141%0.41SS..Hα-helixtrans-65.9-36.517900000111.8L64 V65 F66 A71 A72L64-A68 PolarHBondContact O-N 3.21Å; V65-A68 PolarHBondContact O-N 3.43Å; F66-A68 VanDerWaalsContact C-N 3.34Å; F66-A68 PolarHBondContact O-N 2.93Å; A68-A71 PolarHBondContact O-N 3.11Å; A68-A72 WeakPolarHBondContact O-CB 3.5Å; A68-A72 PolarHBondContact O-N 3.44Å
69C91.6Very high90.4Very high70 Ų7068.1 Ų68.147%0.47341%0.405SS..Hα-helixtrans-64.1-44.5174.2-65.40000112V65 F66 A67 A72 V73V65-C69 PolarHBondContact O-N 3.27Å; V65-C69 VanDerWaalsContact O-N 3.1Å; V65-C69 PolarHBondContact O-SG 3.03Å; F66-C69 WeakPolarHBondContact O-CB 3.31Å; F66-C69 PolarHBondContact O-N 3.35Å; A67-C69 VanDerWaalsContact C-N 3.32Å; A67-C69 PolarHBondContact O-N 3.07Å; C69-A72 PolarHBondContact O-N 3.16Å; C69-V73 WeakPolarHBondContact O-CG2 3.49Å; C69-V73 PolarHBondContact O-N 2.92Å; C69-V73 VanDerWaalsContact O-N 3.1Å
70E89.6Confident90.5Very high126 Ų12666.8 Ų66.859%0.58940%0.399SS*.Hα-helixtrans-62.5-43176.1-71.4-174.616600111.8F66 A67 A72 V73 G74F66-E70 PolarHBondContact O-N 3.44Å; A67-E70 PolarHBondContact O-N 3.33Å; E70-A72 PolarHBondContact O-N 2.87Å; E70-V73 PolarHBondContact O-N 3.47Å; E70-G74 PolarHBondContact O-N 2.98Å
71A89.8Confident90.5Very high21 Ų2171.2 Ų71.217%0.17442%0.422CS..Hα-helixtrans-63-40.9176.300000112.3A67 A68 V73 G74 L75A67-A71 PolarHBondContact O-N 3.06Å; A68-A71 PolarHBondContact O-N 3.11Å; A71-V73 PolarHBondContact O-N 3.4Å; A71-G74 PolarHBondContact O-N 3.44Å; A71-L75 WeakPolarHBondContact O-CG 3.36Å; A71-L75 PolarHBondContact O-N 2.76Å
72A91.3Very high90.3Very high58 Ų5870.7 Ų70.748%0.47943%0.427SS..Hα-helixtrans-62-42.8176.600000112.1A68 C69 E70 L75 A76A68-A72 WeakPolarHBondContact O-CB 3.5Å; A68-A72 PolarHBondContact O-N 3.44Å; C69-A72 PolarHBondContact O-N 3.16Å; E70-A72 PolarHBondContact O-N 2.87Å; A72-L75 PolarHBondContact O-N 3.05Å; A72-A76 PolarHBondContact O-N 3.13Å
73V91Very high90Very high91 Ų9174.9 Ų74.955%0.55244%0.444SS*.Hα-helixtrans-66.9-40.7174.9177.20000110.9C69 E70 A71 L75 A76 L77C69-V73 WeakPolarHBondContact O-CG2 3.49Å; C69-V73 PolarHBondContact O-N 2.92Å; C69-V73 VanDerWaalsContact O-N 3.1Å; E70-V73 PolarHBondContact O-N 3.47Å; A71-V73 PolarHBondContact O-N 3.4Å; V73-L75 PolarHBondContact O-N 3.39Å; V73-A76 PolarHBondContact O-N 3.36Å; V73-L77 HydrophobicContact CG1-CD1 4.47Å; V73-L77 WeakPolarHBondContact O-CG 3.34Å; V73-L77 PolarHBondContact O-N 3.32Å
74G89.4Confident89.3Confident13 Ų1378.8 Ų78.813%0.13447%0.472CS..Hα-helixtrans-59.9-42.5175.700000113.1E70 A71 L77 L78E70-G74 PolarHBondContact O-N 2.98Å; A71-G74 PolarHBondContact O-N 3.44Å; G74-L77 PolarHBondContact O-N 3.27Å; G74-L78 PolarHBondContact O-N 3.22Å
75L88.9Confident89.3Confident83 Ų8378.8 Ų78.844%0.43548%0.475SS..Hα-helixtrans-67-38.7174.6-72.1169.6000112.2L30 A71 A72 V73 L77 L78 V79L30-L75 HydrophobicContact CD1-CD2 4.13Å; L30-L75 HydrophobicContact CD1-CG 4.38Å; A71-L75 WeakPolarHBondContact O-CG 3.36Å; A71-L75 PolarHBondContact O-N 2.76Å; A72-L75 PolarHBondContact O-N 3.05Å; V73-L75 PolarHBondContact O-N 3.39Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 3.37Å; L75-L78 HydrophobicContact CD2-CD1 4.16Å; L75-L78 WeakPolarHBondContact O-CB 3.26Å; L75-L78 PolarHBondContact O-N 2.96Å; L75-V79 WeakPolarHBondContact O-CG2 3.2Å; L75-V79 PolarHBondContact O-N 3.16Å; L75-V79 VanDerWaalsContact O-N 3.09Å
76A90.9Very high89Confident63 Ų6378.4 Ų78.452%0.52147%0.473SS..Hα-helixtrans-62-41.217500000112A72 V73 V79 S80A72-A76 PolarHBondContact O-N 3.13Å; V73-A76 PolarHBondContact O-N 3.36Å; A76-V79 PolarHBondContact O-N 3.29Å; A76-S80 PolarHBondContact O-N 3.29Å; A76-S80 VanDerWaalsContact O-N 3.15Å
77L87.5Confident88.8Confident102 Ų10274.7 Ų74.753%0.53446%0.464SS..Hα-helixtrans-64.8-41.4174.9-72.4173.3000112V73 G74 L75 V79 S80 I81V73-L77 HydrophobicContact CG1-CD1 4.47Å; V73-L77 WeakPolarHBondContact O-CG 3.34Å; V73-L77 PolarHBondContact O-N 3.32Å; G74-L77 PolarHBondContact O-N 3.27Å; L75-L77 VanDerWaalsContact C-N 3.33Å; L75-L77 PolarHBondContact O-N 3.37Å; L77-V79 VanDerWaalsContact C-N 3.32Å; L77-V79 PolarHBondContact O-N 2.95Å; L77-S80 PolarHBondContact O-N 3.39Å; L77-S80 VanDerWaalsContact O-N 3.12Å; L77-S80 PolarHBondContact O-OG 3.04Å; L77-I81 WeakPolarHBondContact O-CG1 3.27Å; L77-I81 PolarHBondContact O-N 2.96Å
78L89.1Confident88.7Confident26 Ų2678.2 Ų78.214%0.13649%0.485CS..Hα-helixtrans-56.5-45.1174.4-90.4174.4000113.1L26 M27 L30 G74 L75 S80 I81 S82L26-L78 HydrophobicContact CB-CD2 3.69Å; L26-L78 HydrophobicContact CD2-CD1 4.1Å; L26-L78 HydrophobicContact CD2-CD2 3.23Å; L26-L78 HydrophobicContact CD2-CG 3.41Å; L26-L78 VanDerWaalsContact CD2-CG 3.41Å; L26-L78 HydrophobicContact CG-CD2 4Å; M27-L78 HydrophobicContact CG-CD1 4.18Å; M27-L78 HydrophobicContact SD-CD1 3.31Å; M27-L78 WeakPolarHBondContact SD-CD1 3.39Å; L30-L78 HydrophobicContact CD1-CD1 3.2Å; L30-L78 HydrophobicContact CD1-CG 4.09Å; L30-L78 HydrophobicContact CG-CD1 4.22Å; G74-L78 PolarHBondContact O-N 3.22Å; L75-L78 HydrophobicContact CD2-CD1 4.16Å; L75-L78 WeakPolarHBondContact O-CB 3.26Å; L75-L78 PolarHBondContact O-N 2.96Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 2.94Å; L78-I81 PolarHBondContact O-N 3.47Å; L78-S82 PolarHBondContact O-N 3.46Å; L78-S82 PolarHBondContact O-OG 2.96Å
79V90.6Very high88.6Confident81 Ų8179.2 Ų79.249%0.49148%0.482SS..Hα-helixtrans-63.2-37.7177.6174.30000110.7L75 A76 L77 S82 N83L75-V79 WeakPolarHBondContact O-CG2 3.2Å; L75-V79 PolarHBondContact O-N 3.16Å; L75-V79 VanDerWaalsContact O-N 3.09Å; A76-V79 PolarHBondContact O-N 3.29Å; L77-V79 VanDerWaalsContact C-N 3.32Å; L77-V79 PolarHBondContact O-N 2.95Å; V79-S82 WeakPolarHBondContact CA-OG 3.08Å; V79-S82 PolarHBondContact O-N 2.98Å; V79-S82 PolarHBondContact O-OG 3.08Å; V79-N83 WeakPolarHBondContact O-CB 3.38Å; V79-N83 PolarHBondContact O-N 3.28Å; V79-N83 VanDerWaalsContact O-N 3.11Å; V79-N83 PolarHBondContact O-ND2 3.44Å
80S89.8Confident88.4Confident59 Ų5979.8 Ų79.841%0.41348%0.483SS..Hα-helixtrans-65.2-38.5175.8740000112.7A76 L77 L78 N83 T84A76-S80 PolarHBondContact O-N 3.29Å; A76-S80 VanDerWaalsContact O-N 3.15Å; L77-S80 PolarHBondContact O-N 3.39Å; L77-S80 VanDerWaalsContact O-N 3.12Å; L77-S80 PolarHBondContact O-OG 3.04Å; L78-S80 VanDerWaalsContact C-N 3.27Å; L78-S80 PolarHBondContact O-N 2.94Å; S80-N83 PolarHBondContact O-N 3.45Å; S80-T84 WeakPolarHBondContact O-CG2 3.3Å; S80-T84 PolarHBondContact O-N 3.2Å
81I88.6Confident88.3Confident94 Ų9476.5 Ų76.548%0.48248%0.475SS..Hα-helixtrans-72.1-34.9177.4-63.8161.3000111.5L26 L77 L78 N83 T84L26-I81 HydrophobicContact CD1-CD1 4.35Å; L77-I81 WeakPolarHBondContact O-CG1 3.27Å; L77-I81 PolarHBondContact O-N 2.96Å; L78-I81 PolarHBondContact O-N 3.47Å; I81-N83 VanDerWaalsContact C-N 3.3Å; I81-T84 PolarHBondContact O-OG1 3.27Å
82S87Confident88.2Confident87 Ų8780.8 Ų80.861%0.60850%0.499SS*.Hα-helixtrans-73.6-24.5177.563.20000113.3L78 V79L78-S82 PolarHBondContact O-N 3.46Å; L78-S82 PolarHBondContact O-OG 2.96Å; V79-S82 WeakPolarHBondContact CA-OG 3.08Å; V79-S82 PolarHBondContact O-N 2.98Å; V79-S82 PolarHBondContact O-OG 3.08Å
83N86.1Confident88Confident128 Ų12882.7 Ų82.768%0.68450%0.5SS*.  trans-89.4-8.7-179.2-69.7-9.1000113.3V79 S80 I81V79-N83 WeakPolarHBondContact O-CB 3.38Å; V79-N83 PolarHBondContact O-N 3.28Å; V79-N83 VanDerWaalsContact O-N 3.11Å; V79-N83 PolarHBondContact O-ND2 3.44Å; S80-N83 PolarHBondContact O-N 3.45Å; I81-N83 VanDerWaalsContact C-N 3.3Å
84T76.9Confident87.7Confident165 Ų16581.9 Ų81.9100%1.01250%0.495SS*.  trans-93.70169.454.30000110.9S80 I81S80-T84 WeakPolarHBondContact O-CG2 3.3Å; S80-T84 PolarHBondContact O-N 3.2Å; I81-T84 PolarHBondContact O-OG1 3.27Å

Retrieved 84 of 84 residues in 135.6 ms (Link to these results)