A0A060YJL4_ONCMY Loading...

LYR motif-containing protein 9

AlphaFold DB (A0A674D3A1), UniProt , Accession A0A060YJL4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 77 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
1M52.6Low71.8Confident152 Ų15294.2 Ų94.275%0.74951%0.505SS*.  0146.60-78-174.7-77.100107.8D72M1-D72 HydrophobicContact CE-CB 3.73Å; M1-D72 VanDerWaalsContact CE-CG 3.46Å; M1-D72 WeakPolarHBondContact CE-OD2 3.46Å; M1-D72 HydrophobicContact SD-CB 4.35Å
2P55.9Low73.7Confident116 Ų11690.8 Ų90.875%0.75349%0.49SS*.PPolyproline II helixtrans-64142174.728.1-32.3000109.2
3P61.3Low75.5Confident63 Ų6387.8 Ų87.841%0.40948%0.478SS..PPolyproline II helixtrans-70.4156.2-179.332.6-37.1000110.9A7 I64 D68P3-A7 HydrophobicContact CB-CB 3.55Å; P3-A7 HydrophobicContact CG-CB 4.05Å; P3-I64 HydrophobicContact CB-CG2 4.05Å; P3-D68 VanDerWaalsContact CA-OD2 3.23Å; P3-D68 WeakPolarHBondContact CA-OD2 3.49Å; P3-D68 WeakPolarHBondContact CB-OD2 3.37Å
4L66.6Low76.9Confident52 Ų5286.1 Ų86.127%0.27247%0.472SS..PPolyproline II helixtrans-59.8152.8-179.2-71.7163.6000112.1G6 A7 Y19 D68 L71L4-G6 PolarHBondContact O-N 3.13Å; L4-G6 VanDerWaalsContact O-N 3.13Å; L4-A7 WeakPolarHBondContact O-CB 3.34Å; L4-A7 PolarHBondContact O-N 3.1Å; L4-Y19 WeakPolarHBondContact CB-OH 3.17Å; L4-D68 PolarHBondContact N-OD1 2.88Å; L4-L71 HydrophobicContact CD1-CD1 3.23Å
5P67.4Low78.2Confident127 Ų12785.9 Ų85.983%0.82547%0.466SS*.THydrogen-bonded Turntrans-49.6122.7177-25.332.4000111.6
6G68.9Low79.4Confident27 Ų2781.4 Ų81.428%0.27844%0.441SS..THydrogen-bonded Turntrans98-4.5-18000000115.8L4 E8 L9L4-G6 PolarHBondContact O-N 3.13Å; L4-G6 VanDerWaalsContact O-N 3.13Å; G6-E8 PolarHBondContact O-N 3.05Å; G6-L9 PolarHBondContact O-N 3.2Å
7A76.7Confident80.4Confident7 Ų780.5 Ų80.56%0.05843%0.431CS..G310 helixtrans-61.3-32.9169.800000112.5P3 L4 L9 V10 Y19 I64P3-A7 HydrophobicContact CB-CB 3.55Å; P3-A7 HydrophobicContact CG-CB 4.05Å; L4-A7 WeakPolarHBondContact O-CB 3.34Å; L4-A7 PolarHBondContact O-N 3.1Å; A7-L9 PolarHBondContact O-N 3.3Å; A7-L9 VanDerWaalsContact O-N 3.13Å; A7-V10 VanDerWaalsContact O-CB 3.3Å; A7-V10 WeakPolarHBondContact O-CB 3.47Å; A7-V10 PolarHBondContact O-N 3.16Å; A7-Y19 HydrophobicContact CB-CE2 4.18Å; A7-I64 HydrophobicContact CB-CD1 4.48Å; A7-I64 HydrophobicContact CB-CG2 3.98Å
8E78.1Confident81.3Confident162 Ų16284.1 Ų84.176%0.75744%0.437SS*.G310 helixtrans-61.8-20.4177.2-57.1179.1-176.100113.7G6G6-E8 PolarHBondContact O-N 3.05Å
9L82.8Confident82Confident126 Ų12680 Ų8066%0.6642%0.415SS*.G310 helixtrans-89.2-6.9178-56.9176.9000112.5G6 A7 R11 H15G6-L9 PolarHBondContact O-N 3.2Å; A7-L9 PolarHBondContact O-N 3.3Å; A7-L9 VanDerWaalsContact O-N 3.13Å; L9-R11 PolarHBondContact O-N 2.83Å; L9-R11 VanDerWaalsContact O-N 3.1Å; L9-H15 PolarHBondContact O-ND1 3.17Å; L9-H15 VanDerWaalsContact O-ND1 3.1Å
10V90.2Very high82.8Confident9 Ų977.1 Ų77.16%0.05540%0.4CS..  trans-82.891.4-179-175.60000109.3A7 H15 L16 Y19 I60 I64A7-V10 VanDerWaalsContact O-CB 3.3Å; A7-V10 WeakPolarHBondContact O-CB 3.47Å; A7-V10 PolarHBondContact O-N 3.16Å; V10-H15 HydrophobicContact CG1-CB 4.24Å; V10-L16 VanDerWaalsContact CG1-CA 3.46Å; V10-L16 HydrophobicContact CG1-CB 3.65Å; V10-L16 HydrophobicContact CG1-CD1 4.03Å; V10-L16 HydrophobicContact CG1-CG 4.48Å; V10-Y19 HydrophobicContact CG2-CD1 4.4Å; V10-Y19 HydrophobicContact CG2-CD2 4.13Å; V10-Y19 HydrophobicContact CG2-CG 3.85Å; V10-I60 HydrophobicContact CB-CG2 4.48Å; V10-I60 HydrophobicContact CG1-CG2 3.69Å; V10-I64 HydrophobicContact CB-CD1 3.92Å; V10-I64 HydrophobicContact CG1-CD1 4.07Å; V10-I64 HydrophobicContact CG2-CD1 4.43Å
11R89.4Confident83.4Confident195 Ų19575.7 Ų75.774%0.73639%0.393SS*.  trans-113.2-5.6179.2-59.2-173.1-179.3-162.3-0.1113.8L9L9-R11 PolarHBondContact O-N 2.83Å; L9-R11 VanDerWaalsContact O-N 3.1Å
12T95.1Very high85.4Confident53 Ų5375.1 Ų75.133%0.32538%0.383SS..SBendtrans-136.8154.9-175.868.80000110.9V14 H15 L16T12-V14 PolarHBondContact O-N 3.49Å; T12-H15 WeakPolarHBondContact O-CB 3.28Å; T12-H15 PolarHBondContact O-N 3.17Å; T12-H15 VanDerWaalsContact O-N 3.08Å; T12-H15 WeakPolarHBondContact OG1-CB 3.34Å; T12-H15 PolarHBondContact OG1-CD2 2.95Å; T12-H15 VanDerWaalsContact OG1-CG 3.22Å; T12-H15 PolarHBondContact OG1-N 3.45Å; T12-L16 PolarHBondContact O-N 3.32Å
13P96.5Very high87.3Confident52 Ų5270 Ų7034%0.33835%0.349SS..Hα-helixtrans-54.2-40175.6-27.835.2000112.9H15 L16 Y17 Y44 I56P13-H15 PolarHBondContact O-N 3.48Å; P13-L16 WeakPolarHBondContact O-CB 3.49Å; P13-L16 PolarHBondContact O-N 2.93Å; P13-Y17 PolarHBondContact O-N 2.95Å; P13-Y44 HydrophobicContact CB-CE2 3.9Å; P13-Y44 WeakPolarHBondContact O-CE2 3.11Å; P13-I56 HydrophobicContact CG-CG2 3.82Å
14V95.9Very high88.9Confident65 Ų6567.2 Ų67.239%0.39433%0.332SS..Hα-helixtrans-66.5-39178.6177.50000111.7T12 L16 R18T12-V14 PolarHBondContact O-N 3.49Å; V14-L16 VanDerWaalsContact C-N 3.33Å; V14-R18 WeakPolarHBondContact O-CG 3.23Å; V14-R18 PolarHBondContact O-N 3.27Å
15H95.7Very high90.1Very high82 Ų8272 Ų7238%0.3835%0.35SS..Hα-helixtrans-64.3-41.6173.9-71.4-174000110.9L9 V10 T12 P13 R18 Y19L9-H15 PolarHBondContact O-ND1 3.17Å; L9-H15 VanDerWaalsContact O-ND1 3.1Å; V10-H15 HydrophobicContact CG1-CB 4.24Å; T12-H15 WeakPolarHBondContact O-CB 3.28Å; T12-H15 PolarHBondContact O-N 3.17Å; T12-H15 VanDerWaalsContact O-N 3.08Å; T12-H15 WeakPolarHBondContact OG1-CB 3.34Å; T12-H15 PolarHBondContact OG1-CD2 2.95Å; T12-H15 VanDerWaalsContact OG1-CG 3.22Å; T12-H15 PolarHBondContact OG1-N 3.45Å; P13-H15 PolarHBondContact O-N 3.48Å; H15-R18 PolarHBondContact O-N 3.03Å; H15-Y19 VanDerWaalsContact O-CB 3.32Å; H15-Y19 WeakPolarHBondContact O-CB 3.19Å; H15-Y19 PolarHBondContact O-N 3.13Å
16L96.8Very high91.4Very high14 Ų1470.3 Ų70.37%0.07333%0.331CS..Hα-helixtrans-60-50.5177.7177.469.2000110.4V10 T12 P13 V14 R18 Y19 L20 I60 A63 I64V10-L16 VanDerWaalsContact CG1-CA 3.46Å; V10-L16 HydrophobicContact CG1-CB 3.65Å; V10-L16 HydrophobicContact CG1-CD1 4.03Å; V10-L16 HydrophobicContact CG1-CG 4.48Å; T12-L16 PolarHBondContact O-N 3.32Å; P13-L16 WeakPolarHBondContact O-CB 3.49Å; P13-L16 PolarHBondContact O-N 2.93Å; V14-L16 VanDerWaalsContact C-N 3.33Å; L16-R18 VanDerWaalsContact C-N 3.33Å; L16-R18 PolarHBondContact O-N 3.31Å; L16-Y19 WeakPolarHBondContact O-CB 3.41Å; L16-Y19 PolarHBondContact O-N 3.35Å; L16-Y19 VanDerWaalsContact O-N 3.1Å; L16-L20 HydrophobicContact CD1-CD1 3.96Å; L16-L20 HydrophobicContact CD1-CD2 4.31Å; L16-L20 HydrophobicContact CD1-CG 3.97Å; L16-L20 HydrophobicContact CD2-CD1 4.36Å; L16-L20 HydrophobicContact CG-CD1 3.82Å; L16-L20 HydrophobicContact CG-CG 4.2Å; L16-L20 VanDerWaalsContact O-CG 3.32Å; L16-L20 WeakPolarHBondContact O-CG 3.39Å; L16-L20 PolarHBondContact O-N 2.98Å; L16-I60 HydrophobicContact CB-CG1 4.29Å; L16-I60 HydrophobicContact CD1-CG2 4.45Å; L16-I60 HydrophobicContact CD2-CB 4.48Å; L16-I60 HydrophobicContact CD2-CG1 3.96Å; L16-A63 HydrophobicContact CD1-CB 3.97Å; L16-A63 HydrophobicContact CD2-CB 3.94Å; L16-A63 HydrophobicContact CG-CB 4.46Å; L16-I64 HydrophobicContact CD1-CG1 3.93Å
17Y97.4Very high92.6Very high66 Ų6669.4 Ų69.426%0.25932%0.32SS..Hα-helixtrans-53.9-48.8179.3-174.8-101.1000112.1P13 L20 L21 I40 Y44P13-Y17 PolarHBondContact O-N 2.95Å; Y17-L20 PolarHBondContact O-N 3.1Å; Y17-L21 HydrophobicContact CD1-CD1 3.96Å; Y17-L21 HydrophobicContact CE1-CD1 3.45Å; Y17-L21 VanDerWaalsContact CE1-CD1 3.45Å; Y17-L21 HydrophobicContact CE1-CG 4.32Å; Y17-L21 WeakPolarHBondContact O-CG 3.37Å; Y17-L21 PolarHBondContact O-N 3.1Å; Y17-L21 VanDerWaalsContact O-N 3.12Å; Y17-I40 HydrophobicContact CD2-CG2 3.67Å; Y17-I40 HydrophobicContact CE2-CG2 3.75Å; Y17-Y44 HydrophobicContact CD2-CD1 4.48Å; Y17-Y44 AromaticContact CD2-CD2 3.79Å; Y17-Y44 HydrophobicContact CD2-CD2 3.79Å; Y17-Y44 HydrophobicContact CD2-CE2 4.46Å; Y17-Y44 AromaticContact CD2-CG 3.79Å; Y17-Y44 HydrophobicContact CD2-CG 3.79Å; Y17-Y44 HydrophobicContact CE2-CG 4.35Å; Y17-Y44 HydrophobicContact CG-CD2 4.16Å; Y17-Y44 HydrophobicContact CG-CE2 4.42Å; Y17-Y44 HydrophobicContact CG-CG 4.49Å
18R95.9Very high93.4Very high145 Ų14572.9 Ų72.955%0.54734%0.342SS..Hα-helixtrans-65.3-39.9177.7-68.8176.1-179.8160.30.9112.5V14 H15 L16 R22V14-R18 WeakPolarHBondContact O-CG 3.23Å; V14-R18 PolarHBondContact O-N 3.27Å; H15-R18 PolarHBondContact O-N 3.03Å; L16-R18 VanDerWaalsContact C-N 3.33Å; L16-R18 PolarHBondContact O-N 3.31Å; R18-R22 PolarHBondContact O-N 3.01Å; R18-R22 VanDerWaalsContact O-N 3.17Å
19Y95.9Very high94.3Very high7 Ų768.3 Ų68.33%0.02733%0.325CS..Hα-helixtrans-60.1-51.3176.4171.1-97.9000110.9L4 A7 V10 H15 L16 L21 R22 C23 I64 D68L4-Y19 WeakPolarHBondContact CB-OH 3.17Å; A7-Y19 HydrophobicContact CB-CE2 4.18Å; V10-Y19 HydrophobicContact CG2-CD1 4.4Å; V10-Y19 HydrophobicContact CG2-CD2 4.13Å; V10-Y19 HydrophobicContact CG2-CG 3.85Å; H15-Y19 VanDerWaalsContact O-CB 3.32Å; H15-Y19 WeakPolarHBondContact O-CB 3.19Å; H15-Y19 PolarHBondContact O-N 3.13Å; L16-Y19 WeakPolarHBondContact O-CB 3.41Å; L16-Y19 PolarHBondContact O-N 3.35Å; L16-Y19 VanDerWaalsContact O-N 3.1Å; Y19-L21 VanDerWaalsContact C-N 3.31Å; Y19-L21 PolarHBondContact O-N 3.11Å; Y19-R22 WeakPolarHBondContact O-CA 2.85Å; Y19-R22 WeakPolarHBondContact O-CB 3.3Å; Y19-R22 PolarHBondContact O-N 3.26Å; Y19-C23 PolarHBondContact O-N 2.69Å; Y19-C23 PolarHBondContact O-SG 2.88Å; Y19-I64 HydrophobicContact CD1-CG1 4.35Å; Y19-I64 HydrophobicContact CE1-CG1 4.06Å; Y19-I64 HydrophobicContact CE1-CG2 4.44Å; Y19-D68 PolarHBondContact OH-OD1 3.46Å
20L96.8Very high94.9Very high22 Ų2271.4 Ų71.412%0.11533%0.328CS..Hα-helixtrans-62.3-36.5-179.5-63.9175.6000112.6L16 Y17 R22 C23 C24 I40 A63 A67L16-L20 HydrophobicContact CD1-CD1 3.96Å; L16-L20 HydrophobicContact CD1-CD2 4.31Å; L16-L20 HydrophobicContact CD1-CG 3.97Å; L16-L20 HydrophobicContact CD2-CD1 4.36Å; L16-L20 HydrophobicContact CG-CD1 3.82Å; L16-L20 HydrophobicContact CG-CG 4.2Å; L16-L20 VanDerWaalsContact O-CG 3.32Å; L16-L20 WeakPolarHBondContact O-CG 3.39Å; L16-L20 PolarHBondContact O-N 2.98Å; Y17-L20 PolarHBondContact O-N 3.1Å; L20-R22 VanDerWaalsContact C-N 3.33Å; L20-R22 PolarHBondContact O-N 3.13Å; L20-C23 WeakPolarHBondContact O-CB 3.35Å; L20-C23 PolarHBondContact O-N 3.24Å; L20-C24 PolarHBondContact O-N 3.41Å; L20-C24 PolarHBondContact O-SG 3.29Å; L20-C24 VanDerWaalsContact O-SG 3.38Å; L20-I40 HydrophobicContact CB-CD1 3.52Å; L20-I40 HydrophobicContact CB-CG1 3.85Å; L20-I40 HydrophobicContact CB-CG2 4.07Å; L20-I40 HydrophobicContact CD1-CG1 4.16Å; L20-I40 HydrophobicContact CD1-CG2 4.15Å; L20-A63 HydrophobicContact CD1-CB 4.34Å; L20-A67 HydrophobicContact CD2-CB 3.61Å
21L96.3Very high95.2Very high48 Ų4874.2 Ų74.225%0.25135%0.352SS..Hα-helixtrans-65.6-33.8173.4-70.6-179.4000112.9Y17 Y19 K25 Q37 I40Y17-L21 HydrophobicContact CD1-CD1 3.96Å; Y17-L21 HydrophobicContact CE1-CD1 3.45Å; Y17-L21 VanDerWaalsContact CE1-CD1 3.45Å; Y17-L21 HydrophobicContact CE1-CG 4.32Å; Y17-L21 WeakPolarHBondContact O-CG 3.37Å; Y17-L21 PolarHBondContact O-N 3.1Å; Y17-L21 VanDerWaalsContact O-N 3.12Å; Y19-L21 VanDerWaalsContact C-N 3.31Å; Y19-L21 PolarHBondContact O-N 3.11Å; L21-K25 PolarHBondContact O-N 3.42Å; L21-Q37 HydrophobicContact CD2-CB 4.41Å; L21-Q37 HydrophobicContact CD2-CG 3.87Å; L21-I40 HydrophobicContact CD2-CD1 4.43Å
22R95Very high95.5Very high139 Ų13966.6 Ų66.653%0.52533%0.326SS..Hα-helixtrans-69.3-40.2172-71.2-173.7-64.7-114.41.2111.4R18 Y19 L20 C24 K25R18-R22 PolarHBondContact O-N 3.01Å; R18-R22 VanDerWaalsContact O-N 3.17Å; Y19-R22 WeakPolarHBondContact O-CA 2.85Å; Y19-R22 WeakPolarHBondContact O-CB 3.3Å; Y19-R22 PolarHBondContact O-N 3.26Å; L20-R22 VanDerWaalsContact C-N 3.33Å; L20-R22 PolarHBondContact O-N 3.13Å; R22-C24 VanDerWaalsContact C-N 3.31Å; R22-C24 PolarHBondContact O-N 3.02Å; R22-K25 WeakPolarHBondContact O-CB 3.2Å; R22-K25 PolarHBondContact O-N 3.4Å; R22-K25 VanDerWaalsContact O-N 3.16Å
23C94.5Very high95.6Very high8 Ų866.4 Ų66.45%0.05432%0.321CS..Hα-helixtrans-57.4-44.8173.2-67.30000111.2Y19 L20 K25 Q26 L71Y19-C23 PolarHBondContact O-N 2.69Å; Y19-C23 PolarHBondContact O-SG 2.88Å; L20-C23 WeakPolarHBondContact O-CB 3.35Å; L20-C23 PolarHBondContact O-N 3.24Å; C23-K25 PolarHBondContact O-N 2.94Å; C23-K25 VanDerWaalsContact O-N 3.17Å; C23-Q26 WeakPolarHBondContact O-CB 3.21Å; C23-Q26 PolarHBondContact O-N 3.34Å; C23-L71 HydrophobicContact CB-CD1 3.72Å
24C95.1Very high95.6Very high5 Ų568.2 Ų68.23%0.03433%0.325CS..Hα-helixtrans-54.9-38.3176.8-72.80000112.8L20 R22 Q26 L27 Q33 Y36 Q37 I40L20-C24 PolarHBondContact O-N 3.41Å; L20-C24 PolarHBondContact O-SG 3.29Å; L20-C24 VanDerWaalsContact O-SG 3.38Å; R22-C24 VanDerWaalsContact C-N 3.31Å; R22-C24 PolarHBondContact O-N 3.02Å; C24-Q26 PolarHBondContact O-N 3.49Å; C24-Q26 VanDerWaalsContact O-N 3.13Å; C24-L27 WeakPolarHBondContact O-CB 3.32Å; C24-L27 WeakPolarHBondContact O-CG 3.33Å; C24-L27 PolarHBondContact O-N 3.4Å; C24-Q33 VanDerWaalsContact O-CG 3.28Å; C24-Q33 WeakPolarHBondContact O-CG 3.34Å; C24-Y36 VanDerWaalsContact SG-CB 3.55Å; C24-Q37 HydrophobicContact CB-CG 4.06Å; C24-I40 WeakPolarHBondContact SG-CD1 3.38Å
25K92.9Very high95.7Very high152 Ų15270.9 Ų70.966%0.66133%0.333SS*.THydrogen-bonded Turntrans-63.2-19.4179.4-65.3-179.3179.1-175.10113.8L21 R22 C23 L27L21-K25 PolarHBondContact O-N 3.42Å; R22-K25 WeakPolarHBondContact O-CB 3.2Å; R22-K25 PolarHBondContact O-N 3.4Å; R22-K25 VanDerWaalsContact O-N 3.16Å; C23-K25 PolarHBondContact O-N 2.94Å; C23-K25 VanDerWaalsContact O-N 3.17Å; K25-L27 VanDerWaalsContact C-N 3.32Å
26Q92.7Very high95.8Very high93 Ų9369 Ų6944%0.43532%0.323SS..THydrogen-bonded Turntrans-84.6-6.7177.4-59.7178.359.100112.8C23 C24 L71 N75C23-Q26 WeakPolarHBondContact O-CB 3.21Å; C23-Q26 PolarHBondContact O-N 3.34Å; C24-Q26 PolarHBondContact O-N 3.49Å; C24-Q26 VanDerWaalsContact O-N 3.13Å; Q26-L71 HydrophobicContact CB-CD2 3.82Å; Q26-N75 PolarHBondContact O-ND2 3.36Å; Q26-N75 PolarHBondContact O-OD1 2.9Å
27L94.5Very high95.8Very high7 Ų771.8 Ų71.84%0.03734%0.335CS..SBendtrans-75.2145.8179.2-64169.9000111.5C24 K25 T29 M32 Q33 Y36 I70 L71 Y74C24-L27 WeakPolarHBondContact O-CB 3.32Å; C24-L27 WeakPolarHBondContact O-CG 3.33Å; C24-L27 PolarHBondContact O-N 3.4Å; K25-L27 VanDerWaalsContact C-N 3.32Å; L27-T29 PolarHBondContact O-N 3.33Å; L27-M32 HydrophobicContact CB-CB 4.37Å; L27-M32 HydrophobicContact CD1-CB 4.36Å; L27-M32 HydrophobicContact CD2-CE 4.17Å; L27-Q33 HydrophobicContact CB-CG 4.05Å; L27-Q33 PolarHBondContact O-NE2 2.97Å; L27-Y36 HydrophobicContact CD1-CD2 3.34Å; L27-Y36 HydrophobicContact CD1-CE2 4.04Å; L27-Y36 HydrophobicContact CD1-CG 4.04Å; L27-I70 HydrophobicContact CD2-CG2 3.94Å; L27-L71 HydrophobicContact CD2-CD2 3.74Å; L27-L71 HydrophobicContact CG-CD2 4.19Å; L27-Y74 HydrophobicContact CD2-CD2 4.41Å
28P94.5Very high95.8Very high80 Ų8074.3 Ų74.352%0.51935%0.349SS..SBendtrans-70.7-26.8-165.524.2-34.5000114.8M32P28-M32 HydrophobicContact CG-CE 4.06Å; P28-M32 HydrophobicContact CG-SD 3.9Å
29T95.7Very high95.9Very high67 Ų6769.5 Ų69.541%0.41134%0.34SS..SBendtrans-126.7145.3-175.573.30000112.5L27 A31 M32 Q33L27-T29 PolarHBondContact O-N 3.33Å; T29-A31 VanDerWaalsContact C-N 3.26Å; T29-A31 PolarHBondContact O-N 3.01Å; T29-M32 HydrophobicContact CG2-SD 4.34Å; T29-M32 WeakPolarHBondContact O-CB 3.49Å; T29-M32 PolarHBondContact O-N 3.44Å; T29-M32 VanDerWaalsContact O-N 3.11Å; T29-M32 WeakPolarHBondContact OG1-CG 3.49Å; T29-M32 PolarHBondContact OG1-N 2.96Å; T29-M32 PolarHBondContact OG1-SD 3.37Å; T29-M32 VanDerWaalsContact OG1-SD 3.34Å; T29-Q33 WeakPolarHBondContact O-CG 3.4Å; T29-Q33 PolarHBondContact O-N 3.1Å
30R95.8Very high96Very high190 Ų19070.3 Ų70.372%0.71735%0.345SS*.Hα-helixtrans-58.2-36.5178.8-171.2173.4-177.8174.20.8113.1Q33 Q34R30-Q33 PolarHBondContact O-N 3.46Å; R30-Q34 WeakPolarHBondContact O-CG 3.49Å; R30-Q34 PolarHBondContact O-N 3.27Å
31A96.6Very high96.1Very high68 Ų6876.6 Ų76.656%0.56237%0.367SS*.Hα-helixtrans-62.4-43.2177.200000111.7T29 Q34 H35T29-A31 VanDerWaalsContact C-N 3.26Å; T29-A31 PolarHBondContact O-N 3.01Å; A31-Q34 PolarHBondContact O-N 2.93Å; A31-H35 WeakPolarHBondContact O-CB 3.44Å; A31-H35 PolarHBondContact O-N 3.21Å
32M95.9Very high96.1Very high35 Ų3581.4 Ų81.417%0.17239%0.388CS..Hα-helixtrans-65.1-44.4174.3-68.7167.266.600111.6L27 P28 T29 Q34 H35 Y36 Y74L27-M32 HydrophobicContact CB-CB 4.37Å; L27-M32 HydrophobicContact CD1-CB 4.36Å; L27-M32 HydrophobicContact CD2-CE 4.17Å; P28-M32 HydrophobicContact CG-CE 4.06Å; P28-M32 HydrophobicContact CG-SD 3.9Å; T29-M32 HydrophobicContact CG2-SD 4.34Å; T29-M32 WeakPolarHBondContact O-CB 3.49Å; T29-M32 PolarHBondContact O-N 3.44Å; T29-M32 VanDerWaalsContact O-N 3.11Å; T29-M32 WeakPolarHBondContact OG1-CG 3.49Å; T29-M32 PolarHBondContact OG1-N 2.96Å; T29-M32 PolarHBondContact OG1-SD 3.37Å; T29-M32 VanDerWaalsContact OG1-SD 3.34Å; M32-Q34 VanDerWaalsContact C-N 3.28Å; M32-Q34 PolarHBondContact O-N 3.5Å; M32-H35 PolarHBondContact O-N 3.34Å; M32-Y36 VanDerWaalsContact O-CD2 3.26Å; M32-Y36 WeakPolarHBondContact O-CD2 3.41Å; M32-Y36 PolarHBondContact O-N 3.46Å; M32-Y74 HydrophobicContact CE-CD1 3.36Å; M32-Y74 HydrophobicContact CE-CD2 3.5Å; M32-Y74 HydrophobicContact CE-CE1 3.68Å; M32-Y74 HydrophobicContact CE-CE2 3.84Å; M32-Y74 HydrophobicContact CE-CG 3.27Å; M32-Y74 HydrophobicContact SD-CD1 4.42Å
33Q96.8Very high96.2Very high50 Ų5076.1 Ų76.123%0.23438%0.377CS..Hα-helixtrans-54.8-46.7176.5-61-173.16.200111.2C24 L27 T29 R30 Q37C24-Q33 VanDerWaalsContact O-CG 3.28Å; C24-Q33 WeakPolarHBondContact O-CG 3.34Å; L27-Q33 HydrophobicContact CB-CG 4.05Å; L27-Q33 PolarHBondContact O-NE2 2.97Å; T29-Q33 WeakPolarHBondContact O-CG 3.4Å; T29-Q33 PolarHBondContact O-N 3.1Å; R30-Q33 PolarHBondContact O-N 3.46Å; Q33-Q37 VanDerWaalsContact O-CB 3.3Å; Q33-Q37 WeakPolarHBondContact O-CB 3.49Å; Q33-Q37 WeakPolarHBondContact O-CG 3.49Å; Q33-Q37 PolarHBondContact O-N 3.32Å
34Q97.6Very high96.4Very high90 Ų9079.9 Ų79.942%0.42139%0.391SS..Hα-helixtrans-64.4-47.5177.7-72.9174.1-31.700112.1R30 A31 M32 Y36 Q37 H38R30-Q34 WeakPolarHBondContact O-CG 3.49Å; R30-Q34 PolarHBondContact O-N 3.27Å; A31-Q34 PolarHBondContact O-N 2.93Å; M32-Q34 VanDerWaalsContact C-N 3.28Å; M32-Q34 PolarHBondContact O-N 3.5Å; Q34-Y36 PolarHBondContact O-N 2.88Å; Q34-Q37 PolarHBondContact O-N 3.38Å; Q34-H38 PolarHBondContact O-CD2 3.27Å; Q34-H38 PolarHBondContact O-N 3.09Å
35H96.9Very high96.4Very high121 Ų12184 Ų8456%0.5641%0.413SS*.Hα-helixtrans-54-51.2178.2173.674.7000111.9A31 M32 H38 A39A31-H35 WeakPolarHBondContact O-CB 3.44Å; A31-H35 PolarHBondContact O-N 3.21Å; M32-H35 PolarHBondContact O-N 3.34Å; H35-H38 PolarHBondContact O-N 3.12Å; H35-A39 PolarHBondContact O-N 2.95Å
36Y97.6Very high96.6Very high43 Ų4380.8 Ų80.817%0.16941%0.409CS..Hα-helixtrans-72.5-33.6-179.3-73.1-70.2000112.8C24 L27 M32 Q34 H38 A39 I40 I70 Y74C24-Y36 VanDerWaalsContact SG-CB 3.55Å; L27-Y36 HydrophobicContact CD1-CD2 3.34Å; L27-Y36 HydrophobicContact CD1-CE2 4.04Å; L27-Y36 HydrophobicContact CD1-CG 4.04Å; M32-Y36 VanDerWaalsContact O-CD2 3.26Å; M32-Y36 WeakPolarHBondContact O-CD2 3.41Å; M32-Y36 PolarHBondContact O-N 3.46Å; Q34-Y36 PolarHBondContact O-N 2.88Å; Y36-H38 VanDerWaalsContact C-N 3.3Å; Y36-H38 PolarHBondContact O-N 3.1Å; Y36-A39 PolarHBondContact O-N 2.98Å; Y36-I40 WeakPolarHBondContact O-CB 3.21Å; Y36-I40 VanDerWaalsContact O-CD1 3.32Å; Y36-I40 WeakPolarHBondContact O-CD1 3.32Å; Y36-I40 WeakPolarHBondContact O-CG1 3.46Å; Y36-I40 PolarHBondContact O-N 2.95Å; Y36-I70 HydrophobicContact CD1-CD1 4.04Å; Y36-I70 HydrophobicContact CE1-CD1 3.46Å; Y36-I70 VanDerWaalsContact CE1-CD1 3.46Å; Y36-I70 HydrophobicContact CE1-CG1 4.2Å; Y36-I70 HydrophobicContact CE1-CG2 4.2Å; Y36-I70 HydrophobicContact CE2-CG2 3.98Å; Y36-Y74 HydrophobicContact CE2-CE2 4.46Å
37Q97.7Very high96.8Very high71 Ų7180.7 Ų80.733%0.33241%0.408SS..Hα-helixtrans-59.4-41.7171.1-77.2171.519.500112L21 C24 Q33 Q34 R41L21-Q37 HydrophobicContact CD2-CB 4.41Å; L21-Q37 HydrophobicContact CD2-CG 3.87Å; C24-Q37 HydrophobicContact CB-CG 4.06Å; Q33-Q37 VanDerWaalsContact O-CB 3.3Å; Q33-Q37 WeakPolarHBondContact O-CB 3.49Å; Q33-Q37 WeakPolarHBondContact O-CG 3.49Å; Q33-Q37 PolarHBondContact O-N 3.32Å; Q34-Q37 PolarHBondContact O-N 3.38Å; Q37-R41 PolarHBondContact O-N 3.34Å; Q37-R41 VanDerWaalsContact O-N 3.09Å
38H98Very high96.8Very high120 Ų12084.7 Ų84.756%0.55643%0.433SS*.Hα-helixtrans-65.3-45.2174.9-72.3-59.2000111.8Q34 H35 Y36 I40 R41 Q42Q34-H38 PolarHBondContact O-CD2 3.27Å; Q34-H38 PolarHBondContact O-N 3.09Å; H35-H38 PolarHBondContact O-N 3.12Å; Y36-H38 VanDerWaalsContact C-N 3.3Å; Y36-H38 PolarHBondContact O-N 3.1Å; H38-I40 PolarHBondContact O-N 3.42Å; H38-R41 PolarHBondContact O-N 2.99Å; H38-Q42 WeakPolarHBondContact O-CG 3.32Å; H38-Q42 PolarHBondContact O-N 3.08Å
39A97.6Very high96.9Very high43 Ų4388.1 Ų88.136%0.35545%0.447SS..Hα-helixtrans-59.6-43.9177.100000112.2H35 Y36 R41 Q42 G43H35-A39 PolarHBondContact O-N 2.95Å; Y36-A39 PolarHBondContact O-N 2.98Å; A39-R41 VanDerWaalsContact C-N 3.34Å; A39-R41 PolarHBondContact O-N 2.95Å; A39-Q42 PolarHBondContact O-N 3.4Å; A39-G43 PolarHBondContact O-N 3.34Å
40I97.9Very high96.9Very high24 Ų2487.6 Ų87.612%0.12344%0.44CS..Hα-helixtrans-60.2-44.7176-67.8158.3000110.8Y17 L20 L21 C24 Y36 H38 G43 Y44Y17-I40 HydrophobicContact CD2-CG2 3.67Å; Y17-I40 HydrophobicContact CE2-CG2 3.75Å; L20-I40 HydrophobicContact CB-CD1 3.52Å; L20-I40 HydrophobicContact CB-CG1 3.85Å; L20-I40 HydrophobicContact CB-CG2 4.07Å; L20-I40 HydrophobicContact CD1-CG1 4.16Å; L20-I40 HydrophobicContact CD1-CG2 4.15Å; L21-I40 HydrophobicContact CD2-CD1 4.43Å; C24-I40 WeakPolarHBondContact SG-CD1 3.38Å; Y36-I40 WeakPolarHBondContact O-CB 3.21Å; Y36-I40 VanDerWaalsContact O-CD1 3.32Å; Y36-I40 WeakPolarHBondContact O-CD1 3.32Å; Y36-I40 WeakPolarHBondContact O-CG1 3.46Å; Y36-I40 PolarHBondContact O-N 2.95Å; H38-I40 PolarHBondContact O-N 3.42Å; I40-G43 PolarHBondContact O-N 3.24Å; I40-Y44 VanDerWaalsContact O-CB 3.31Å; I40-Y44 WeakPolarHBondContact O-CB 3.26Å; I40-Y44 PolarHBondContact O-N 2.95Å
41R97.8Very high96.9Very high155 Ų15585.3 Ų85.359%0.58544%0.442SS*.Hα-helixtrans-64.7-41.5179.4-168.4175.9-165.3167.23.3111.9Q37 H38 A39 N45Q37-R41 PolarHBondContact O-N 3.34Å; Q37-R41 VanDerWaalsContact O-N 3.09Å; H38-R41 PolarHBondContact O-N 2.99Å; A39-R41 VanDerWaalsContact C-N 3.34Å; A39-R41 PolarHBondContact O-N 2.95Å; R41-N45 WeakPolarHBondContact O-CB 3.28Å; R41-N45 VanDerWaalsContact O-CG 3.3Å; R41-N45 PolarHBondContact O-N 3.39Å; R41-N45 VanDerWaalsContact O-N 3.17Å
42Q98.1Very high96.9Very high149 Ų14985 Ų8570%0.69643%0.431SS*.Hα-helixtrans-64.2-49.9176.3-75.1-175-18.300111.4H38 A39 Y44 N45 S46H38-Q42 WeakPolarHBondContact O-CG 3.32Å; H38-Q42 PolarHBondContact O-N 3.08Å; A39-Q42 PolarHBondContact O-N 3.4Å; Q42-Y44 VanDerWaalsContact C-N 3.34Å; Q42-Y44 PolarHBondContact O-N 3.15Å; Q42-N45 PolarHBondContact O-N 3.46Å; Q42-S46 PolarHBondContact O-N 3.23Å; Q42-S46 PolarHBondContact O-OG 3.13Å
43G97Very high96.9Very high28 Ų2888 Ų8829%0.28945%0.453SS..Hα-helixtrans-61.9-38.817900000113.2A39 I40 N45 S46 H47A39-G43 PolarHBondContact O-N 3.34Å; I40-G43 PolarHBondContact O-N 3.24Å; G43-N45 PolarHBondContact O-N 3.2Å; G43-S46 WeakPolarHBondContact CA-OG 3.32Å; G43-S46 PolarHBondContact O-N 3.25Å; G43-S46 PolarHBondContact O-OG 2.91Å; G43-H47 PolarHBondContact O-CD2 3.37Å
44Y96.9Very high96.9Very high87 Ų8793 Ų9334%0.34148%0.477SS..Hα-helixtrans-62.3-44.2175.6-171.4-92.1000111.8P13 Y17 I40 Q42 S46 H47P13-Y44 HydrophobicContact CB-CE2 3.9Å; P13-Y44 WeakPolarHBondContact O-CE2 3.11Å; Y17-Y44 HydrophobicContact CD2-CD1 4.48Å; Y17-Y44 AromaticContact CD2-CD2 3.79Å; Y17-Y44 HydrophobicContact CD2-CD2 3.79Å; Y17-Y44 HydrophobicContact CD2-CE2 4.46Å; Y17-Y44 AromaticContact CD2-CG 3.79Å; Y17-Y44 HydrophobicContact CD2-CG 3.79Å; Y17-Y44 HydrophobicContact CE2-CG 4.35Å; Y17-Y44 HydrophobicContact CG-CD2 4.16Å; Y17-Y44 HydrophobicContact CG-CE2 4.42Å; Y17-Y44 HydrophobicContact CG-CG 4.49Å; I40-Y44 VanDerWaalsContact O-CB 3.31Å; I40-Y44 WeakPolarHBondContact O-CB 3.26Å; I40-Y44 PolarHBondContact O-N 2.95Å; Q42-Y44 VanDerWaalsContact C-N 3.34Å; Q42-Y44 PolarHBondContact O-N 3.15Å; Y44-S46 VanDerWaalsContact C-N 3.34Å; Y44-S46 PolarHBondContact O-N 3.37Å; Y44-H47 PolarHBondContact O-N 3.05Å
45N96.9Very high96.9Very high92 Ų9295.1 Ų95.149%0.49248%0.481SS..Hα-helixtrans-72.8-24.3-179.9-70.8-6.8000113.2R41 Q42 G43 H47 T48R41-N45 WeakPolarHBondContact O-CB 3.28Å; R41-N45 VanDerWaalsContact O-CG 3.3Å; R41-N45 PolarHBondContact O-N 3.39Å; R41-N45 VanDerWaalsContact O-N 3.17Å; Q42-N45 PolarHBondContact O-N 3.46Å; G43-N45 PolarHBondContact O-N 3.2Å; N45-H47 PolarHBondContact O-N 3.08Å; N45-T48 WeakPolarHBondContact O-CG2 3.3Å; N45-T48 PolarHBondContact O-OG1 2.97Å
46S97.1Very high96.9Very high84 Ų8491.3 Ų91.359%0.58746%0.464SS*.Hα-helixtrans-76.1-11.3177.859.80000113.9Q42 G43 Y44Q42-S46 PolarHBondContact O-N 3.23Å; Q42-S46 PolarHBondContact O-OG 3.13Å; G43-S46 WeakPolarHBondContact CA-OG 3.32Å; G43-S46 PolarHBondContact O-N 3.25Å; G43-S46 PolarHBondContact O-OG 2.91Å; Y44-S46 VanDerWaalsContact C-N 3.34Å; Y44-S46 PolarHBondContact O-N 3.37Å
47H95.9Very high96.8Very high90 Ų9092.6 Ų92.642%0.41747%0.472SS..THydrogen-bonded Turntrans-112.520.1-179.2-63.8-57.8000112.8G43 Y44 N45 D49 E50G43-H47 PolarHBondContact O-CD2 3.37Å; Y44-H47 PolarHBondContact O-N 3.05Å; N45-H47 PolarHBondContact O-N 3.08Å; H47-D49 PolarHBondContact O-N 3.02Å; H47-E50 HydrophobicContact CB-CB 4.46Å; H47-E50 WeakPolarHBondContact O-CB 3.44Å; H47-E50 PolarHBondContact O-N 3.02Å
48T94.1Very high96.7Very high92 Ų9294 Ų9456%0.56448%0.481SS*.THydrogen-bonded Turntrans-63.7-29.1-178.249.40000113.6N45N45-T48 WeakPolarHBondContact O-CG2 3.3Å; N45-T48 PolarHBondContact O-OG1 2.97Å
49D96.2Very high96.7Very high152 Ų15290.4 Ų90.481%0.81347%0.465SS*.THydrogen-bonded Turntrans-94.42.9-176.2-52.7-25.3000112.1H47H47-D49 PolarHBondContact O-N 3.02Å
50E96.3Very high96.6Very high56 Ų5688.5 Ų88.526%0.26245%0.449SS..  trans-82.6115.4175.5-176.568.3-109.200109.9H47 D52 R55 I56 I59H47-E50 HydrophobicContact CB-CB 4.46Å; H47-E50 WeakPolarHBondContact O-CB 3.44Å; H47-E50 PolarHBondContact O-N 3.02Å; E50-D52 WeakPolarHBondContact OE1-CB 3.43Å; E50-D52 PolarHBondContact OE1-N 2.98Å; E50-R55 VanDerWaalsContact CD-CB 3.5Å; E50-R55 HydrophobicContact CG-CB 4.07Å; E50-R55 WeakPolarHBondContact OE1-CB 3.25Å; E50-R55 WeakPolarHBondContact OE2-CD 3.17Å; E50-I56 HydrophobicContact CG-CG1 3.88Å; E50-I59 HydrophobicContact CG-CD1 4.26Å
51D96.1Very high96.4Very high141 Ų14192.5 Ų92.575%0.75447%0.467SS*.  trans-117.1-8.3179.663.6-15.6000113.5P53D51-P53 WeakPolarHBondContact O-CD 3.41Å
52D97.7Very high96.4Very high61 Ų6192.5 Ų92.533%0.32647%0.467SS..  trans-70.8116.1176.4178.62.5000110.4E50 E54 R55 I56E50-D52 WeakPolarHBondContact OE1-CB 3.43Å; E50-D52 PolarHBondContact OE1-N 2.98Å; D52-E54 PolarHBondContact O-N 3.49Å; D52-E54 PolarHBondContact OD1-N 3.44Å; D52-R55 HydrophobicContact CB-CB 4.13Å; D52-R55 HydrophobicContact CB-CG 3.9Å; D52-R55 PolarHBondContact O-N 2.89Å; D52-R55 VanDerWaalsContact OD2-CG 3.29Å; D52-R55 WeakPolarHBondContact OD2-CG 3.49Å; D52-I56 VanDerWaalsContact O-CG1 3.32Å; D52-I56 WeakPolarHBondContact O-CG1 3.3Å; D52-I56 PolarHBondContact O-N 2.91Å
53P95.1Very high96.3Very high98 Ų9886.5 Ų86.564%0.63644%0.443SS*.Hα-helixtrans-59.2-32.7-178.724.7-35.3000113.3D51 Q57D51-P53 WeakPolarHBondContact O-CD 3.41Å; P53-Q57 WeakPolarHBondContact O-CB 3.31Å; P53-Q57 PolarHBondContact O-N 2.91Å
54E96.7Very high96.2Very high156 Ų15685.9 Ų85.973%0.72943%0.433SS*.Hα-helixtrans-70.6-43.5179-66-170178.500111.2D52 Q57 L58D52-E54 PolarHBondContact O-N 3.49Å; D52-E54 PolarHBondContact OD1-N 3.44Å; E54-Q57 PolarHBondContact O-N 3.2Å; E54-L58 WeakPolarHBondContact O-CB 3.36Å; E54-L58 PolarHBondContact O-N 2.87Å
55R97.2Very high96.1Very high135 Ų13585 Ų8551%0.50944%0.439SS..Hα-helixtrans-63.5-44.8175-61.8-146.383.786.52.2111.6E50 D52 Q57 L58 I59E50-R55 VanDerWaalsContact CD-CB 3.5Å; E50-R55 HydrophobicContact CG-CB 4.07Å; E50-R55 WeakPolarHBondContact OE1-CB 3.25Å; E50-R55 WeakPolarHBondContact OE2-CD 3.17Å; D52-R55 HydrophobicContact CB-CB 4.13Å; D52-R55 HydrophobicContact CB-CG 3.9Å; D52-R55 PolarHBondContact O-N 2.89Å; D52-R55 VanDerWaalsContact OD2-CG 3.29Å; D52-R55 WeakPolarHBondContact OD2-CG 3.49Å; R55-Q57 VanDerWaalsContact C-N 3.28Å; R55-Q57 PolarHBondContact O-N 3.27Å; R55-L58 PolarHBondContact O-N 3.42Å; R55-I59 VanDerWaalsContact O-CG1 3.28Å; R55-I59 WeakPolarHBondContact O-CG1 3.45Å; R55-I59 PolarHBondContact O-N 3.44Å
56I96.9Very high96Very high41 Ų4183.6 Ų83.621%0.2143%0.432CS..Hα-helixtrans-56.5-46.6176.5-69.1168.4000110.3P13 E50 D52 L58 I59 I60P13-I56 HydrophobicContact CG-CG2 3.82Å; E50-I56 HydrophobicContact CG-CG1 3.88Å; D52-I56 VanDerWaalsContact O-CG1 3.32Å; D52-I56 WeakPolarHBondContact O-CG1 3.3Å; D52-I56 PolarHBondContact O-N 2.91Å; I56-L58 VanDerWaalsContact C-N 3.34Å; I56-L58 PolarHBondContact O-N 3.32Å; I56-I59 PolarHBondContact O-N 2.88Å; I56-I60 HydrophobicContact CG2-CD1 3.85Å; I56-I60 VanDerWaalsContact O-CG1 3.29Å; I56-I60 WeakPolarHBondContact O-CG1 3.49Å; I56-I60 PolarHBondContact O-N 3.31Å
57Q95.4Very high95.9Very high70 Ų7080 Ų8033%0.32741%0.407SS..Hα-helixtrans-65-38-179.5-173.256.167.400112.2P53 E54 R55 I60 Q61P53-Q57 WeakPolarHBondContact O-CB 3.31Å; P53-Q57 PolarHBondContact O-N 2.91Å; E54-Q57 PolarHBondContact O-N 3.2Å; R55-Q57 VanDerWaalsContact C-N 3.28Å; R55-Q57 PolarHBondContact O-N 3.27Å; Q57-I60 PolarHBondContact O-N 3.01Å; Q57-Q61 WeakPolarHBondContact O-CG 3.34Å; Q57-Q61 PolarHBondContact O-N 3.45Å
58L96.2Very high95.7Very high99 Ų9976.8 Ų76.852%0.51839%0.393SS..Hα-helixtrans-65.2-45.1174.9-178.464.1000111.9E54 R55 I56 I60 Q61 R62E54-L58 WeakPolarHBondContact O-CB 3.36Å; E54-L58 PolarHBondContact O-N 2.87Å; R55-L58 PolarHBondContact O-N 3.42Å; I56-L58 VanDerWaalsContact C-N 3.34Å; I56-L58 PolarHBondContact O-N 3.32Å; L58-I60 VanDerWaalsContact C-N 3.3Å; L58-I60 PolarHBondContact O-N 3.03Å; L58-Q61 PolarHBondContact O-N 2.88Å; L58-R62 WeakPolarHBondContact O-CB 3.49Å; L58-R62 PolarHBondContact O-N 3.38Å
59I96.7Very high95.7Very high46 Ų4679.3 Ų79.324%0.23639%0.392CS..Hα-helixtrans-58.2-45.4176-68.4163.5000110E50 R55 I56 R62 A63E50-I59 HydrophobicContact CG-CD1 4.26Å; R55-I59 VanDerWaalsContact O-CG1 3.28Å; R55-I59 WeakPolarHBondContact O-CG1 3.45Å; R55-I59 PolarHBondContact O-N 3.44Å; I56-I59 PolarHBondContact O-N 2.88Å; I59-R62 PolarHBondContact O-N 3.38Å; I59-A63 VanDerWaalsContact O-CB 3.28Å; I59-A63 WeakPolarHBondContact O-CB 3.49Å; I59-A63 PolarHBondContact O-N 2.93Å
60I96.1Very high95.6Very high2 Ų273.5 Ų73.51%0.0136%0.361CS..Hα-helixtrans-57.9-52.9176.7-72.2167.4000111.1V10 L16 I56 Q57 L58 R62 A63 I64V10-I60 HydrophobicContact CB-CG2 4.48Å; V10-I60 HydrophobicContact CG1-CG2 3.69Å; L16-I60 HydrophobicContact CB-CG1 4.29Å; L16-I60 HydrophobicContact CD1-CG2 4.45Å; L16-I60 HydrophobicContact CD2-CB 4.48Å; L16-I60 HydrophobicContact CD2-CG1 3.96Å; I56-I60 HydrophobicContact CG2-CD1 3.85Å; I56-I60 VanDerWaalsContact O-CG1 3.29Å; I56-I60 WeakPolarHBondContact O-CG1 3.49Å; I56-I60 PolarHBondContact O-N 3.31Å; Q57-I60 PolarHBondContact O-N 3.01Å; L58-I60 VanDerWaalsContact C-N 3.3Å; L58-I60 PolarHBondContact O-N 3.03Å; I60-R62 VanDerWaalsContact C-N 3.29Å; I60-R62 PolarHBondContact O-N 2.91Å; I60-A63 PolarHBondContact O-N 3.29Å; I60-I64 HydrophobicContact CG2-CD1 3.8Å; I60-I64 VanDerWaalsContact O-CG1 3.3Å; I60-I64 WeakPolarHBondContact O-CG1 3.35Å; I60-I64 PolarHBondContact O-N 3.33Å
61Q94.9Very high95.4Very high109 Ų10971.3 Ų71.351%0.50935%0.351SS..Hα-helixtrans-60.7-41.1-178.7-73.2173.98.800111.8Q57 L58 S65Q57-Q61 WeakPolarHBondContact O-CG 3.34Å; Q57-Q61 PolarHBondContact O-N 3.45Å; L58-Q61 PolarHBondContact O-N 2.88Å; Q61-S65 PolarHBondContact O-N 3.4Å; Q61-S65 VanDerWaalsContact O-N 3.08Å; Q61-S65 PolarHBondContact O-OG 3.45Å
62R96.1Very high95.2Very high155 Ų15566.6 Ų66.659%0.58533%0.326SS*.Hα-helixtrans-66.1-48.1179.1-175.364.7-162.8-166.63.6111.7L58 I59 I60 I64 S65 D66L58-R62 WeakPolarHBondContact O-CB 3.49Å; L58-R62 PolarHBondContact O-N 3.38Å; I59-R62 PolarHBondContact O-N 3.38Å; I60-R62 VanDerWaalsContact C-N 3.29Å; I60-R62 PolarHBondContact O-N 2.91Å; R62-I64 VanDerWaalsContact C-N 3.3Å; R62-I64 PolarHBondContact O-N 2.97Å; R62-S65 WeakPolarHBondContact O-CB 3.45Å; R62-S65 PolarHBondContact O-N 3.14Å; R62-S65 VanDerWaalsContact O-N 3.13Å; R62-D66 IonicContact CZ-OD1 3.43Å; R62-D66 IonicContact NE-OD1 3.14Å; R62-D66 PolarHBondContact NE-OD1 3.37Å; R62-D66 VanDerWaalsContact NE-OD1 3.14Å; R62-D66 IonicContact NE-OD2 3.4Å; R62-D66 PolarHBondContact NE-OD2 3.48Å; R62-D66 IonicContact NH2-OD1 3.14Å; R62-D66 PolarHBondContact NH2-OD1 2.97Å; R62-D66 VanDerWaalsContact NH2-OD1 3.14Å; R62-D66 PolarHBondContact O-N 3.5Å
63A96.8Very high94.9Very high22 Ų2268.6 Ų68.618%0.18233%0.332CS..Hα-helixtrans-62.9-35.5179.700000112.7L16 L20 I59 I60 A67L16-A63 HydrophobicContact CD1-CB 3.97Å; L16-A63 HydrophobicContact CD2-CB 3.94Å; L16-A63 HydrophobicContact CG-CB 4.46Å; L20-A63 HydrophobicContact CD1-CB 4.34Å; I59-A63 VanDerWaalsContact O-CB 3.28Å; I59-A63 WeakPolarHBondContact O-CB 3.49Å; I59-A63 PolarHBondContact O-N 2.93Å; I60-A63 PolarHBondContact O-N 3.29Å; A63-A67 WeakPolarHBondContact O-CB 3.28Å; A63-A67 PolarHBondContact O-N 3.37Å
64I95.2Very high94.8Very high16 Ų1668.1 Ų68.18%0.08232%0.318CS..Hα-helixtrans-62.8-50.1172-69.5166.7000110.2P3 A7 V10 L16 Y19 I60 R62 D66 A67 D68P3-I64 HydrophobicContact CB-CG2 4.05Å; A7-I64 HydrophobicContact CB-CD1 4.48Å; A7-I64 HydrophobicContact CB-CG2 3.98Å; V10-I64 HydrophobicContact CB-CD1 3.92Å; V10-I64 HydrophobicContact CG1-CD1 4.07Å; V10-I64 HydrophobicContact CG2-CD1 4.43Å; L16-I64 HydrophobicContact CD1-CG1 3.93Å; Y19-I64 HydrophobicContact CD1-CG1 4.35Å; Y19-I64 HydrophobicContact CE1-CG1 4.06Å; Y19-I64 HydrophobicContact CE1-CG2 4.44Å; I60-I64 HydrophobicContact CG2-CD1 3.8Å; I60-I64 VanDerWaalsContact O-CG1 3.3Å; I60-I64 WeakPolarHBondContact O-CG1 3.35Å; I60-I64 PolarHBondContact O-N 3.33Å; R62-I64 VanDerWaalsContact C-N 3.3Å; R62-I64 PolarHBondContact O-N 2.97Å; I64-D66 VanDerWaalsContact C-N 3.31Å; I64-D66 PolarHBondContact O-N 3.36Å; I64-A67 PolarHBondContact O-N 3.42Å; I64-A67 VanDerWaalsContact O-N 3.15Å; I64-D68 PolarHBondContact O-N 2.89Å
65S94.3Very high94.2Very high67 Ų6764.2 Ų64.247%0.46930%0.302SS..Hα-helixtrans-59.8-41.9-179.6-56.80000112.3Q61 R62 D68 W69Q61-S65 PolarHBondContact O-N 3.4Å; Q61-S65 VanDerWaalsContact O-N 3.08Å; Q61-S65 PolarHBondContact O-OG 3.45Å; R62-S65 WeakPolarHBondContact O-CB 3.45Å; R62-S65 PolarHBondContact O-N 3.14Å; R62-S65 VanDerWaalsContact O-N 3.13Å; S65-D68 PolarHBondContact O-N 3.14Å; S65-W69 PolarHBondContact O-N 3.45Å
66D95.4Very high93Very high64 Ų6464.2 Ų64.234%0.34231%0.305SS..Hα-helixtrans-66-40.7177.4-67.9-25.8000110.9R62 I64 W69 I70R62-D66 IonicContact CZ-OD1 3.43Å; R62-D66 IonicContact NE-OD1 3.14Å; R62-D66 PolarHBondContact NE-OD1 3.37Å; R62-D66 VanDerWaalsContact NE-OD1 3.14Å; R62-D66 IonicContact NE-OD2 3.4Å; R62-D66 PolarHBondContact NE-OD2 3.48Å; R62-D66 IonicContact NH2-OD1 3.14Å; R62-D66 PolarHBondContact NH2-OD1 2.97Å; R62-D66 VanDerWaalsContact NH2-OD1 3.14Å; R62-D66 PolarHBondContact O-N 3.5Å; I64-D66 VanDerWaalsContact C-N 3.31Å; I64-D66 PolarHBondContact O-N 3.36Å; D66-W69 PolarHBondContact O-N 2.98Å; D66-I70 WeakPolarHBondContact O-CD1 3.29Å; D66-I70 VanDerWaalsContact O-CG1 3.25Å; D66-I70 WeakPolarHBondContact O-CG1 3.42Å; D66-I70 PolarHBondContact O-N 3.21Å
67A94.8Very high90.9Very high9 Ų975.5 Ų75.57%0.07435%0.353CS..Hα-helixtrans-64.8-41.6176.100000112.7L20 A63 I64 W69 I70 L71L20-A67 HydrophobicContact CD2-CB 3.61Å; A63-A67 WeakPolarHBondContact O-CB 3.28Å; A63-A67 PolarHBondContact O-N 3.37Å; I64-A67 PolarHBondContact O-N 3.42Å; I64-A67 VanDerWaalsContact O-N 3.15Å; A67-W69 VanDerWaalsContact C-N 3.34Å; A67-I70 PolarHBondContact O-N 3.21Å; A67-L71 WeakPolarHBondContact O-CG 3.5Å; A67-L71 PolarHBondContact O-N 3.34Å
68D92.3Very high90.7Very high21 Ų2175.8 Ų75.811%0.11235%0.354CS..Hα-helixtrans-62.7-43.1176.4-67.5-28.3000110.8P3 L4 Y19 I64 S65 L71 D72P3-D68 VanDerWaalsContact CA-OD2 3.23Å; P3-D68 WeakPolarHBondContact CA-OD2 3.49Å; P3-D68 WeakPolarHBondContact CB-OD2 3.37Å; L4-D68 PolarHBondContact N-OD1 2.88Å; Y19-D68 PolarHBondContact OH-OD1 3.46Å; I64-D68 PolarHBondContact O-N 2.89Å; S65-D68 PolarHBondContact O-N 3.14Å; D68-L71 PolarHBondContact O-N 3.17Å; D68-D72 WeakPolarHBondContact O-CB 3.36Å; D68-D72 PolarHBondContact O-N 3.41Å
69W93.3Very high90.4Very high146 Ų14674.5 Ų74.555%0.55335%0.346SS*.Hα-helixtrans-62.9-42.5175.6179.384.5000112.6S65 D66 A67 D72 K73S65-W69 PolarHBondContact O-N 3.45Å; D66-W69 PolarHBondContact O-N 2.98Å; A67-W69 VanDerWaalsContact C-N 3.34Å; W69-D72 PolarHBondContact O-N 2.98Å; W69-K73 HydrophobicContact CH2-CD 3.67Å; W69-K73 HydrophobicContact CZ2-CD 4.04Å; W69-K73 HydrophobicContact CZ3-CD 4.02Å; W69-K73 VanDerWaalsContact O-CB 3.32Å; W69-K73 WeakPolarHBondContact O-CB 3.45Å; W69-K73 PolarHBondContact O-N 3.19Å
70I93.8Very high90.1Very high29 Ų2976.1 Ų76.115%0.14935%0.352CS..Hα-helixtrans-61.2-48.3176.7-71.2162.1000110.3L27 Y36 D66 A67 K73 Y74L27-I70 HydrophobicContact CD2-CG2 3.94Å; Y36-I70 HydrophobicContact CD1-CD1 4.04Å; Y36-I70 HydrophobicContact CE1-CD1 3.46Å; Y36-I70 VanDerWaalsContact CE1-CD1 3.46Å; Y36-I70 HydrophobicContact CE1-CG1 4.2Å; Y36-I70 HydrophobicContact CE1-CG2 4.2Å; Y36-I70 HydrophobicContact CE2-CG2 3.98Å; D66-I70 WeakPolarHBondContact O-CD1 3.29Å; D66-I70 VanDerWaalsContact O-CG1 3.25Å; D66-I70 WeakPolarHBondContact O-CG1 3.42Å; D66-I70 PolarHBondContact O-N 3.21Å; A67-I70 PolarHBondContact O-N 3.21Å; I70-K73 WeakPolarHBondContact O-CB 3.47Å; I70-K73 PolarHBondContact O-N 3.45Å; I70-Y74 HydrophobicContact CG2-CD2 3.84Å; I70-Y74 HydrophobicContact CG2-CE2 4.11Å; I70-Y74 WeakPolarHBondContact O-CD2 3.4Å; I70-Y74 PolarHBondContact O-N 3.2Å; I70-Y74 VanDerWaalsContact O-N 3.1Å
71L92.3Very high89.7Confident10 Ų1080.5 Ų80.55%0.05237%0.372CS..Hα-helixtrans-65.5-41.6-178.3-75176.4000111.7L4 C23 Q26 L27 A67 D68 K73 Y74 N75L4-L71 HydrophobicContact CD1-CD1 3.23Å; C23-L71 HydrophobicContact CB-CD1 3.72Å; Q26-L71 HydrophobicContact CB-CD2 3.82Å; L27-L71 HydrophobicContact CD2-CD2 3.74Å; L27-L71 HydrophobicContact CG-CD2 4.19Å; A67-L71 WeakPolarHBondContact O-CG 3.5Å; A67-L71 PolarHBondContact O-N 3.34Å; D68-L71 PolarHBondContact O-N 3.17Å; L71-K73 VanDerWaalsContact C-N 3.34Å; L71-K73 PolarHBondContact O-N 2.95Å; L71-Y74 PolarHBondContact O-N 3.38Å; L71-N75 WeakPolarHBondContact O-CB 3.4Å; L71-N75 PolarHBondContact O-N 2.89Å
72D91.7Very high89.4Confident42 Ų4278.7 Ų78.723%0.22536%0.363CS..Hα-helixtrans-58.5-46.1173-176.168.3000111.8M1 D68 W69 Y74 K76M1-D72 HydrophobicContact CE-CB 3.73Å; M1-D72 VanDerWaalsContact CE-CG 3.46Å; M1-D72 WeakPolarHBondContact CE-OD2 3.46Å; M1-D72 HydrophobicContact SD-CB 4.35Å; D68-D72 WeakPolarHBondContact O-CB 3.36Å; D68-D72 PolarHBondContact O-N 3.41Å; W69-D72 PolarHBondContact O-N 2.98Å; D72-Y74 VanDerWaalsContact C-N 3.33Å; D72-Y74 PolarHBondContact O-N 3.02Å; D72-K76 VanDerWaalsContact CG-CE 3.48Å; D72-K76 WeakPolarHBondContact O-CB 3.33Å; D72-K76 WeakPolarHBondContact O-CG 3.32Å; D72-K76 PolarHBondContact O-N 3.27Å; D72-K76 WeakPolarHBondContact OD1-CD 3.28Å; D72-K76 WeakPolarHBondContact OD1-CE 3.4Å; D72-K76 IonicContact OD1-NZ 2.88Å; D72-K76 PolarHBondContact OD1-NZ 3.3Å; D72-K76 WeakPolarHBondContact OD2-CE 3.29Å; D72-K76 IonicContact OD2-NZ 2.69Å; D72-K76 PolarHBondContact OD2-NZ 3.43Å
73K92.9Very high89Confident104 Ų10473.6 Ų73.645%0.45235%0.348SS..Hα-helixtrans-58.8-40.8179.2178.6-179.5178.4-172.90113.2W69 I70 L71W69-K73 HydrophobicContact CH2-CD 3.67Å; W69-K73 HydrophobicContact CZ2-CD 4.04Å; W69-K73 HydrophobicContact CZ3-CD 4.02Å; W69-K73 VanDerWaalsContact O-CB 3.32Å; W69-K73 WeakPolarHBondContact O-CB 3.45Å; W69-K73 PolarHBondContact O-N 3.19Å; I70-K73 WeakPolarHBondContact O-CB 3.47Å; I70-K73 PolarHBondContact O-N 3.45Å; L71-K73 VanDerWaalsContact C-N 3.34Å; L71-K73 PolarHBondContact O-N 2.95Å
74Y91.3Very high88.4Confident87 Ų8777.3 Ų77.334%0.34136%0.36SS..Hα-helixtrans-102.1-14.7-171.9-67.5-68.3000114.8L27 M32 Y36 I70 L71 D72L27-Y74 HydrophobicContact CD2-CD2 4.41Å; M32-Y74 HydrophobicContact CE-CD1 3.36Å; M32-Y74 HydrophobicContact CE-CD2 3.5Å; M32-Y74 HydrophobicContact CE-CE1 3.68Å; M32-Y74 HydrophobicContact CE-CE2 3.84Å; M32-Y74 HydrophobicContact CE-CG 3.27Å; M32-Y74 HydrophobicContact SD-CD1 4.42Å; Y36-Y74 HydrophobicContact CE2-CE2 4.46Å; I70-Y74 HydrophobicContact CG2-CD2 3.84Å; I70-Y74 HydrophobicContact CG2-CE2 4.11Å; I70-Y74 WeakPolarHBondContact O-CD2 3.4Å; I70-Y74 PolarHBondContact O-N 3.2Å; I70-Y74 VanDerWaalsContact O-N 3.1Å; L71-Y74 PolarHBondContact O-N 3.38Å; D72-Y74 VanDerWaalsContact C-N 3.33Å; D72-Y74 PolarHBondContact O-N 3.02Å
75N84.2Confident87.9Confident74 Ų7482 Ų8240%0.39638%0.382SS..Hα-helixtrans-103.6-10.8175.3-68.5-21.6000113.6Q26 L71 K77Q26-N75 PolarHBondContact O-ND2 3.36Å; Q26-N75 PolarHBondContact O-OD1 2.9Å; L71-N75 WeakPolarHBondContact O-CB 3.4Å; L71-N75 PolarHBondContact O-N 2.89Å; N75-K77 PolarHBondContact O-N 3.06Å; N75-K77 VanDerWaalsContact O-N 3.1Å
76K71.9Confident87.3Confident135 Ų13583.3 Ų83.359%0.58737%0.374SS*.  trans-64.1110.9163.5-84.5175.4165.1156.20109D72D72-K76 VanDerWaalsContact CG-CE 3.48Å; D72-K76 WeakPolarHBondContact O-CB 3.33Å; D72-K76 WeakPolarHBondContact O-CG 3.32Å; D72-K76 PolarHBondContact O-N 3.27Å; D72-K76 WeakPolarHBondContact OD1-CD 3.28Å; D72-K76 WeakPolarHBondContact OD1-CE 3.4Å; D72-K76 IonicContact OD1-NZ 2.88Å; D72-K76 PolarHBondContact OD1-NZ 3.3Å; D72-K76 WeakPolarHBondContact OD2-CE 3.29Å; D72-K76 IonicContact OD2-NZ 2.69Å; D72-K76 PolarHBondContact OD2-NZ 3.43Å
77K54.3Low86.6Confident278 Ų27885 Ų85100%1.20938%0.377SS*.  trans-68.20166.5-81.9-173.4174.3-176.90110.8N75N75-K77 PolarHBondContact O-N 3.06Å; N75-K77 VanDerWaalsContact O-N 3.1Å

Retrieved 77 of 77 residues in 146.3 ms (Link to these results)

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