A0A060YE87_ONCMY Loading...

Stem cell protein

AlphaFold DB , UniProt , Accession A0A060YE87, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 112 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
1M62.1Low88.4Confident207 Ų207132.2 Ų132.2100%1.0264%0.638SS**  0-28.80-134.373.8174.300113.7
2T76.4Confident89.3Confident123 Ų123136 Ų13676%0.75564%0.641SS**Hα-helixtrans-65.8-38.2-171.521.40000116.2K4 V5 F6T2-K4 PolarHBondContact O-N 2.67Å; T2-V5 PolarHBondContact O-N 3.25Å; T2-F6 PolarHBondContact O-N 3.01Å
3R83.1Confident90Very high212 Ų212138.5 Ų138.580%0.864%0.641SS**Hα-helixtrans-62.1-41.2-179.5-169.3179-173.7178.82.7112.9V5 F6 T7R3-V5 VanDerWaalsContact C-N 3.34Å; R3-V5 PolarHBondContact O-N 3.21Å; R3-F6 PolarHBondContact O-N 3.32Å; R3-T7 PolarHBondContact O-N 3.49Å; R3-T7 PolarHBondContact O-OG1 3.4Å
4K86.7Confident90.6Very high176 Ų176137 Ų13777%0.76563%0.627SS**Hα-helixtrans-64.6-39.4178.8-70.9-178.3176.8177.20111.6T2 N8T2-K4 PolarHBondContact O-N 2.67Å; K4-N8 WeakPolarHBondContact O-CB 3.31Å; K4-N8 PolarHBondContact O-N 3.27Å
5V91.2Very high91.1Very high91 Ų91132.6 Ų132.655%0.55261%0.607SS**Hα-helixtrans-64.8-49.2177178.80000110.4T2 R3 T7 N8 T9T2-V5 PolarHBondContact O-N 3.25Å; R3-V5 VanDerWaalsContact C-N 3.34Å; R3-V5 PolarHBondContact O-N 3.21Å; V5-T7 PolarHBondContact O-N 3.15Å; V5-N8 PolarHBondContact O-N 3.21Å; V5-T9 PolarHBondContact O-N 3.04Å; V5-T9 PolarHBondContact O-OG1 3.41Å; V5-T9 VanDerWaalsContact O-OG1 3.09Å
6F90.6Very high91.6Very high146 Ų146131.3 Ų131.364%0.6460%0.601SS**Hα-helixtrans-58.9-46.1177.9-178-98.5000112.4T2 R3 N8 T9 R10T2-F6 PolarHBondContact O-N 3.01Å; R3-F6 PolarHBondContact O-N 3.32Å; F6-N8 PolarHBondContact O-N 3.29Å; F6-T9 PolarHBondContact O-N 3.48Å; F6-R10 PolarHBondContact O-N 2.88Å
7T94Very high92Very high80 Ų80127.4 Ų127.449%0.49159%0.587SS.*Hα-helixtrans-61.7-41.6176.8-580000112.1R3 V5 R10 E11R3-T7 PolarHBondContact O-N 3.49Å; R3-T7 PolarHBondContact O-OG1 3.4Å; V5-T7 PolarHBondContact O-N 3.15Å; T7-R10 PolarHBondContact O-N 3.4Å; T7-E11 PolarHBondContact O-N 2.96Å
8N96.4Very high92.3Very high95 Ų95123.1 Ų123.151%0.50857%0.571SS.*Hα-helixtrans-64.3-45.4178-169.7-74.2000111.8K4 V5 F6 R10 E11 R12K4-N8 WeakPolarHBondContact O-CB 3.31Å; K4-N8 PolarHBondContact O-N 3.27Å; V5-N8 PolarHBondContact O-N 3.21Å; F6-N8 PolarHBondContact O-N 3.29Å; N8-R10 VanDerWaalsContact C-N 3.31Å; N8-R10 PolarHBondContact O-N 3.01Å; N8-E11 PolarHBondContact O-N 2.95Å; N8-R12 WeakPolarHBondContact O-CB 3.35Å; N8-R12 PolarHBondContact O-N 2.87Å
9T96.8Very high92.7Very high86 Ų86120.4 Ų120.453%0.52856%0.561SS.*Hα-helixtrans-58.4-45.1176.8-59.90000111.1V5 F6 R12 W13V5-T9 PolarHBondContact O-N 3.04Å; V5-T9 PolarHBondContact O-OG1 3.41Å; V5-T9 VanDerWaalsContact O-OG1 3.09Å; F6-T9 PolarHBondContact O-N 3.48Å; T9-R12 PolarHBondContact O-N 3.31Å; T9-W13 PolarHBondContact O-N 3.27Å
10R97.6Very high92.9Very high166 Ų166117.5 Ų117.563%0.62655%0.552SS**Hα-helixtrans-62.3-45.1177.4-178174172.3-91.42.3112.3F6 T7 N8 R12 W13 R14F6-R10 PolarHBondContact O-N 2.88Å; T7-R10 PolarHBondContact O-N 3.4Å; N8-R10 VanDerWaalsContact C-N 3.31Å; N8-R10 PolarHBondContact O-N 3.01Å; R10-R12 VanDerWaalsContact C-N 3.34Å; R10-R12 PolarHBondContact O-N 3.32Å; R10-W13 PolarHBondContact O-N 2.93Å; R10-R14 PolarHBondContact O-N 2.94Å
11E98Very high93.2Very high72 Ų72114.8 Ų114.834%0.33655%0.549SS..Hα-helixtrans-65.8-38.5178.3178.154.7-160.800111.8T7 N8 W13 R14 Q15T7-E11 PolarHBondContact O-N 2.96Å; N8-E11 PolarHBondContact O-N 2.95Å; E11-W13 VanDerWaalsContact C-N 3.32Å; E11-W13 PolarHBondContact O-N 3.33Å; E11-R14 WeakPolarHBondContact O-CB 3.38Å; E11-R14 PolarHBondContact O-N 2.95Å; E11-R14 IonicContact OE1-CZ 2.66Å; E11-R14 IonicContact OE1-NE 3.45Å; E11-R14 PolarHBondContact OE1-NE 3.22Å; E11-R14 IonicContact OE1-NH2 2.76Å; E11-R14 PolarHBondContact OE1-NH2 3.07Å; E11-R14 IonicContact OE2-CZ 2.84Å; E11-R14 IonicContact OE2-NE 3.7Å; E11-R14 PolarHBondContact OE2-NE 3.35Å; E11-R14 IonicContact OE2-NH2 3.68Å; E11-Q15 HydrophobicContact CG-CG 4.48Å; E11-Q15 WeakPolarHBondContact O-CG 3.47Å; E11-Q15 PolarHBondContact O-N 2.95Å; E11-Q15 WeakPolarHBondContact OE1-CG 3.34Å; E11-Q15 PolarHBondContact OE1-NE2 2.91Å
12R98.4Very high94.9Very high178 Ų178107 Ų10767%0.67251%0.51SS*.Hα-helixtrans-59.5-43.5173.5-174.7-176.5-63.6-109.4-0.3111.6N8 T9 R10 Q15 H16N8-R12 WeakPolarHBondContact O-CB 3.35Å; N8-R12 PolarHBondContact O-N 2.87Å; T9-R12 PolarHBondContact O-N 3.31Å; R10-R12 VanDerWaalsContact C-N 3.34Å; R10-R12 PolarHBondContact O-N 3.32Å; R12-Q15 PolarHBondContact O-N 2.84Å; R12-H16 WeakPolarHBondContact O-CB 3.43Å; R12-H16 PolarHBondContact O-N 2.98Å
13W98.3Very high96Very high169 Ų169103.4 Ų103.464%0.6449%0.493SS*.Hα-helixtrans-63.4-42.2176.4-172.580.6000111.9T9 R10 E11 Q15 H16 N17T9-W13 PolarHBondContact O-N 3.27Å; R10-W13 PolarHBondContact O-N 2.93Å; E11-W13 VanDerWaalsContact C-N 3.32Å; E11-W13 PolarHBondContact O-N 3.33Å; W13-Q15 VanDerWaalsContact C-N 3.34Å; W13-Q15 PolarHBondContact O-N 2.99Å; W13-H16 WeakPolarHBondContact O-CB 3.28Å; W13-H16 PolarHBondContact O-N 3.18Å; W13-N17 WeakPolarHBondContact CH2-ND2 3.4Å; W13-N17 WeakPolarHBondContact CZ2-ND2 3.39Å; W13-N17 WeakPolarHBondContact CZ3-ND2 3.48Å; W13-N17 PolarHBondContact O-N 3.47Å
14R98.5Very high96.7Very high117 Ų11797.9 Ų97.944%0.44248%0.476SS..Hα-helixtrans-59.1-45.2174.6-164.1-168.170.380.2-2112R10 E11 N17 V18R10-R14 PolarHBondContact O-N 2.94Å; E11-R14 WeakPolarHBondContact O-CB 3.38Å; E11-R14 PolarHBondContact O-N 2.95Å; E11-R14 IonicContact OE1-CZ 2.66Å; E11-R14 IonicContact OE1-NE 3.45Å; E11-R14 PolarHBondContact OE1-NE 3.22Å; E11-R14 IonicContact OE1-NH2 2.76Å; E11-R14 PolarHBondContact OE1-NH2 3.07Å; E11-R14 IonicContact OE2-CZ 2.84Å; E11-R14 IonicContact OE2-NE 3.7Å; E11-R14 PolarHBondContact OE2-NE 3.35Å; E11-R14 IonicContact OE2-NH2 3.68Å; R14-N17 PolarHBondContact O-N 3.19Å; R14-V18 PolarHBondContact O-N 3.46Å
15Q98.6Very high97.3Very high71 Ų7192.2 Ų92.233%0.33245%0.454SS..Hα-helixtrans-67.1-36.1177.2-68.6-70.1-14.600112.4E11 R12 W13 V18 N19E11-Q15 HydrophobicContact CG-CG 4.48Å; E11-Q15 WeakPolarHBondContact O-CG 3.47Å; E11-Q15 PolarHBondContact O-N 2.95Å; E11-Q15 WeakPolarHBondContact OE1-CG 3.34Å; E11-Q15 PolarHBondContact OE1-NE2 2.91Å; R12-Q15 PolarHBondContact O-N 2.84Å; W13-Q15 VanDerWaalsContact C-N 3.34Å; W13-Q15 PolarHBondContact O-N 2.99Å; Q15-V18 PolarHBondContact O-N 3.39Å; Q15-N19 WeakPolarHBondContact O-CB 3.48Å; Q15-N19 PolarHBondContact O-N 3.05Å; Q15-N19 PolarHBondContact O-ND2 3.12Å
16H98.5Very high97.6Very high111 Ų11189.8 Ų89.851%0.51444%0.435SS..Hα-helixtrans-58.5-49173.9178.774.3000110.8R12 W13 V18 N19 T20R12-H16 WeakPolarHBondContact O-CB 3.43Å; R12-H16 PolarHBondContact O-N 2.98Å; W13-H16 WeakPolarHBondContact O-CB 3.28Å; W13-H16 PolarHBondContact O-N 3.18Å; H16-V18 VanDerWaalsContact C-N 3.32Å; H16-V18 PolarHBondContact O-N 3.39Å; H16-N19 PolarHBondContact O-N 3.33Å; H16-N19 VanDerWaalsContact O-N 3.09Å; H16-T20 PolarHBondContact O-N 3.45Å; H16-T20 PolarHBondContact O-OG1 3.14Å; H16-T20 VanDerWaalsContact O-OG1 3.1Å
17N98.6Very high97.9Very high66 Ų6689.5 Ų89.535%0.35343%0.434SS..Hα-helixtrans-58.4-42.6177.6-66.2-8.9000112.4W13 R14 T20 A21W13-N17 WeakPolarHBondContact CH2-ND2 3.4Å; W13-N17 WeakPolarHBondContact CZ2-ND2 3.39Å; W13-N17 WeakPolarHBondContact CZ3-ND2 3.48Å; W13-N17 PolarHBondContact O-N 3.47Å; R14-N17 PolarHBondContact O-N 3.19Å; N17-T20 PolarHBondContact O-N 3.35Å; N17-A21 PolarHBondContact O-N 3.12Å
18V98.5Very high98.1Very high50 Ų5091.6 Ų91.630%0.30344%0.441SS..Hα-helixtrans-62.2-44.5175.4172.60000111.1R14 Q15 H16 T20 A21 F22R14-V18 PolarHBondContact O-N 3.46Å; Q15-V18 PolarHBondContact O-N 3.39Å; H16-V18 VanDerWaalsContact C-N 3.32Å; H16-V18 PolarHBondContact O-N 3.39Å; V18-T20 VanDerWaalsContact C-N 3.33Å; V18-T20 PolarHBondContact O-N 3.24Å; V18-A21 PolarHBondContact O-N 3.35Å; V18-F22 HydrophobicContact CG1-CD2 3.99Å; V18-F22 HydrophobicContact CG1-CE2 4.12Å; V18-F22 WeakPolarHBondContact O-CD2 3.31Å; V18-F22 PolarHBondContact O-N 3.33Å
19N98.3Very high98.2Very high72 Ų7287.4 Ų87.439%0.38542%0.418SS..Hα-helixtrans-65.7-36.9179.6-68.5-28000112Q15 H16 F22 A23 K40Q15-N19 WeakPolarHBondContact O-CB 3.48Å; Q15-N19 PolarHBondContact O-N 3.05Å; Q15-N19 PolarHBondContact O-ND2 3.12Å; H16-N19 PolarHBondContact O-N 3.33Å; H16-N19 VanDerWaalsContact O-N 3.09Å; N19-F22 WeakPolarHBondContact O-CB 3.38Å; N19-F22 PolarHBondContact O-N 2.81Å; N19-A23 PolarHBondContact O-N 2.75Å; N19-K40 WeakPolarHBondContact OD1-CE 3.17Å; N19-K40 PolarHBondContact OD1-NZ 3.35Å
20T98.6Very high98.2Very high61 Ų6186.9 Ų86.937%0.37442%0.417SS..Hα-helixtrans-62-45.1173.4-58.10000111H16 N17 V18 F22 A23 E24H16-T20 PolarHBondContact O-N 3.45Å; H16-T20 PolarHBondContact O-OG1 3.14Å; H16-T20 VanDerWaalsContact O-OG1 3.1Å; N17-T20 PolarHBondContact O-N 3.35Å; V18-T20 VanDerWaalsContact C-N 3.33Å; V18-T20 PolarHBondContact O-N 3.24Å; T20-F22 VanDerWaalsContact C-N 3.32Å; T20-F22 PolarHBondContact O-N 2.74Å; T20-A23 WeakPolarHBondContact O-CB 3.4Å; T20-A23 PolarHBondContact O-N 2.86Å; T20-E24 PolarHBondContact O-N 2.99Å
21A98.5Very high98.1Very high61 Ų6180.7 Ų80.750%0.50440%0.398SS..Hα-helixtrans-61.2-38.3174.900000112.7N17 V18 A23 E24 L25N17-A21 PolarHBondContact O-N 3.12Å; V18-A21 PolarHBondContact O-N 3.35Å; A21-A23 VanDerWaalsContact C-N 3.32Å; A21-A23 PolarHBondContact O-N 3.06Å; A21-E24 PolarHBondContact O-N 2.95Å; A21-L25 WeakPolarHBondContact O-CB 3.46Å; A21-L25 PolarHBondContact O-N 3.23Å
22F98.6Very high97.9Very high43 Ų4385.9 Ų85.919%0.18942%0.421CS..Hα-helixtrans-62.4-37.4172.6-97.8-85.2000112.6V18 N19 T20 R26 K40 I43 L44V18-F22 HydrophobicContact CG1-CD2 3.99Å; V18-F22 HydrophobicContact CG1-CE2 4.12Å; V18-F22 WeakPolarHBondContact O-CD2 3.31Å; V18-F22 PolarHBondContact O-N 3.33Å; N19-F22 WeakPolarHBondContact O-CB 3.38Å; N19-F22 PolarHBondContact O-N 2.81Å; T20-F22 VanDerWaalsContact C-N 3.32Å; T20-F22 PolarHBondContact O-N 2.74Å; F22-R26 WeakPolarHBondContact O-CB 3.47Å; F22-R26 PolarHBondContact O-N 3.28Å; F22-K40 HydrophobicContact CD1-CB 4.21Å; F22-K40 HydrophobicContact CD1-CG 4.01Å; F22-K40 HydrophobicContact CE1-CB 3.67Å; F22-K40 HydrophobicContact CE1-CG 3.91Å; F22-K40 HydrophobicContact CE2-CD 4.41Å; F22-K40 HydrophobicContact CG-CG 4.43Å; F22-K40 HydrophobicContact CZ-CB 4.05Å; F22-K40 HydrophobicContact CZ-CD 4.35Å; F22-K40 HydrophobicContact CZ-CG 4.24Å; F22-I43 HydrophobicContact CD1-CB 4.25Å; F22-I43 HydrophobicContact CD1-CD1 4.03Å; F22-I43 HydrophobicContact CD1-CG2 3.9Å; F22-I43 HydrophobicContact CE1-CB 4.36Å; F22-I43 HydrophobicContact CE1-CG2 4.17Å; F22-L44 HydrophobicContact CE1-CD2 4.14Å; F22-L44 HydrophobicContact CE1-CG 4.08Å; F22-L44 HydrophobicContact CZ-CD1 4.32Å; F22-L44 HydrophobicContact CZ-CD2 4.08Å; F22-L44 HydrophobicContact CZ-CG 4.19Å
23A98Very high97.7Very high49 Ų4980 Ų8041%0.40541%0.406SS..Hα-helixtrans-68.2-41.7176.800000111.8N19 T20 A21 R26 K27N19-A23 PolarHBondContact O-N 2.75Å; T20-A23 WeakPolarHBondContact O-CB 3.4Å; T20-A23 PolarHBondContact O-N 2.86Å; A21-A23 VanDerWaalsContact C-N 3.32Å; A21-A23 PolarHBondContact O-N 3.06Å; A23-R26 WeakPolarHBondContact O-CB 3.34Å; A23-R26 PolarHBondContact O-N 2.66Å; A23-K27 PolarHBondContact O-N 3.39Å
24E98.4Very high97.4Very high95 Ų9576.3 Ų76.344%0.44440%0.404SS..Hα-helixtrans-63.4-45.3174-64.9-49.7133.300111.6T20 A21 R26 K27T20-E24 PolarHBondContact O-N 2.99Å; A21-E24 PolarHBondContact O-N 2.95Å; E24-R26 VanDerWaalsContact C-N 3.27Å; E24-R26 PolarHBondContact O-N 3.14Å; E24-K27 WeakPolarHBondContact O-CB 3.41Å; E24-K27 PolarHBondContact O-N 3.31Å; E24-K27 VanDerWaalsContact O-N 3.14Å; E24-K27 IonicContact OE1-NZ 3.31Å; E24-K27 PolarHBondContact OE1-NZ 2.97Å; E24-K27 IonicContact OE2-NZ 2.82Å; E24-K27 PolarHBondContact OE2-NZ 3.47Å
25L98.4Very high97.1Very high57 Ų5777.4 Ų77.430%0.29841%0.414SS..Hα-helixtrans-59.2-39.1175.4-17958.5000111.9A21 K27 L28 I43 A47A21-L25 WeakPolarHBondContact O-CB 3.46Å; A21-L25 PolarHBondContact O-N 3.23Å; L25-K27 VanDerWaalsContact C-N 3.29Å; L25-K27 PolarHBondContact O-N 3.45Å; L25-L28 PolarHBondContact O-N 3.31Å; L25-I43 HydrophobicContact CB-CG2 4.37Å; L25-I43 HydrophobicContact CD2-CG2 3.66Å; L25-I43 HydrophobicContact CG-CG2 3.85Å; L25-A47 HydrophobicContact CD1-CB 4.06Å; L25-A47 HydrophobicContact CD2-CB 4.26Å; L25-A47 HydrophobicContact CG-CB 4.43Å
26R98.1Very high96.9Very high41 Ų4178.5 Ų78.516%0.15542%0.418CS..Hα-helixtrans-59.7-36.9177.7171.860.8-172.585.6-0.7112.5F22 A23 E24 L28 I29 T31 P34 K36 L38 I43F22-R26 WeakPolarHBondContact O-CB 3.47Å; F22-R26 PolarHBondContact O-N 3.28Å; A23-R26 WeakPolarHBondContact O-CB 3.34Å; A23-R26 PolarHBondContact O-N 2.66Å; E24-R26 VanDerWaalsContact C-N 3.27Å; E24-R26 PolarHBondContact O-N 3.14Å; R26-L28 PolarHBondContact O-N 3.3Å; R26-I29 PolarHBondContact NH1-O 3.2Å; R26-I29 PolarHBondContact O-N 2.81Å; R26-T31 PolarHBondContact NH2-OG1 3.24Å; R26-P34 PolarHBondContact NH2-O 2.78Å; R26-K36 PolarHBondContact NE-O 3.44Å; R26-K36 PolarHBondContact NH2-O 3.21Å; R26-L38 VanDerWaalsContact CD-CD1 3.49Å; R26-I43 HydrophobicContact CB-CD1 4.1Å; R26-I43 HydrophobicContact CB-CG1 4.48Å
27K97.6Very high96.8Very high140 Ų14082.6 Ų82.661%0.60943%0.434SS*.Hα-helixtrans-64.3-28179.9-64.8173.1-167.9167.80112.5A23 E24 L25A23-K27 PolarHBondContact O-N 3.39Å; E24-K27 WeakPolarHBondContact O-CB 3.41Å; E24-K27 PolarHBondContact O-N 3.31Å; E24-K27 VanDerWaalsContact O-N 3.14Å; E24-K27 IonicContact OE1-NZ 3.31Å; E24-K27 PolarHBondContact OE1-NZ 2.97Å; E24-K27 IonicContact OE2-NZ 2.82Å; E24-K27 PolarHBondContact OE2-NZ 3.47Å; L25-K27 VanDerWaalsContact C-N 3.29Å; L25-K27 PolarHBondContact O-N 3.45Å
28L97.9Very high96.7Very high123 Ų12380.7 Ų80.764%0.64442%0.424SS*.THydrogen-bonded Turntrans-83.3-12.3-179.7-57.3177.2000113.3L25 R26 P30 Y50L25-L28 PolarHBondContact O-N 3.31Å; R26-L28 PolarHBondContact O-N 3.3Å; L28-P30 WeakPolarHBondContact O-CD 3.47Å; L28-Y50 WeakPolarHBondContact O-CE1 3.16Å
29I97.7Very high96.7Very high7 Ų781 Ų814%0.03643%0.428CS..SBendtrans-88.5118.8-177.6-65.4170.9000109.6R26 T31 L38 I43 L46 A47R26-I29 PolarHBondContact NH1-O 3.2Å; R26-I29 PolarHBondContact O-N 2.81Å; I29-T31 HydrophobicContact CG2-CG2 4.15Å; I29-T31 PolarHBondContact O-N 3.35Å; I29-L38 HydrophobicContact CG2-CD1 4.26Å; I29-I43 HydrophobicContact CD1-CB 4.19Å; I29-I43 HydrophobicContact CD1-CG1 4.47Å; I29-I43 HydrophobicContact CD1-CG2 3.76Å; I29-I43 VanDerWaalsContact CD1-O 3.27Å; I29-I43 WeakPolarHBondContact CD1-O 3.3Å; I29-L46 HydrophobicContact CD1-CB 4.1Å; I29-L46 HydrophobicContact CG2-CB 3.64Å; I29-L46 HydrophobicContact CG2-CD1 4.15Å; I29-L46 HydrophobicContact CG2-CD2 4.49Å; I29-L46 HydrophobicContact CG2-CG 4.3Å; I29-A47 HydrophobicContact CD1-CB 4.28Å
30P97.2Very high96.7Very high76 Ų7682.5 Ų82.549%0.49443%0.431SS..  trans-68127.3175.7-17.831.6000111.6L28 Y50L28-P30 WeakPolarHBondContact O-CD 3.47Å; P30-Y50 HydrophobicContact CG-CD1 4.35Å; P30-Y50 HydrophobicContact CG-CD2 3.87Å; P30-Y50 HydrophobicContact CG-CE1 3.98Å; P30-Y50 HydrophobicContact CG-CE2 3.48Å; P30-Y50 VanDerWaalsContact CG-CE2 3.48Å; P30-Y50 HydrophobicContact CG-CG 4.3Å
31T96.6Very high96.7Very high36 Ų3683.2 Ų83.222%0.22143%0.433CS..  trans-142.2155.3174.361.50000111.6R26 I29 P33 P34 L38R26-T31 PolarHBondContact NH2-OG1 3.24Å; I29-T31 HydrophobicContact CG2-CG2 4.15Å; I29-T31 PolarHBondContact O-N 3.35Å; T31-P33 CarbonylContact C-O 3.52Å; T31-P33 CarbonylContact O-C 3.4Å; T31-P33 PolarHBondContact OG1-O 3.23Å; T31-P34 PolarHBondContact OG1-O 3.42Å; T31-L38 HydrophobicContact CG2-CD1 4.02Å
32H93.6Very high96.6Very high180 Ų18083.9 Ų83.983%0.83343%0.426SS*.SBendtrans-119.2122.4166.6-171.172000109.6
33P94.5Very high96.6Very high55 Ų5582.4 Ų82.436%0.35742%0.42SS..SBendcis-69.2162.6-9.933.4-37.6000112.3T31 E35 K36T31-P33 CarbonylContact C-O 3.52Å; T31-P33 CarbonylContact O-C 3.4Å; T31-P33 PolarHBondContact OG1-O 3.23Å; P33-E35 WeakPolarHBondContact CB-OE1 3.34Å; P33-E35 PolarHBondContact O-N 2.72Å; P33-K36 WeakPolarHBondContact O-CB 3.17Å; P33-K36 PolarHBondContact O-N 2.95Å; P33-K36 VanDerWaalsContact O-N 3.15Å
34P90.9Very high96.6Very high91 Ų9184 Ų8459%0.59142%0.421SS*.THydrogen-bonded Turntrans-62.8-28.4-176.921.9-29.9000113.1R26 T31 K36R26-P34 PolarHBondContact NH2-O 2.78Å; T31-P34 PolarHBondContact OG1-O 3.42Å; P34-K36 VanDerWaalsContact C-N 3.3Å; P34-K36 PolarHBondContact O-N 3.49Å
35E91.3Very high96.5Very high141 Ų14186.5 Ų86.566%0.65943%0.426SS*.THydrogen-bonded Turntrans-84.16.2178.368.3-80.8-176.800114.5P33 K37P33-E35 WeakPolarHBondContact CB-OE1 3.34Å; P33-E35 PolarHBondContact O-N 2.72Å; E35-K37 PolarHBondContact O-N 3.31Å; E35-K37 VanDerWaalsContact O-N 3.11Å
36K95.6Very high96.4Very high94 Ų9485.6 Ų85.641%0.40942%0.421SS..  trans-52.5120.6177.8179.9-177.8168.976.90110.7R26 P33 P34 L38R26-K36 PolarHBondContact NE-O 3.44Å; R26-K36 PolarHBondContact NH2-O 3.21Å; P33-K36 WeakPolarHBondContact O-CB 3.17Å; P33-K36 PolarHBondContact O-N 2.95Å; P33-K36 VanDerWaalsContact O-N 3.15Å; P34-K36 VanDerWaalsContact C-N 3.3Å; P34-K36 PolarHBondContact O-N 3.49Å; K36-L38 HydrophobicContact CD-CD2 3.85Å; K36-L38 HydrophobicContact CG-CD2 4.01Å; K36-L38 PolarHBondContact O-N 3.26Å
37K96.4Very high96.3Very high196 Ų19684.3 Ų84.385%0.85242%0.419SS*.  trans-69123.7173.5-65.4-174.7178.8177.50109.2E35E35-K37 PolarHBondContact O-N 3.31Å; E35-K37 VanDerWaalsContact O-N 3.11Å
38L96.6Very high96.2Very high26 Ų2681.8 Ų81.814%0.13641%0.411CS..  trans-112.5139.8177.6-61.6-176.7000109.7R26 I29 T31 K36 E42 I43 L46R26-L38 VanDerWaalsContact CD-CD1 3.49Å; I29-L38 HydrophobicContact CG2-CD1 4.26Å; T31-L38 HydrophobicContact CG2-CD1 4.02Å; K36-L38 HydrophobicContact CD-CD2 3.85Å; K36-L38 HydrophobicContact CG-CD2 4.01Å; K36-L38 PolarHBondContact O-N 3.26Å; L38-E42 HydrophobicContact CB-CB 4.32Å; L38-E42 HydrophobicContact CD2-CB 4.49Å; L38-I43 HydrophobicContact CB-CD1 4.29Å; L38-I43 HydrophobicContact CB-CG1 3.69Å; L38-I43 HydrophobicContact CD1-CG1 4.17Å; L38-L46 HydrophobicContact CD1-CD1 3.56Å; L38-L46 HydrophobicContact CD2-CD1 4.07Å; L38-L46 HydrophobicContact CG-CD1 4.47Å
39S98.1Very high95.9Very high57 Ų5783.4 Ų83.440%0.39941%0.409SS..  trans-69160.5168.167.70000111.3N41 E42 I43S39-N41 PolarHBondContact O-N 3.42Å; S39-E42 VanDerWaalsContact CB-OE2 3.26Å; S39-E42 WeakPolarHBondContact CB-OE2 3.27Å; S39-E42 PolarHBondContact N-OE2 2.89Å; S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 WeakPolarHBondContact OG-CB 3.46Å; S39-E42 VanDerWaalsContact OG-CG 3.25Å; S39-E42 WeakPolarHBondContact OG-CG 3.32Å; S39-E42 PolarHBondContact OG-N 3.26Å; S39-E42 PolarHBondContact OG-OE2 3.26Å; S39-I43 WeakPolarHBondContact O-CG1 3.45Å; S39-I43 PolarHBondContact O-N 2.89Å
40K97.9Very high95.9Very high103 Ų10386.9 Ų86.945%0.44842%0.422SS..Hα-helixtrans-54.5-41.3175.8-69.4-174.5175.9-174.80112N19 F22 I43 L44N19-K40 WeakPolarHBondContact OD1-CE 3.17Å; N19-K40 PolarHBondContact OD1-NZ 3.35Å; F22-K40 HydrophobicContact CD1-CB 4.21Å; F22-K40 HydrophobicContact CD1-CG 4.01Å; F22-K40 HydrophobicContact CE1-CB 3.67Å; F22-K40 HydrophobicContact CE1-CG 3.91Å; F22-K40 HydrophobicContact CE2-CD 4.41Å; F22-K40 HydrophobicContact CG-CG 4.43Å; F22-K40 HydrophobicContact CZ-CB 4.05Å; F22-K40 HydrophobicContact CZ-CD 4.35Å; F22-K40 HydrophobicContact CZ-CG 4.24Å; K40-I43 PolarHBondContact O-N 3.05Å; K40-L44 WeakPolarHBondContact O-CG 3.45Å; K40-L44 PolarHBondContact O-N 3.4Å; K40-L44 VanDerWaalsContact O-N 3.15Å
41N97.9Very high95.8Very high77 Ų7787.5 Ų87.541%0.41242%0.42SS..Hα-helixtrans-68.5-42.1-179.9-175.9-87.4000112.2S39 I43 L44 R45S39-N41 PolarHBondContact O-N 3.42Å; N41-I43 VanDerWaalsContact C-N 3.34Å; N41-I43 PolarHBondContact O-N 3.16Å; N41-L44 PolarHBondContact O-N 3.39Å; N41-R45 WeakPolarHBondContact O-CG 3.33Å; N41-R45 PolarHBondContact O-N 3.1Å; N41-R45 WeakPolarHBondContact OD1-CD 3.35Å; N41-R45 PolarHBondContact OD1-NE 2.85Å; N41-R45 PolarHBondContact OD1-NH1 3.3Å
42E97.5Very high95.3Very high75 Ų7587.6 Ų87.635%0.3542%0.419SS..Hα-helixtrans-61.8-42.8174.7-73.1167.5117.100111.7L38 S39 L44 R45 L46L38-E42 HydrophobicContact CB-CB 4.32Å; L38-E42 HydrophobicContact CD2-CB 4.49Å; S39-E42 VanDerWaalsContact CB-OE2 3.26Å; S39-E42 WeakPolarHBondContact CB-OE2 3.27Å; S39-E42 PolarHBondContact N-OE2 2.89Å; S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 WeakPolarHBondContact OG-CB 3.46Å; S39-E42 VanDerWaalsContact OG-CG 3.25Å; S39-E42 WeakPolarHBondContact OG-CG 3.32Å; S39-E42 PolarHBondContact OG-N 3.26Å; S39-E42 PolarHBondContact OG-OE2 3.26Å; E42-L44 VanDerWaalsContact C-N 3.32Å; E42-L44 PolarHBondContact O-N 2.97Å; E42-R45 PolarHBondContact O-N 2.75Å; E42-L46 HydrophobicContact CB-CD1 4.45Å; E42-L46 VanDerWaalsContact O-CB 3.29Å; E42-L46 WeakPolarHBondContact O-CB 3.38Å; E42-L46 WeakPolarHBondContact O-CG 3.48Å; E42-L46 PolarHBondContact O-N 3.21Å
43I98.2Very high95.2Very high12 Ų1284.4 Ų84.46%0.06240%0.403CS..Hα-helixtrans-54.5-49.2175.5-70.9168000110.1F22 L25 R26 I29 L38 S39 K40 N41 L46 A47F22-I43 HydrophobicContact CD1-CB 4.25Å; F22-I43 HydrophobicContact CD1-CD1 4.03Å; F22-I43 HydrophobicContact CD1-CG2 3.9Å; F22-I43 HydrophobicContact CE1-CB 4.36Å; F22-I43 HydrophobicContact CE1-CG2 4.17Å; L25-I43 HydrophobicContact CB-CG2 4.37Å; L25-I43 HydrophobicContact CD2-CG2 3.66Å; L25-I43 HydrophobicContact CG-CG2 3.85Å; R26-I43 HydrophobicContact CB-CD1 4.1Å; R26-I43 HydrophobicContact CB-CG1 4.48Å; I29-I43 HydrophobicContact CD1-CB 4.19Å; I29-I43 HydrophobicContact CD1-CG1 4.47Å; I29-I43 HydrophobicContact CD1-CG2 3.76Å; I29-I43 VanDerWaalsContact CD1-O 3.27Å; I29-I43 WeakPolarHBondContact CD1-O 3.3Å; L38-I43 HydrophobicContact CB-CD1 4.29Å; L38-I43 HydrophobicContact CB-CG1 3.69Å; L38-I43 HydrophobicContact CD1-CG1 4.17Å; S39-I43 WeakPolarHBondContact O-CG1 3.45Å; S39-I43 PolarHBondContact O-N 2.89Å; K40-I43 PolarHBondContact O-N 3.05Å; N41-I43 VanDerWaalsContact C-N 3.34Å; N41-I43 PolarHBondContact O-N 3.16Å; I43-L46 PolarHBondContact O-N 3.19Å; I43-A47 VanDerWaalsContact O-CB 3.3Å; I43-A47 WeakPolarHBondContact O-CB 3.32Å; I43-A47 PolarHBondContact O-N 3.41Å
44L98.2Very high95.1Very high83 Ų8384.9 Ų84.944%0.43540%0.402SS..Hα-helixtrans-62.1-47.3179-65.4174.7000111.9F22 K40 N41 E42 L46 A47 M48F22-L44 HydrophobicContact CE1-CD2 4.14Å; F22-L44 HydrophobicContact CE1-CG 4.08Å; F22-L44 HydrophobicContact CZ-CD1 4.32Å; F22-L44 HydrophobicContact CZ-CD2 4.08Å; F22-L44 HydrophobicContact CZ-CG 4.19Å; K40-L44 WeakPolarHBondContact O-CG 3.45Å; K40-L44 PolarHBondContact O-N 3.4Å; K40-L44 VanDerWaalsContact O-N 3.15Å; N41-L44 PolarHBondContact O-N 3.39Å; E42-L44 VanDerWaalsContact C-N 3.32Å; E42-L44 PolarHBondContact O-N 2.97Å; L44-L46 PolarHBondContact O-N 2.87Å; L44-A47 PolarHBondContact O-N 2.97Å; L44-M48 WeakPolarHBondContact O-CE 3.46Å; L44-M48 WeakPolarHBondContact O-CG 3.33Å; L44-M48 PolarHBondContact O-N 2.93Å; L44-M48 VanDerWaalsContact O-N 3.12Å
45R95.9Very high95Very high147 Ų14783.1 Ų83.156%0.55539%0.39SS*.Hα-helixtrans-65.1-37.9-179.7-73.1-179.7174.2152.1-3.7112.8N41 E42 M48 R49N41-R45 WeakPolarHBondContact O-CG 3.33Å; N41-R45 PolarHBondContact O-N 3.1Å; N41-R45 WeakPolarHBondContact OD1-CD 3.35Å; N41-R45 PolarHBondContact OD1-NE 2.85Å; N41-R45 PolarHBondContact OD1-NH1 3.3Å; E42-R45 PolarHBondContact O-N 2.75Å; R45-M48 HydrophobicContact CG-CE 4.33Å; R45-R49 WeakPolarHBondContact O-CG 3.34Å; R45-R49 PolarHBondContact O-N 3.05Å; R45-R49 PolarHBondContact O-NE 3.29Å
46L96.3Very high94.7Very high37 Ų3780.3 Ų80.319%0.19438%0.377CS..Hα-helixtrans-72.6-40.1177.7-80.2158.9000111.5I29 L38 E42 I43 L44 M48 R49 Y50I29-L46 HydrophobicContact CD1-CB 4.1Å; I29-L46 HydrophobicContact CG2-CB 3.64Å; I29-L46 HydrophobicContact CG2-CD1 4.15Å; I29-L46 HydrophobicContact CG2-CD2 4.49Å; I29-L46 HydrophobicContact CG2-CG 4.3Å; L38-L46 HydrophobicContact CD1-CD1 3.56Å; L38-L46 HydrophobicContact CD2-CD1 4.07Å; L38-L46 HydrophobicContact CG-CD1 4.47Å; E42-L46 HydrophobicContact CB-CD1 4.45Å; E42-L46 VanDerWaalsContact O-CB 3.29Å; E42-L46 WeakPolarHBondContact O-CB 3.38Å; E42-L46 WeakPolarHBondContact O-CG 3.48Å; E42-L46 PolarHBondContact O-N 3.21Å; I43-L46 PolarHBondContact O-N 3.19Å; L44-L46 PolarHBondContact O-N 2.87Å; L46-M48 PolarHBondContact O-N 2.78Å; L46-R49 VanDerWaalsContact CD2-NH2 3.28Å; L46-R49 PolarHBondContact O-N 3.38Å; L46-Y50 WeakPolarHBondContact O-CB 3.45Å; L46-Y50 PolarHBondContact O-N 3.23Å
47A97.4Very high94.4Very high14 Ų1479.5 Ų79.512%0.11638%0.376CS..Hα-helixtrans-57.6-47.7174.700000111.6L25 I29 I43 L44 R49 Y50 I51L25-A47 HydrophobicContact CD1-CB 4.06Å; L25-A47 HydrophobicContact CD2-CB 4.26Å; L25-A47 HydrophobicContact CG-CB 4.43Å; I29-A47 HydrophobicContact CD1-CB 4.28Å; I43-A47 VanDerWaalsContact O-CB 3.3Å; I43-A47 WeakPolarHBondContact O-CB 3.32Å; I43-A47 PolarHBondContact O-N 3.41Å; L44-A47 PolarHBondContact O-N 2.97Å; A47-R49 PolarHBondContact O-N 3.04Å; A47-Y50 PolarHBondContact O-N 3.21Å; A47-I51 WeakPolarHBondContact O-CG1 3.2Å; A47-I51 PolarHBondContact O-N 3.47Å
48M93.7Very high94Very high88 Ų8875.8 Ų75.843%0.43337%0.365SS..Hα-helixtrans-59.4-45.2176-71-176.1-71.900112.3L44 R45 L46 Y50 N52 L77L44-M48 WeakPolarHBondContact O-CE 3.46Å; L44-M48 WeakPolarHBondContact O-CG 3.33Å; L44-M48 PolarHBondContact O-N 2.93Å; L44-M48 VanDerWaalsContact O-N 3.12Å; R45-M48 HydrophobicContact CG-CE 4.33Å; L46-M48 PolarHBondContact O-N 2.78Å; M48-Y50 VanDerWaalsContact C-N 3.33Å; M48-Y50 PolarHBondContact O-N 3.1Å; M48-N52 PolarHBondContact O-N 3.22Å; M48-L77 HydrophobicContact CG-CD1 4.48Å; M48-L77 HydrophobicContact SD-CD1 4.35Å
49R93.2Very high93.5Very high156 Ų15678.6 Ų78.659%0.58938%0.378SS*.Hα-helixtrans-64.1-37.9177.2-77.1-173.5-73.5165.6-7112.5R45 L46 A47 N52 F53R45-R49 WeakPolarHBondContact O-CG 3.34Å; R45-R49 PolarHBondContact O-N 3.05Å; R45-R49 PolarHBondContact O-NE 3.29Å; L46-R49 VanDerWaalsContact CD2-NH2 3.28Å; L46-R49 PolarHBondContact O-N 3.38Å; A47-R49 PolarHBondContact O-N 3.04Å; R49-N52 WeakPolarHBondContact O-CB 3.19Å; R49-N52 PolarHBondContact O-N 3.38Å; R49-F53 WeakPolarHBondContact O-CB 2.95Å; R49-F53 PolarHBondContact O-N 3.28Å
50Y96.3Very high92.7Very high81 Ų8179.1 Ų79.132%0.31838%0.381SS..Hα-helixtrans-72.4-42.8-177.9-173.5-130.6000111.9L28 P30 L46 A47 M48 N52 F53 L54L28-Y50 WeakPolarHBondContact O-CE1 3.16Å; P30-Y50 HydrophobicContact CG-CD1 4.35Å; P30-Y50 HydrophobicContact CG-CD2 3.87Å; P30-Y50 HydrophobicContact CG-CE1 3.98Å; P30-Y50 HydrophobicContact CG-CE2 3.48Å; P30-Y50 VanDerWaalsContact CG-CE2 3.48Å; P30-Y50 HydrophobicContact CG-CG 4.3Å; L46-Y50 WeakPolarHBondContact O-CB 3.45Å; L46-Y50 PolarHBondContact O-N 3.23Å; A47-Y50 PolarHBondContact O-N 3.21Å; M48-Y50 VanDerWaalsContact C-N 3.33Å; M48-Y50 PolarHBondContact O-N 3.1Å; Y50-N52 VanDerWaalsContact C-N 3.26Å; Y50-N52 PolarHBondContact O-N 2.89Å; Y50-F53 HydrophobicContact CD2-CD1 4.15Å; Y50-F53 HydrophobicContact CE2-CD1 4.08Å; Y50-F53 WeakPolarHBondContact O-CB 3.38Å; Y50-F53 PolarHBondContact O-N 3.47Å; Y50-L54 HydrophobicContact CD1-CD1 4.22Å; Y50-L54 HydrophobicContact CD2-CG 4.34Å; Y50-L54 HydrophobicContact CE1-CD1 3.83Å; Y50-L54 HydrophobicContact CE1-CG 4.46Å; Y50-L54 HydrophobicContact CE2-CD1 4.25Å; Y50-L54 HydrophobicContact CE2-CD2 3.94Å; Y50-L54 HydrophobicContact CE2-CG 3.99Å; Y50-L54 WeakPolarHBondContact O-CG 3.48Å; Y50-L54 PolarHBondContact O-N 3.09Å
51I94.9Very high92.1Very high89 Ų8980.9 Ų80.946%0.45639%0.391SS..Hα-helixtrans-54.3-46.8172-68.2165.6000110.1A47 L54 V55A47-I51 WeakPolarHBondContact O-CG1 3.2Å; A47-I51 PolarHBondContact O-N 3.47Å; I51-L54 PolarHBondContact O-N 3.07Å; I51-V55 WeakPolarHBondContact O-CG2 3.41Å; I51-V55 PolarHBondContact O-N 3Å
52N87.1Confident91.2Very high38 Ų3880.6 Ų80.620%0.20340%0.395CS..Hα-helixtrans-61.3-45.9177.5-178.852.6000113.6M48 R49 Y50 L54 V55 Q56 L73M48-N52 PolarHBondContact O-N 3.22Å; R49-N52 WeakPolarHBondContact O-CB 3.19Å; R49-N52 PolarHBondContact O-N 3.38Å; Y50-N52 VanDerWaalsContact C-N 3.26Å; Y50-N52 PolarHBondContact O-N 2.89Å; N52-L54 PolarHBondContact O-N 3.01Å; N52-V55 PolarHBondContact O-N 3.28Å; N52-Q56 VanDerWaalsContact CG-NE2 3.34Å; N52-Q56 PolarHBondContact ND2-NE2 3.46Å; N52-Q56 WeakPolarHBondContact O-CG 3.37Å; N52-Q56 PolarHBondContact O-N 3.01Å; N52-Q56 PolarHBondContact OD1-NE2 3.12Å; N52-L73 HydrophobicContact CB-CD1 3.32Å; N52-L73 HydrophobicContact CB-CD2 3.61Å; N52-L73 HydrophobicContact CB-CG 3.84Å; N52-L73 VanDerWaalsContact OD1-CD2 3.27Å; N52-L73 WeakPolarHBondContact OD1-CD2 3.46Å; N52-L73 WeakPolarHBondContact OD1-CG 3.2Å
53F91.6Very high89.7Confident112 Ų11280.2 Ų80.249%0.49141%0.411SS..Hα-helixtrans-56.2-43.9177.2171.5-98.8000110.9R49 Y50 Q56 L57R49-F53 WeakPolarHBondContact O-CB 2.95Å; R49-F53 PolarHBondContact O-N 3.28Å; Y50-F53 HydrophobicContact CD2-CD1 4.15Å; Y50-F53 HydrophobicContact CE2-CD1 4.08Å; Y50-F53 WeakPolarHBondContact O-CB 3.38Å; Y50-F53 PolarHBondContact O-N 3.47Å; F53-Q56 PolarHBondContact O-N 3.25Å; F53-L57 HydrophobicContact CE1-CD2 4.3Å; F53-L57 VanDerWaalsContact O-CB 3.28Å; F53-L57 WeakPolarHBondContact O-CB 3.46Å; F53-L57 PolarHBondContact O-N 3.15Å
54L92.8Very high88Confident65 Ų6585.9 Ų85.934%0.3444%0.437SS..Hα-helixtrans-66.2-41.9177.6-65176.9000112.6Y50 I51 N52 L57 L58Y50-L54 HydrophobicContact CD1-CD1 4.22Å; Y50-L54 HydrophobicContact CD2-CG 4.34Å; Y50-L54 HydrophobicContact CE1-CD1 3.83Å; Y50-L54 HydrophobicContact CE1-CG 4.46Å; Y50-L54 HydrophobicContact CE2-CD1 4.25Å; Y50-L54 HydrophobicContact CE2-CD2 3.94Å; Y50-L54 HydrophobicContact CE2-CG 3.99Å; Y50-L54 WeakPolarHBondContact O-CG 3.48Å; Y50-L54 PolarHBondContact O-N 3.09Å; I51-L54 PolarHBondContact O-N 3.07Å; N52-L54 PolarHBondContact O-N 3.01Å; L54-L57 PolarHBondContact O-N 3.31Å; L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 3.44Å
55V88.4Confident86.1Confident54 Ų5487.5 Ų87.533%0.32745%0.453SS..Hα-helixtrans-59-49.3175.6170.40000110.7I51 N52 L57 L58 E59I51-V55 WeakPolarHBondContact O-CG2 3.41Å; I51-V55 PolarHBondContact O-N 3Å; N52-V55 PolarHBondContact O-N 3.28Å; V55-L57 VanDerWaalsContact C-N 3.32Å; V55-L57 PolarHBondContact O-N 2.97Å; V55-L58 PolarHBondContact O-N 3.41Å; V55-L58 VanDerWaalsContact O-N 3.15Å; V55-E59 HydrophobicContact CG1-CG 4.46Å; V55-E59 WeakPolarHBondContact CG1-OE1 3.45Å; V55-E59 WeakPolarHBondContact O-CG 3.22Å; V55-E59 PolarHBondContact O-N 2.9Å
56Q84.6Confident84.3Confident83 Ų8383.1 Ų83.139%0.38844%0.442SS..Hα-helixtrans-63.5-38.4178.7-67.7-179.614.800112.4N52 F53 L58 E59 S60N52-Q56 VanDerWaalsContact CG-NE2 3.34Å; N52-Q56 PolarHBondContact ND2-NE2 3.46Å; N52-Q56 WeakPolarHBondContact O-CG 3.37Å; N52-Q56 PolarHBondContact O-N 3.01Å; N52-Q56 PolarHBondContact OD1-NE2 3.12Å; F53-Q56 PolarHBondContact O-N 3.25Å; Q56-L58 VanDerWaalsContact C-N 3.27Å; Q56-L58 PolarHBondContact O-N 3.45Å; Q56-E59 PolarHBondContact O-N 3.5Å; Q56-S60 WeakPolarHBondContact O-CB 3.48Å; Q56-S60 PolarHBondContact O-N 2.81Å; Q56-S60 PolarHBondContact O-OG 3.33Å
57L89.8Confident82.5Confident76 Ų7686.4 Ų86.440%0.39847%0.468SS..Hα-helixtrans-62.4-36.8176.3-178.165.2000111.4F53 L54 V55 S60 Q61F53-L57 HydrophobicContact CE1-CD2 4.3Å; F53-L57 VanDerWaalsContact O-CB 3.28Å; F53-L57 WeakPolarHBondContact O-CB 3.46Å; F53-L57 PolarHBondContact O-N 3.15Å; L54-L57 PolarHBondContact O-N 3.31Å; V55-L57 VanDerWaalsContact C-N 3.32Å; V55-L57 PolarHBondContact O-N 2.97Å; L57-S60 PolarHBondContact O-OG 3.4Å; L57-Q61 VanDerWaalsContact O-CG 3.31Å; L57-Q61 WeakPolarHBondContact O-CG 3.27Å; L57-Q61 PolarHBondContact O-N 3.11Å; L57-Q61 PolarHBondContact O-NE2 3.44Å
58L88.6Confident80.6Confident118 Ų11893.4 Ų93.462%0.61850%0.498SS*.Hα-helixtrans-74.4-42.4176.5-67.6171.8000112.2L54 V55 Q56 Q61 S62L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 3.44Å; V55-L58 PolarHBondContact O-N 3.41Å; V55-L58 VanDerWaalsContact O-N 3.15Å; Q56-L58 VanDerWaalsContact C-N 3.27Å; Q56-L58 PolarHBondContact O-N 3.45Å; L58-Q61 PolarHBondContact O-N 3.4Å; L58-S62 PolarHBondContact O-N 3.22Å
59E84.9Confident79.1Confident85 Ų8591.6 Ų91.640%0.39749%0.494SS..Hα-helixtrans-62.3-44.7178.3-72.4172.6173.500111.9V55 Q56 Q61 S62V55-E59 HydrophobicContact CG1-CG 4.46Å; V55-E59 WeakPolarHBondContact CG1-OE1 3.45Å; V55-E59 WeakPolarHBondContact O-CG 3.22Å; V55-E59 PolarHBondContact O-N 2.9Å; Q56-E59 PolarHBondContact O-N 3.5Å; E59-Q61 VanDerWaalsContact C-N 3.27Å; E59-Q61 PolarHBondContact O-N 2.93Å; E59-S62 PolarHBondContact O-N 3.23Å; E59-S62 PolarHBondContact O-OG 3.06Å
60S82.1Confident77.4Confident68 Ų6889.9 Ų89.948%0.47650%0.503SS..Hα-helixtrans-61.6-33.5177.656.90000113.1Q56 L57 S62Q56-S60 WeakPolarHBondContact O-CB 3.48Å; Q56-S60 PolarHBondContact O-N 2.81Å; Q56-S60 PolarHBondContact O-OG 3.33Å; L57-S60 PolarHBondContact O-OG 3.4Å; S60-S62 VanDerWaalsContact C-N 3.32Å
61Q85.3Confident75.8Confident141 Ų14189.7 Ų89.766%0.65951%0.511SS*.Hα-helixtrans-72.3-25.1174.5-72.7176.693.100112.9L57 L58 E59 G63L57-Q61 VanDerWaalsContact O-CG 3.31Å; L57-Q61 WeakPolarHBondContact O-CG 3.27Å; L57-Q61 PolarHBondContact O-N 3.11Å; L57-Q61 PolarHBondContact O-NE2 3.44Å; L58-Q61 PolarHBondContact O-N 3.4Å; E59-Q61 VanDerWaalsContact C-N 3.27Å; E59-Q61 PolarHBondContact O-N 2.93Å; Q61-G63 VanDerWaalsContact C-N 3.31Å; Q61-G63 PolarHBondContact O-N 3.42Å
62S77.8Confident74.4Confident71 Ų7187.9 Ų87.950%0.49751%0.509SS..THydrogen-bonded Turntrans-83.1-1.6-178.972.50000114.6L58 E59 S60 Q64L58-S62 PolarHBondContact O-N 3.22Å; E59-S62 PolarHBondContact O-N 3.23Å; E59-S62 PolarHBondContact O-OG 3.06Å; S60-S62 VanDerWaalsContact C-N 3.32Å; S62-Q64 PolarHBondContact O-N 3.21Å
63G66.8Low73.3Confident66 Ų6687.9 Ų87.968%0.6851%0.509SS*.THydrogen-bonded Turntrans69.810.3179.900000114.9Q61Q61-G63 VanDerWaalsContact C-N 3.31Å; Q61-G63 PolarHBondContact O-N 3.42Å
64Q63Low72.1Confident131 Ų13187.7 Ų87.761%0.61251%0.512SS*.  trans-79.3139.4175.5-66.9-68.3-68.600110.6S62 V66S62-Q64 PolarHBondContact O-N 3.21Å; Q64-V66 PolarHBondContact O-N 3.43Å
65P57.8Low71Confident118 Ų11888.5 Ų88.577%0.76652%0.52SS*.  trans-65.5122.8179.925.8-32.4000110.8S67P65-S67 PolarHBondContact O-N 3Å
66V59Low70.1Confident54 Ų5491.2 Ų91.233%0.32753%0.528SS..  trans-69111.7-175.2-1710000110Q64 H68Q64-V66 PolarHBondContact O-N 3.43Å; V66-H68 WeakPolarHBondContact CG1-CE1 3.35Å; V66-H68 WeakPolarHBondContact CG1-ND1 3.4Å; V66-H68 PolarHBondContact O-CD2 2.86Å; V66-H68 VanDerWaalsContact O-CD2 3.31Å; V66-H68 PolarHBondContact O-N 3.22Å
67S58.7Low69.4Low106 Ų10690.2 Ų90.274%0.74153%0.525SS*.  trans-79.588.5169-166.60000108.9P65 S69P65-S67 PolarHBondContact O-N 3Å; S67-S69 VanDerWaalsContact C-N 3.35Å; S67-S69 PolarHBondContact O-N 3.34Å
68H57.4Low68.5Low161 Ų16193.9 Ų93.975%0.74553%0.533SS*.  trans-66.988.2178.9-60.7-76.5000110.8V66V66-H68 WeakPolarHBondContact CG1-CE1 3.35Å; V66-H68 WeakPolarHBondContact CG1-ND1 3.4Å; V66-H68 PolarHBondContact O-CD2 2.86Å; V66-H68 VanDerWaalsContact O-CD2 3.31Å; V66-H68 PolarHBondContact O-N 3.22Å
69S60.9Low67.7Low50 Ų5089.8 Ų89.835%0.3552%0.52SS..  trans-129.8120.5168.3-171.20000110.3S67 T71 A72S67-S69 VanDerWaalsContact C-N 3.35Å; S67-S69 PolarHBondContact O-N 3.34Å; S69-T71 PolarHBondContact O-N 3.33Å; S69-T71 VanDerWaalsContact OG-CB 3.22Å; S69-T71 WeakPolarHBondContact OG-CB 3.29Å; S69-T71 PolarHBondContact OG-N 3.34Å; S69-T71 PolarHBondContact OG-OG1 3.23Å; S69-A72 WeakPolarHBondContact O-CB 3.45Å; S69-A72 PolarHBondContact O-N 2.92Å
70P57.8Low66.8Low120 Ų12089 Ų8978%0.77952%0.518SS*.THydrogen-bonded Turntrans-53.6-23.5165.9-22.432.1000112.3A72P70-A72 VanDerWaalsContact C-N 3.33Å
71T62.4Low66.2Low78 Ų7889.3 Ų89.348%0.47952%0.517SS..Hα-helixtrans-73.2-22.9175.3-39.30000112.3S69 L73 L74 T75S69-T71 PolarHBondContact O-N 3.33Å; S69-T71 VanDerWaalsContact OG-CB 3.22Å; S69-T71 WeakPolarHBondContact OG-CB 3.29Å; S69-T71 PolarHBondContact OG-N 3.34Å; S69-T71 PolarHBondContact OG-OG1 3.23Å; T71-L73 VanDerWaalsContact C-N 3.25Å; T71-L73 PolarHBondContact O-N 3.4Å; T71-L74 PolarHBondContact O-N 2.92Å; T71-T75 WeakPolarHBondContact O-CB 3.42Å; T71-T75 PolarHBondContact O-N 3.44Å; T71-T75 PolarHBondContact O-OG1 3.17Å
72A66.1Low65.4Low50 Ų5088.1 Ų88.141%0.41351%0.511SS..Hα-helixtrans-57.7-38.1-177.500000112.2S69 P70 F76S69-A72 WeakPolarHBondContact O-CB 3.45Å; S69-A72 PolarHBondContact O-N 2.92Å; P70-A72 VanDerWaalsContact C-N 3.33Å; A72-F76 WeakPolarHBondContact O-CB 3.45Å; A72-F76 PolarHBondContact O-N 3.25Å
73L63.8Low64.6Low38 Ų3893.2 Ų93.220%0.19952%0.52CS..Hα-helixtrans-70.5-43173.4-72.6-177.4000113.6N52 T71 T75 F76 L77N52-L73 HydrophobicContact CB-CD1 3.32Å; N52-L73 HydrophobicContact CB-CD2 3.61Å; N52-L73 HydrophobicContact CB-CG 3.84Å; N52-L73 VanDerWaalsContact OD1-CD2 3.27Å; N52-L73 WeakPolarHBondContact OD1-CD2 3.46Å; N52-L73 WeakPolarHBondContact OD1-CG 3.2Å; T71-L73 VanDerWaalsContact C-N 3.25Å; T71-L73 PolarHBondContact O-N 3.4Å; L73-T75 PolarHBondContact O-N 2.82Å; L73-F76 PolarHBondContact O-N 3.23Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.69Å
74L66.3Low64Low108 Ų10896 Ų9657%0.56552%0.518SS*.Hα-helixtrans-64.4-35.5177.2-70.7-179.5000110.3T71 R78T71-L74 PolarHBondContact O-N 2.92Å; L74-R78 WeakPolarHBondContact O-CA 3.36Å; L74-R78 WeakPolarHBondContact O-CB 3.48Å; L74-R78 PolarHBondContact O-N 3.2Å
75T70Confident63.5Low82 Ų8296.1 Ų96.150%0.50352%0.519SS..Hα-helixtrans-70-41.6173.5-57.50000111.5T71 L73 G79T71-T75 WeakPolarHBondContact O-CB 3.42Å; T71-T75 PolarHBondContact O-N 3.44Å; T71-T75 PolarHBondContact O-OG1 3.17Å; L73-T75 PolarHBondContact O-N 2.82Å; T75-G79 WeakPolarHBondContact O-CA 3.26Å; T75-G79 PolarHBondContact O-N 2.75Å
76F68.5Low63.1Low112 Ų11295.4 Ų95.449%0.49152%0.517SS..Hα-helixtrans-68.4-48.7177.8179.4-96.6000111.6A72 L73 G79 N80A72-F76 WeakPolarHBondContact O-CB 3.45Å; A72-F76 PolarHBondContact O-N 3.25Å; L73-F76 PolarHBondContact O-N 3.23Å; F76-G79 PolarHBondContact O-N 2.8Å; F76-N80 WeakPolarHBondContact O-CB 3.47Å; F76-N80 PolarHBondContact O-N 3.45Å
77L69.8Low62.6Low61 Ų6197.1 Ų97.132%0.31953%0.531SS..Hα-helixtrans-65-41.9176.4-66175.5000110.9M48 L73 N80 V81M48-L77 HydrophobicContact CG-CD1 4.48Å; M48-L77 HydrophobicContact SD-CD1 4.35Å; L73-L77 WeakPolarHBondContact O-CB 3.49Å; L73-L77 WeakPolarHBondContact O-CG 3.41Å; L73-L77 PolarHBondContact O-N 2.69Å; L77-N80 PolarHBondContact O-N 3Å; L77-V81 WeakPolarHBondContact O-CG2 3.25Å; L77-V81 PolarHBondContact O-N 3.5Å
78R72.6Confident62.3Low153 Ų15396.5 Ų96.558%0.57753%0.526SS*.Hα-helixtrans-62.1-46.8172-178.1140.481.9-108.311.9111L74 N80 V81 E82L74-R78 WeakPolarHBondContact O-CA 3.36Å; L74-R78 WeakPolarHBondContact O-CB 3.48Å; L74-R78 PolarHBondContact O-N 3.2Å; R78-N80 VanDerWaalsContact C-N 3.29Å; R78-N80 PolarHBondContact O-N 3.38Å; R78-V81 PolarHBondContact O-N 2.99Å; R78-V81 VanDerWaalsContact O-N 3.1Å; R78-E82 HydrophobicContact CG-CG 4.24Å; R78-E82 WeakPolarHBondContact O-CG 3.39Å; R78-E82 PolarHBondContact O-N 3.27Å
79G70.3Confident62Low33 Ų3397.4 Ų97.434%0.3453%0.531SS..Hα-helixtrans-58.4-3917600000112.9T75 F76 R83T75-G79 WeakPolarHBondContact O-CA 3.26Å; T75-G79 PolarHBondContact O-N 2.75Å; F76-G79 PolarHBondContact O-N 2.8Å; G79-R83 WeakPolarHBondContact O-CB 3.45Å; G79-R83 PolarHBondContact O-N 2.82Å
80N66Low61.4Low67 Ų67100.9 Ų100.936%0.35855%0.55SS.*Hα-helixtrans-67.2-40.6173.7-106.217.1000112.3F76 L77 R78 R83 L84F76-N80 WeakPolarHBondContact O-CB 3.47Å; F76-N80 PolarHBondContact O-N 3.45Å; L77-N80 PolarHBondContact O-N 3Å; R78-N80 VanDerWaalsContact C-N 3.29Å; R78-N80 PolarHBondContact O-N 3.38Å; N80-R83 PolarHBondContact O-N 3.31Å; N80-L84 WeakPolarHBondContact O-CG 3.4Å; N80-L84 PolarHBondContact O-N 3.09Å; N80-L84 VanDerWaalsContact O-N 3.14Å
81V70.9Confident60.9Low75 Ų75107.2 Ų107.246%0.45556%0.559SS.*Hα-helixtrans-62.6-46.6174.9167.70000111L77 R78 R83 L84 H85L77-V81 WeakPolarHBondContact O-CG2 3.25Å; L77-V81 PolarHBondContact O-N 3.5Å; R78-V81 PolarHBondContact O-N 2.99Å; R78-V81 VanDerWaalsContact O-N 3.1Å; V81-R83 VanDerWaalsContact C-N 3.32Å; V81-R83 PolarHBondContact O-N 3.41Å; V81-L84 PolarHBondContact O-N 2.96Å; V81-H85 PolarHBondContact O-CD2 2.83Å; V81-H85 VanDerWaalsContact O-CD2 3.22Å; V81-H85 PolarHBondContact O-N 2.9Å; V81-H85 VanDerWaalsContact O-N 3.16Å
82E67.8Low60.2Low116 Ų116106.4 Ų106.454%0.54257%0.566SS.*Hα-helixtrans-61.6-38.8176.8-66.1-59.5150.100111.9R78 L84 H85 S86R78-E82 HydrophobicContact CG-CG 4.24Å; R78-E82 WeakPolarHBondContact O-CG 3.39Å; R78-E82 PolarHBondContact O-N 3.27Å; E82-L84 VanDerWaalsContact C-N 3.34Å; E82-L84 PolarHBondContact O-N 3.35Å; E82-H85 PolarHBondContact O-N 3.27Å; E82-S86 PolarHBondContact O-N 2.76Å
83R60.2Low59.2Low179 Ų179111.8 Ų111.868%0.67559%0.587SS**Hα-helixtrans-65.7-35.1177.8-167.9177.9-69.4167.2-2.8112.6G79 N80 V81 S87G79-R83 WeakPolarHBondContact O-CB 3.45Å; G79-R83 PolarHBondContact O-N 2.82Å; N80-R83 PolarHBondContact O-N 3.31Å; V81-R83 VanDerWaalsContact C-N 3.32Å; V81-R83 PolarHBondContact O-N 3.41Å; R83-S87 WeakPolarHBondContact O-CB 3.33Å; R83-S87 PolarHBondContact O-N 3.41Å; R83-S87 VanDerWaalsContact O-N 3.12Å
84L55Low58Low123 Ų123114.9 Ų114.964%0.64462%0.618SS**Hα-helixtrans-67.8-36.6173.1-69.4172.7000112N80 V81 E82 S87 S88N80-L84 WeakPolarHBondContact O-CG 3.4Å; N80-L84 PolarHBondContact O-N 3.09Å; N80-L84 VanDerWaalsContact O-N 3.14Å; V81-L84 PolarHBondContact O-N 2.96Å; E82-L84 VanDerWaalsContact C-N 3.34Å; E82-L84 PolarHBondContact O-N 3.35Å; L84-S87 PolarHBondContact O-N 3.06Å; L84-S88 PolarHBondContact O-OG 3.43Å
85H53.3Low56.8Low134 Ų134113.9 Ų113.962%0.6262%0.62SS**Hα-helixtrans-71.6-37.5176.6-77.6-129.4000111.9V81 E82 S87 S88V81-H85 PolarHBondContact O-CD2 2.83Å; V81-H85 VanDerWaalsContact O-CD2 3.22Å; V81-H85 PolarHBondContact O-N 2.9Å; V81-H85 VanDerWaalsContact O-N 3.16Å; E82-H85 PolarHBondContact O-N 3.27Å; H85-S87 VanDerWaalsContact C-N 3.27Å; H85-S87 PolarHBondContact O-N 3.28Å; H85-S88 WeakPolarHBondContact O-CB 3.39Å; H85-S88 PolarHBondContact O-N 2.99Å
86S49.1Very low55.5Low104 Ų104118.2 Ų118.273%0.72764%0.64SS**Hα-helixtrans-66.5-27.7173.3-178.40000112.9E82 S88E82-S86 PolarHBondContact O-N 2.76Å; S86-S88 PolarHBondContact O-N 3.42Å
87S48.8Very low54.8Low90 Ų90118.1 Ų118.163%0.62965%0.649SS**THydrogen-bonded Turntrans-74.62.2174.7179.40000114.2R83 L84 H85 Q89R83-S87 WeakPolarHBondContact O-CB 3.33Å; R83-S87 PolarHBondContact O-N 3.41Å; R83-S87 VanDerWaalsContact O-N 3.12Å; L84-S87 PolarHBondContact O-N 3.06Å; H85-S87 VanDerWaalsContact C-N 3.27Å; H85-S87 PolarHBondContact O-N 3.28Å; S87-Q89 PolarHBondContact O-N 3.02Å
88S52.1Low53.5Low92 Ų92121.9 Ų121.964%0.64367%0.669SS**THydrogen-bonded Turntrans-89.111.5-173.5-63.80000115.6L84 H85 S86L84-S88 PolarHBondContact O-OG 3.43Å; H85-S88 WeakPolarHBondContact O-CB 3.39Å; H85-S88 PolarHBondContact O-N 2.99Å; S86-S88 PolarHBondContact O-N 3.42Å
89Q50.4Low52.3Low181 Ų181119.5 Ų119.585%0.84668%0.682SS**  trans-120.368.4179.5-154.517224.400113.6S87S87-Q89 PolarHBondContact O-N 3.02Å
90T48.4Very low51Low122 Ų122125.5 Ų125.575%0.74871%0.706SS**SBendtrans-140.6-2.3156.773.20000115.2G92T90-G92 PolarHBondContact O-N 3.49Å; T90-G92 VanDerWaalsContact O-N 3.12Å
91W46.9Very low50.4Low254 Ų254128 Ų12896%0.96273%0.728SS**SBendtrans-86.637.8178.4-69.186.3000113.8
92G48.6Very low49.4Very low60 Ų60130.3 Ų130.362%0.61975%0.745SS**SBendtrans-163.675.3-179.300000112.2T90T90-G92 PolarHBondContact O-N 3.49Å; T90-G92 VanDerWaalsContact O-N 3.12Å
93L43.8Very low48.2Very low163 Ų163128 Ų12885%0.85375%0.753SS**  trans-177.670.3145.6-122.979.5000108.7
94A39.8Very low47.4Very low103 Ų103125.6 Ų125.685%0.85176%0.763SS**SBendtrans-89.7106.314800000104.3D96A94-D96 PolarHBondContact O-N 3Å
95S41.5Very low46.9Very low87 Ų87123.9 Ų123.961%0.60876%0.761SS**  trans-47.1122.9-170.3-56.70000113.3T97S95-T97 PolarHBondContact O-N 3.41Å; S95-T97 PolarHBondContact O-OG1 3.21Å
96D41.8Very low46.8Very low173 Ų173122.8 Ų122.893%0.92577%0.768SS**  trans-53.9108.1148.9-73.9-49.1000107.1A94A94-D96 PolarHBondContact O-N 3Å
97T54.3Low46.3Very low110 Ų110124.8 Ų124.868%0.67577%0.77SS**  trans-120.5118.2166.6-2.80000107.4S95S95-T97 PolarHBondContact O-N 3.41Å; S95-T97 PolarHBondContact O-OG1 3.21Å
98D41.3Very low46.3Very low140 Ų140124.8 Ų124.875%0.74977%0.77SS**  trans81.376.5160.4-55-40.3000118.8L100D98-L100 PolarHBondContact O-N 2.99Å
99A47.8Very low46.2Very low103 Ų103127 Ų12785%0.85178%0.78SS**  trans-71.3108.4143.700000109.6
100L44.3Very low45.8Very low160 Ų160127.3 Ų127.384%0.83878%0.781SS**  trans-112.4101.2160.5-80.6167.2000108.6D98D98-L100 PolarHBondContact O-N 2.99Å
101S52Low45.5Very low118 Ų118125.2 Ų125.283%0.82578%0.776SS**  trans-82.2137.2163.5-64.60000109.6
102P49.9Very low45.3Very low124 Ų124128.7 Ų128.781%0.80579%0.789SS**  trans-127.8116.3141.428.6-12.7000111.1
103G42.7Very low45.2Very low69 Ų69132.1 Ų132.171%0.71180%0.798SS**  64126.4125.600000121.3
104S43.7Very low45.3Very low127 Ų127130.5 Ų130.589%0.88880%0.795SS**  trans72.5143.3133.9-164.30000116.6
105S44.7Very low45.6Very low87 Ų87132 Ų13261%0.60879%0.792SS**  cis177.1141.7-13.9164.80000102.4
106C51Low45.8Very low112 Ų112134.6 Ų134.676%0.75780%0.803SS**  trans52.1142.3165.465.30000117.8
107D38.4Very low46.1Very low145 Ų145132.3 Ų132.378%0.77580%0.795SS**  -167.1166.957.2-159.8-86000110.3
108S49.3Very low45.5Very low90 Ų90133.7 Ų133.763%0.62980%0.803SS**  trans-69.3151.2-175.6-59.40000112.3
109T48.9Very low45.8Very low138 Ų138133.3 Ų133.385%0.84781%0.807SS**  164.2141.9110.9350000111.9
110E43.3Very low45.7Very low189 Ų189135.6 Ų135.688%0.88380%0.804SS**  trans-32.7149.6155.8-94.6158.265.700114.2
111A41.3Very low45.8Very low78 Ų78133.6 Ų133.665%0.64580%0.801SS**  168.3136102.600000112.9
112W44.2Very low45.2Very low326 Ų326135 Ų135100%1.23580%0.799SS**  trans69.10165-49.986.3000119.9

Retrieved 112 of 112 residues in 549.8 ms (Link to these results)