A0A087X7T3_POEFO Loading...

Transmembrane protein 170A

AlphaFold DB , UniProt , Accession A0A087X7T3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 137 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
1M60.5Low70.1Confident210 Ų210135.5 Ų135.5100%1.03465%0.648SS**  0-490-83.5172.27500114N3 M4 Q5M1-N3 VanDerWaalsContact C-N 3.29Å; M1-N3 PolarHBondContact O-N 3.23Å; M1-M4 PolarHBondContact O-N 3.06Å; M1-M4 VanDerWaalsContact O-N 3.07Å; M1-Q5 PolarHBondContact O-N 3.33Å
2K67Low70.3Confident187 Ų187130 Ų13081%0.81362%0.624SS**Hα-helixtrans-51.8-39.2178.5-84.6176.7172.2178.40115M4 Q5 N6K2-M4 VanDerWaalsContact C-N 3.33Å; K2-M4 PolarHBondContact O-N 3.44Å; K2-Q5 PolarHBondContact O-N 3.38Å; K2-N6 PolarHBondContact O-N 3.05Å; K2-N6 VanDerWaalsContact O-N 3.11Å
3N65.7Low70.6Confident127 Ų127130.2 Ų130.268%0.67962%0.621SS**Hα-helixtrans-71.4-21179.9-67.11.9000114.9M1M1-N3 VanDerWaalsContact C-N 3.29Å; M1-N3 PolarHBondContact O-N 3.23Å
4M67.3Low70.1Confident148 Ų148122.9 Ų122.973%0.72959%0.593SS**Hα-helixtrans-84.7-39.1173.8-81.7-147.3-10200111.1M1 K2 N6 R7 Y8M1-M4 PolarHBondContact O-N 3.06Å; M1-M4 VanDerWaalsContact O-N 3.07Å; K2-M4 VanDerWaalsContact C-N 3.33Å; K2-M4 PolarHBondContact O-N 3.44Å; M4-N6 VanDerWaalsContact C-N 3.35Å; M4-N6 PolarHBondContact O-N 3.05Å; M4-R7 PolarHBondContact O-N 3.48Å; M4-Y8 PolarHBondContact O-N 3.38Å
5Q73.4Confident69.7Low147 Ų147120.3 Ų120.369%0.68758%0.578SS**Hα-helixtrans-60.1-45.1175.8-160.481.310.200111.5M1 K2 R7 Y8 S9M1-Q5 PolarHBondContact O-N 3.33Å; K2-Q5 PolarHBondContact O-N 3.38Å; Q5-R7 VanDerWaalsContact C-N 3.32Å; Q5-R7 PolarHBondContact O-N 3.14Å; Q5-Y8 WeakPolarHBondContact O-CB 3.42Å; Q5-Y8 PolarHBondContact O-N 3.1Å; Q5-Y8 VanDerWaalsContact O-N 3.17Å; Q5-S9 PolarHBondContact O-N 2.94Å; Q5-S9 PolarHBondContact O-OG 3.12Å
6N72.8Confident69.5Low100 Ų100120.3 Ų120.354%0.53558%0.577SS.*Hα-helixtrans-64.1-39-178.7-147.29.6000111.9K2 M4 Y8 S9 D10K2-N6 PolarHBondContact O-N 3.05Å; K2-N6 VanDerWaalsContact O-N 3.11Å; M4-N6 VanDerWaalsContact C-N 3.35Å; M4-N6 PolarHBondContact O-N 3.05Å; N6-Y8 VanDerWaalsContact C-N 3.31Å; N6-Y8 PolarHBondContact O-N 2.9Å; N6-S9 VanDerWaalsContact CA-OG 3.3Å; N6-S9 WeakPolarHBondContact CA-OG 3.4Å; N6-S9 PolarHBondContact O-N 3.18Å; N6-S9 PolarHBondContact O-OG 3.35Å; N6-D10 VanDerWaalsContact O-CG 3.29Å; N6-D10 PolarHBondContact O-N 2.87Å; N6-D10 VanDerWaalsContact O-OD2 3.13Å
7R70.4Confident69.4Low160 Ų160118.2 Ų118.260%0.60457%0.569SS**Hα-helixtrans-65.5-36.1176.3-145.2178.5-57-170.1-0.2111.9M4 Q5 I11M4-R7 PolarHBondContact O-N 3.48Å; Q5-R7 VanDerWaalsContact C-N 3.32Å; Q5-R7 PolarHBondContact O-N 3.14Å; R7-I11 WeakPolarHBondContact O-CB 3.42Å; R7-I11 VanDerWaalsContact O-CD1 3.31Å; R7-I11 WeakPolarHBondContact O-CD1 3.43Å; R7-I11 WeakPolarHBondContact O-CG1 3.43Å; R7-I11 PolarHBondContact O-N 3.31Å
8Y73.3Confident69Low168 Ų168113.4 Ų113.466%0.65955%0.545SS*.Hα-helixtrans-69-43.3176.3-161.5-92000111.2M4 Q5 N6 I11 D12M4-Y8 PolarHBondContact O-N 3.38Å; Q5-Y8 WeakPolarHBondContact O-CB 3.42Å; Q5-Y8 PolarHBondContact O-N 3.1Å; Q5-Y8 VanDerWaalsContact O-N 3.17Å; N6-Y8 VanDerWaalsContact C-N 3.31Å; N6-Y8 PolarHBondContact O-N 2.9Å; Y8-I11 PolarHBondContact O-N 3.13Å; Y8-D12 WeakPolarHBondContact O-CB 3.01Å; Y8-D12 PolarHBondContact O-N 2.85Å
9S75.8Confident68.4Low59 Ų59110.1 Ų110.141%0.41354%0.535SS..Hα-helixtrans-65.6-38.1176.446.50000113.4Q5 N6 D12 F13Q5-S9 PolarHBondContact O-N 2.94Å; Q5-S9 PolarHBondContact O-OG 3.12Å; N6-S9 VanDerWaalsContact CA-OG 3.3Å; N6-S9 WeakPolarHBondContact CA-OG 3.4Å; N6-S9 PolarHBondContact O-N 3.18Å; N6-S9 PolarHBondContact O-OG 3.35Å; S9-D12 PolarHBondContact O-N 2.86Å; S9-F13 WeakPolarHBondContact O-CB 3.26Å; S9-F13 PolarHBondContact O-N 3.31Å
10D74.6Confident67.7Low100 Ų100113.3 Ų113.354%0.53554%0.541SS..Hα-helixtrans-64.3-41.8175.6-72-36.5000111.5N6 D12 A14N6-D10 VanDerWaalsContact O-CG 3.29Å; N6-D10 PolarHBondContact O-N 2.87Å; N6-D10 VanDerWaalsContact O-OD2 3.13Å; D10-D12 VanDerWaalsContact C-N 3.34Å; D10-A14 WeakPolarHBondContact O-CB 3.45Å; D10-A14 PolarHBondContact O-N 3.42Å
11I70.4Confident67.1Low85 Ų85114.2 Ų114.244%0.43655%0.549SS..Hα-helixtrans-66.9-38.2176.6-67.4167.8000110.6R7 Y8 K15R7-I11 WeakPolarHBondContact O-CB 3.42Å; R7-I11 VanDerWaalsContact O-CD1 3.31Å; R7-I11 WeakPolarHBondContact O-CD1 3.43Å; R7-I11 WeakPolarHBondContact O-CG1 3.43Å; R7-I11 PolarHBondContact O-N 3.31Å; Y8-I11 PolarHBondContact O-N 3.13Å; I11-K15 HydrophobicContact CG2-CD 4.14Å; I11-K15 WeakPolarHBondContact O-CB 3.36Å; I11-K15 WeakPolarHBondContact O-CG 3.34Å; I11-K15 PolarHBondContact O-N 3.14Å
12D72.1Confident67.1Low69 Ų69108.4 Ų108.437%0.36952%0.522SS..Hα-helixtrans-72.1-38.3179.7-149.655000112.1Y8 S9 D10 K15 Q16Y8-D12 WeakPolarHBondContact O-CB 3.01Å; Y8-D12 PolarHBondContact O-N 2.85Å; S9-D12 PolarHBondContact O-N 2.86Å; D10-D12 VanDerWaalsContact C-N 3.34Å; D12-K15 PolarHBondContact O-N 3.26Å; D12-Q16 WeakPolarHBondContact O-CB 3.32Å; D12-Q16 PolarHBondContact O-N 3.45Å
13F74.2Confident67Low132 Ų132100.7 Ų100.758%0.57949%0.49SS*.Hα-helixtrans-63.9-45.3171.4177.7-101.8000111.7S9 Q16 L17S9-F13 WeakPolarHBondContact O-CB 3.26Å; S9-F13 PolarHBondContact O-N 3.31Å; F13-Q16 PolarHBondContact O-N 3.02Å; F13-L17 HydrophobicContact CE1-CD2 4.49Å; F13-L17 WeakPolarHBondContact O-CB 3.31Å; F13-L17 PolarHBondContact O-N 3.05Å
14A64.4Low66.8Low28 Ų2898.9 Ų98.923%0.23149%0.486CS..Hα-helixtrans-59.6-48.2174.800000110.7D10 Q16 L17 F18D10-A14 WeakPolarHBondContact O-CB 3.45Å; D10-A14 PolarHBondContact O-N 3.42Å; A14-Q16 VanDerWaalsContact C-N 3.31Å; A14-Q16 PolarHBondContact O-N 3.43Å; A14-L17 PolarHBondContact O-N 3.45Å; A14-F18 HydrophobicContact CB-CD2 4.22Å; A14-F18 HydrophobicContact CB-CE2 4.1Å; A14-F18 WeakPolarHBondContact O-CB 3.31Å; A14-F18 WeakPolarHBondContact O-CD2 3.21Å; A14-F18 WeakPolarHBondContact O-CG 3.23Å; A14-F18 PolarHBondContact O-N 2.9Å
15K63.9Low66.8Low85 Ų8594.2 Ų94.237%0.3746%0.46SS..Hα-helixtrans-58.6-42.5175.5-76.7173.1178.7-177.60112.2I11 D12 F18 S19I11-K15 HydrophobicContact CG2-CD 4.14Å; I11-K15 WeakPolarHBondContact O-CB 3.36Å; I11-K15 WeakPolarHBondContact O-CG 3.34Å; I11-K15 PolarHBondContact O-N 3.14Å; D12-K15 PolarHBondContact O-N 3.26Å; K15-F18 PolarHBondContact O-N 2.79Å; K15-S19 VanDerWaalsContact O-CB 3.25Å; K15-S19 WeakPolarHBondContact O-CB 3.3Å; K15-S19 PolarHBondContact O-N 3.39Å
16Q66.6Low66.4Low119 Ų11991.8 Ų91.856%0.55646%0.455SS*.Hα-helixtrans-60.8-51.8175.1-86.6-179.532.500110.5D12 F13 A14 F18 S19 W20D12-Q16 WeakPolarHBondContact O-CB 3.32Å; D12-Q16 PolarHBondContact O-N 3.45Å; F13-Q16 PolarHBondContact O-N 3.02Å; A14-Q16 VanDerWaalsContact C-N 3.31Å; A14-Q16 PolarHBondContact O-N 3.43Å; Q16-F18 VanDerWaalsContact C-N 3.34Å; Q16-F18 PolarHBondContact O-N 3.47Å; Q16-S19 WeakPolarHBondContact O-CB 3.1Å; Q16-S19 PolarHBondContact O-N 2.92Å; Q16-W20 PolarHBondContact O-NE1 2.89Å
17L66.7Low65.8Low86 Ų8691.6 Ų91.645%0.4545%0.454SS..Hα-helixtrans-58.6-40.5179.6-16771.4000112.6F13 A14 S19 W20F13-L17 HydrophobicContact CE1-CD2 4.49Å; F13-L17 WeakPolarHBondContact O-CB 3.31Å; F13-L17 PolarHBondContact O-N 3.05Å; A14-L17 PolarHBondContact O-N 3.45Å; L17-S19 VanDerWaalsContact C-N 3.33Å; L17-W20 WeakPolarHBondContact O-CB 3.18Å; L17-W20 VanDerWaalsContact O-CD1 3.31Å; L17-W20 PolarHBondContact O-N 3.38Å
18F62.4Low65.1Low32 Ų3293.4 Ų93.414%0.1446%0.461CS..Hα-helixtrans-79.2-13.3177.7-67.7-58.5000114A14 K15 Q16 W20 W46 F112 F115A14-F18 HydrophobicContact CB-CD2 4.22Å; A14-F18 HydrophobicContact CB-CE2 4.1Å; A14-F18 WeakPolarHBondContact O-CB 3.31Å; A14-F18 WeakPolarHBondContact O-CD2 3.21Å; A14-F18 WeakPolarHBondContact O-CG 3.23Å; A14-F18 PolarHBondContact O-N 2.9Å; K15-F18 PolarHBondContact O-N 2.79Å; Q16-F18 VanDerWaalsContact C-N 3.34Å; Q16-F18 PolarHBondContact O-N 3.47Å; F18-W20 VanDerWaalsContact C-N 3.32Å; F18-W46 AromaticContact CD1-CH2 3.92Å; F18-W46 HydrophobicContact CD1-CH2 3.92Å; F18-W46 AromaticContact CD1-CZ2 3.82Å; F18-W46 HydrophobicContact CD1-CZ2 3.82Å; F18-W46 HydrophobicContact CE1-CH2 4.2Å; F18-W46 HydrophobicContact CE1-CZ2 4.47Å; F18-F112 AromaticContact CD2-CD2 3.81Å; F18-F112 HydrophobicContact CD2-CD2 3.81Å; F18-F112 HydrophobicContact CD2-CE2 4.37Å; F18-F112 AromaticContact CE2-CD2 3.94Å; F18-F112 HydrophobicContact CE2-CD2 3.94Å; F18-F112 HydrophobicContact CE2-CE2 4.04Å; F18-F115 HydrophobicContact CD1-CB 4Å; F18-F115 HydrophobicContact CD1-CD1 4.27Å; F18-F115 AromaticContact CD1-CD2 3.82Å; F18-F115 HydrophobicContact CD1-CD2 3.82Å; F18-F115 HydrophobicContact CD1-CE2 4.35Å; F18-F115 AromaticContact CD1-CG 3.75Å; F18-F115 HydrophobicContact CD1-CG 3.75Å; F18-F115 HydrophobicContact CE1-CB 4.11Å; F18-F115 AromaticContact CE1-CD1 3.64Å; F18-F115 HydrophobicContact CE1-CD1 3.64Å; F18-F115 AromaticContact CE1-CD2 3.19Å; F18-F115 HydrophobicContact CE1-CD2 3.19Å; F18-F115 AromaticContact CE1-CE1 3.77Å; F18-F115 HydrophobicContact CE1-CE1 3.77Å; F18-F115 AromaticContact CE1-CE2 3.32Å; F18-F115 HydrophobicContact CE1-CE2 3.32Å; F18-F115 AromaticContact CE1-CG 3.34Å; F18-F115 HydrophobicContact CE1-CG 3.34Å; F18-F115 AromaticContact CE1-CZ 3.61Å; F18-F115 HydrophobicContact CE1-CZ 3.61Å; F18-F115 HydrophobicContact CE2-CD1 4.19Å; F18-F115 HydrophobicContact CE2-CE1 4.22Å; F18-F115 AromaticContact CZ-CD1 3.59Å; F18-F115 HydrophobicContact CZ-CD1 3.59Å; F18-F115 AromaticContact CZ-CD2 3.93Å; F18-F115 HydrophobicContact CZ-CD2 3.93Å; F18-F115 AromaticContact CZ-CE1 3.42Å; F18-F115 HydrophobicContact CZ-CE1 3.42Å; F18-F115 VanDerWaalsContact CZ-CE1 3.42Å; F18-F115 AromaticContact CZ-CE2 3.76Å; F18-F115 HydrophobicContact CZ-CE2 3.76Å; F18-F115 AromaticContact CZ-CG 3.84Å; F18-F115 HydrophobicContact CZ-CG 3.84Å; F18-F115 AromaticContact CZ-CZ 3.5Å; F18-F115 HydrophobicContact CZ-CZ 3.5Å
19S57.8Low64.5Low49 Ų4992.9 Ų92.934%0.34347%0.47SS..THydrogen-bonded Turntrans-82.3-7.6172-163.60000113K15 Q16 L17 N21K15-S19 VanDerWaalsContact O-CB 3.25Å; K15-S19 WeakPolarHBondContact O-CB 3.3Å; K15-S19 PolarHBondContact O-N 3.39Å; Q16-S19 WeakPolarHBondContact O-CB 3.1Å; Q16-S19 PolarHBondContact O-N 2.92Å; L17-S19 VanDerWaalsContact C-N 3.33Å; S19-N21 PolarHBondContact O-N 3.4Å
20W54.7Low64Low175 Ų17593.4 Ų93.466%0.66347%0.468SS*.SBendtrans-67.9107.8-179.9-7866.7000111.4Q16 L17 F18 L22Q16-W20 PolarHBondContact O-NE1 2.89Å; L17-W20 WeakPolarHBondContact O-CB 3.18Å; L17-W20 VanDerWaalsContact O-CD1 3.31Å; L17-W20 PolarHBondContact O-N 3.38Å; F18-W20 VanDerWaalsContact C-N 3.32Å; W20-L22 PolarHBondContact O-N 2.98Å
21N55.7Low63.7Low132 Ų13291.1 Ų91.171%0.70646%0.458SS*.SBendtrans31.51.1148.3-89.8-47000122.8S19S19-N21 PolarHBondContact O-N 3.4Å
22L60.8Low64.1Low88 Ų8891.2 Ų91.246%0.46146%0.455SS..SBendtrans-81.1-31.4-175.5-82.1153.3000111.9W20 L45 W46W20-L22 PolarHBondContact O-N 2.98Å; L22-L45 HydrophobicContact CB-CD2 3.78Å; L22-L45 HydrophobicContact CD2-CD2 4.04Å; L22-L45 HydrophobicContact CG-CD2 4.39Å; L22-L45 VanDerWaalsContact O-CD1 3.28Å; L22-L45 WeakPolarHBondContact O-CD1 3.49Å; L22-W46 HydrophobicContact CD1-CH2 3.98Å; L22-W46 HydrophobicContact CD1-CZ2 4.23Å
23V63.8Low64.4Low25 Ų2588 Ų8815%0.15244%0.438CS..SBendtrans-97.7124.1177.8-175.20000108.6R25 L33V23-R25 PolarHBondContact O-N 2.83Å; V23-R25 VanDerWaalsContact O-N 3.14Å; V23-L33 HydrophobicContact CG1-CD2 4.11Å
24P62Low64.7Low90 Ų9085.7 Ų85.758%0.58443%0.431SS*.  trans-56.9120.3172.1-19.430.4000108.8
25R66.4Low65.8Low49 Ų4988 Ų8819%0.18544%0.439CS..  trans-124.7133.7-175.2-167.7173.5-131.9148.814.7110.1V23 N27 D30 T31 F32 E38 S111V23-R25 PolarHBondContact O-N 2.83Å; V23-R25 VanDerWaalsContact O-N 3.14Å; R25-N27 WeakPolarHBondContact CD-O 3.1Å; R25-N27 WeakPolarHBondContact CG-O 3.37Å; R25-D30 PolarHBondContact NE-O 3.46Å; R25-D30 PolarHBondContact NH1-O 3.49Å; R25-D30 PolarHBondContact NH2-O 2.92Å; R25-D30 VanDerWaalsContact NH2-O 3.12Å; R25-T31 PolarHBondContact NH2-O 3.37Å; R25-T31 VanDerWaalsContact NH2-O 3.15Å; R25-F32 PolarHBondContact NE-O 3.32Å; R25-F32 VanDerWaalsContact NH2-N 3.12Å; R25-F32 PolarHBondContact NH2-O 3.04Å; R25-E38 WeakPolarHBondContact CA-OE1 3.42Å; R25-S111 PolarHBondContact NH1-OG 2.95Å; R25-S111 PolarHBondContact NH2-OG 2.98Å
26T65Low66.9Low97 Ų9788 Ų8860%0.59544%0.439SS*.SBendtrans-69.3-37179-152.70000111.6E38T26-E38 WeakPolarHBondContact CB-OE1 3.35Å; T26-E38 PolarHBondContact N-OE1 3.38Å
27N60.2Low67.9Low96 Ų9685.1 Ų85.151%0.51343%0.432SS..SBendtrans-129.9108.4175.2-86.9-60.5000112.2R25 N29 D30R25-N27 WeakPolarHBondContact CD-O 3.1Å; R25-N27 WeakPolarHBondContact CG-O 3.37Å; N27-N29 PolarHBondContact O-N 3.26Å; N27-N29 VanDerWaalsContact O-N 3.08Å; N27-D30 VanDerWaalsContact CB-OD2 3.25Å; N27-D30 WeakPolarHBondContact CB-OD2 3.2Å; N27-D30 PolarHBondContact O-N 2.85Å
28R56.9Low68.9Low197 Ų19781.7 Ų81.774%0.74341%0.414SS*.THydrogen-bonded Turntrans-60.7-18.5-173.3-78.2-173.8-172.7151.53.4116.1
29N60.1Low70.2Confident158 Ų15880.1 Ų80.185%0.84541%0.407SS*.THydrogen-bonded Turntrans-90.6-14.7-176.1-72.9-8000113.8N27N27-N29 PolarHBondContact O-N 3.26Å; N27-N29 VanDerWaalsContact O-N 3.08Å
30D64.5Low71.7Confident70 Ų7080.5 Ų80.537%0.37440%0.401SS..  trans-84.4140-177-60.4-30.1000109.2R25 N27R25-D30 PolarHBondContact NE-O 3.46Å; R25-D30 PolarHBondContact NH1-O 3.49Å; R25-D30 PolarHBondContact NH2-O 2.92Å; R25-D30 VanDerWaalsContact NH2-O 3.12Å; N27-D30 VanDerWaalsContact CB-OD2 3.25Å; N27-D30 WeakPolarHBondContact CB-OD2 3.2Å; N27-D30 PolarHBondContact O-N 2.85Å
31T69.5Low73.3Confident52 Ų5277 Ų7732%0.31939%0.389SS..SBendtrans-85.1-1.1175.1-8.30000112.5R25 S111R25-T31 PolarHBondContact NH2-O 3.37Å; R25-T31 VanDerWaalsContact NH2-O 3.15Å; T31-S111 PolarHBondContact O-N 3.39Å; T31-S111 PolarHBondContact O-OG 3Å
32F78Confident74.8Confident86 Ų8670.8 Ų70.838%0.37736%0.355SS..EExtended strand (participates in β ladder)trans-109.9153.5-173.2-61.2-85.4000111.9R25 M109 M110R25-F32 PolarHBondContact NE-O 3.32Å; R25-F32 VanDerWaalsContact NH2-N 3.12Å; R25-F32 PolarHBondContact NH2-O 3.04Å; F32-M109 CarbonylContact C-O 3.54Å; F32-M109 WeakPolarHBondContact CA-O 3.43Å; F32-M110 HydrophobicContact CD1-CB 4.28Å; F32-M110 HydrophobicContact CE1-CB 4.25Å; F32-M110 HydrophobicContact CE1-CE 3.77Å; F32-M110 HydrophobicContact CE1-CG 4.42Å; F32-M110 HydrophobicContact CZ-CE 3.85Å
33L79.6Confident76.2Confident1 Ų166.6 Ų66.61%0.00533%0.333CS..EExtended strand (participates in β ladder)trans-114.8123.6175.6-57.6169.4000105.9V23 E38 M39 M109 A114V23-L33 HydrophobicContact CG1-CD2 4.11Å; L33-E38 HydrophobicContact CB-CB 4.14Å; L33-E38 HydrophobicContact CD2-CB 4.06Å; L33-M39 HydrophobicContact CB-CG 3.79Å; L33-M109 HydrophobicContact CB-CE 4.48Å; L33-M109 HydrophobicContact CD1-CE 3.5Å; L33-M109 PolarHBondContact N-O 2.92Å; L33-M109 PolarHBondContact O-N 2.91Å; L33-A114 HydrophobicContact CD1-CB 4.09Å
34I80.1Confident77.5Confident85 Ų8567.7 Ų67.744%0.43634%0.336SS..  trans-111.7-39-167.9-55177.1000110.1E38 T108I34-E38 PolarHBondContact N-OE2 2.99Å; I34-E38 VanDerWaalsContact N-OE2 3.15Å; I34-T108 HydrophobicContact CG1-CG2 4.02Å; I34-T108 HydrophobicContact CG2-CG2 4.47Å
35D86.3Confident78.7Confident77 Ų7765.6 Ų65.641%0.41232%0.32SS..SBendtrans-81.2145.3179.5-72.2-36.2000111.4S37 E38 M39D35-S37 PolarHBondContact O-N 3.23Å; D35-E38 HydrophobicContact CB-CB 4.41Å; D35-E38 HydrophobicContact CB-CG 4.01Å; D35-E38 PolarHBondContact N-OE2 3.41Å; D35-E38 PolarHBondContact O-N 3.43Å; D35-E38 VanDerWaalsContact O-N 3.14Å; D35-M39 WeakPolarHBondContact O-CG 3.49Å; D35-M39 PolarHBondContact O-N 3.17Å
36F88.4Confident79.8Confident83 Ų8364.6 Ų64.636%0.36432%0.316SS..Hα-helixtrans-54.2-44177.3169.5-93.3000111.4E38 M39 W40 A96 A99F36-E38 PolarHBondContact O-N 2.87Å; F36-M39 PolarHBondContact O-N 3.39Å; F36-W40 HydrophobicContact CE1-CB 4.31Å; F36-W40 HydrophobicContact CZ-CB 4.37Å; F36-W40 VanDerWaalsContact O-CB 3.23Å; F36-W40 WeakPolarHBondContact O-CB 3.33Å; F36-W40 PolarHBondContact O-N 3.26Å; F36-A96 HydrophobicContact CZ-CB 4.29Å; F36-A99 HydrophobicContact CD2-CB 3.81Å; F36-A99 HydrophobicContact CE2-CB 3.71Å; F36-A99 HydrophobicContact CZ-CB 4.47Å
37S86.8Confident81Confident59 Ų5960.4 Ų60.441%0.41329%0.291SS..Hα-helixtrans-58.6-48.3178.2-172.80000111.3D35 M39 W40 Y41D35-S37 PolarHBondContact O-N 3.23Å; S37-M39 PolarHBondContact O-N 3.49Å; S37-W40 PolarHBondContact O-N 3.22Å; S37-Y41 WeakPolarHBondContact O-CB 3.39Å; S37-Y41 WeakPolarHBondContact O-CD2 3.48Å; S37-Y41 PolarHBondContact O-N 3.34Å; S37-Y41 VanDerWaalsContact OG-CD2 3.3Å; S37-Y41 WeakPolarHBondContact OG-CD2 3.37Å; S37-Y41 WeakPolarHBondContact OG-CE2 3.33Å
38E86.8Confident82.2Confident14 Ų1457.3 Ų57.37%0.06528%0.278CS..Hα-helixtrans-61.2-43.1178.6-65.7-177.214400112.1R25 T26 L33 I34 D35 F36 G42R25-E38 WeakPolarHBondContact CA-OE1 3.42Å; T26-E38 WeakPolarHBondContact CB-OE1 3.35Å; T26-E38 PolarHBondContact N-OE1 3.38Å; L33-E38 HydrophobicContact CB-CB 4.14Å; L33-E38 HydrophobicContact CD2-CB 4.06Å; I34-E38 PolarHBondContact N-OE2 2.99Å; I34-E38 VanDerWaalsContact N-OE2 3.15Å; D35-E38 HydrophobicContact CB-CB 4.41Å; D35-E38 HydrophobicContact CB-CG 4.01Å; D35-E38 PolarHBondContact N-OE2 3.41Å; D35-E38 PolarHBondContact O-N 3.43Å; D35-E38 VanDerWaalsContact O-N 3.14Å; F36-E38 PolarHBondContact O-N 2.87Å; E38-G42 PolarHBondContact O-N 3.31Å
39M90.6Very high83.6Confident0 Ų050.3 Ų50.30%026%0.257CS..Hα-helixtrans-66.1-46.3178.4-64.7-172.4-75.400111.8L33 D35 F36 S37 G42 V43 A99 Y102 K103 M109L33-M39 HydrophobicContact CB-CG 3.79Å; D35-M39 WeakPolarHBondContact O-CG 3.49Å; D35-M39 PolarHBondContact O-N 3.17Å; F36-M39 PolarHBondContact O-N 3.39Å; S37-M39 PolarHBondContact O-N 3.49Å; M39-G42 PolarHBondContact O-N 2.87Å; M39-V43 WeakPolarHBondContact O-CG2 3.32Å; M39-V43 PolarHBondContact O-N 2.84Å; M39-V43 VanDerWaalsContact O-N 3.08Å; M39-A99 HydrophobicContact CB-CB 3.75Å; M39-Y102 HydrophobicContact SD-CD1 4.43Å; M39-Y102 HydrophobicContact SD-CG 4.26Å; M39-K103 HydrophobicContact CE-CB 4.17Å; M39-K103 HydrophobicContact CE-CD 4.47Å; M39-M109 VanDerWaalsContact CA-CE 3.44Å; M39-M109 HydrophobicContact CB-CE 3.64Å; M39-M109 HydrophobicContact CB-SD 4.34Å; M39-M109 HydrophobicContact CG-CB 3.85Å; M39-M109 HydrophobicContact CG-CE 3.89Å; M39-M109 WeakPolarHBondContact O-CE 3.35Å; M39-M109 HydrophobicContact SD-CB 3.68Å
40W90.1Very high84.9Confident57 Ų5743.1 Ų43.122%0.21622%0.219CC..Hα-helixtrans-62.9-51.4-180173.145.4000111.7F36 S37 G42 V43 F44 V92 S95 A96 A99F36-W40 HydrophobicContact CE1-CB 4.31Å; F36-W40 HydrophobicContact CZ-CB 4.37Å; F36-W40 VanDerWaalsContact O-CB 3.23Å; F36-W40 WeakPolarHBondContact O-CB 3.33Å; F36-W40 PolarHBondContact O-N 3.26Å; S37-W40 PolarHBondContact O-N 3.22Å; W40-G42 VanDerWaalsContact C-N 3.3Å; W40-G42 PolarHBondContact O-N 2.9Å; W40-V43 PolarHBondContact O-N 3.43Å; W40-F44 VanDerWaalsContact O-CB 3.27Å; W40-F44 WeakPolarHBondContact O-CB 3.45Å; W40-F44 PolarHBondContact O-N 3.38Å; W40-V92 HydrophobicContact CZ2-CG1 3.86Å; W40-V92 PolarHBondContact NE1-O 2.83Å; W40-S95 VanDerWaalsContact CD1-C 3.44Å; W40-A96 HydrophobicContact CG-CB 4.4Å; W40-A99 HydrophobicContact CB-CB 3.81Å
41Y87.1Confident85.9Confident102 Ų10240.3 Ų40.340%0.421%0.205SC..Hα-helixtrans-62.1-38.7177.1-80.2-63.7000111.7S37 F44 L45S37-Y41 WeakPolarHBondContact O-CB 3.39Å; S37-Y41 WeakPolarHBondContact O-CD2 3.48Å; S37-Y41 PolarHBondContact O-N 3.34Å; S37-Y41 VanDerWaalsContact OG-CD2 3.3Å; S37-Y41 WeakPolarHBondContact OG-CD2 3.37Å; S37-Y41 WeakPolarHBondContact OG-CE2 3.33Å; Y41-F44 PolarHBondContact O-N 3.39Å; Y41-L45 WeakPolarHBondContact O-CB 3.49Å; Y41-L45 PolarHBondContact O-N 2.89Å
42G87.8Confident86.6Confident0 Ų042.3 Ų42.30%021%0.213CC..Hα-helixtrans-59-52.8177.300000112.7E38 M39 W40 W46E38-G42 PolarHBondContact O-N 3.31Å; M39-G42 PolarHBondContact O-N 2.87Å; W40-G42 VanDerWaalsContact C-N 3.3Å; W40-G42 PolarHBondContact O-N 2.9Å; G42-W46 PolarHBondContact O-N 3.37Å
43V90.2Very high86.9Confident0 Ų043.5 Ų43.50%022%0.222CC..Hα-helixtrans-65.2-43.2179.6179.20000111.1M39 W40 S47 S95 I98 M109 A114 F117 G118 Q121M39-V43 WeakPolarHBondContact O-CG2 3.32Å; M39-V43 PolarHBondContact O-N 2.84Å; M39-V43 VanDerWaalsContact O-N 3.08Å; W40-V43 PolarHBondContact O-N 3.43Å; V43-S47 WeakPolarHBondContact O-CB 3.17Å; V43-S47 PolarHBondContact O-N 3.32Å; V43-S95 WeakPolarHBondContact CG1-OG 3.44Å; V43-I98 HydrophobicContact CG1-CD1 4.01Å; V43-I98 HydrophobicContact CG2-CG2 4.25Å; V43-M109 HydrophobicContact CG2-CE 3.83Å; V43-M109 HydrophobicContact CG2-SD 3.77Å; V43-A114 HydrophobicContact CG2-CB 4.23Å; V43-F117 HydrophobicContact CG1-CB 3.93Å; V43-F117 HydrophobicContact CG2-CB 4.26Å; V43-G118 WeakPolarHBondContact O-CA 3.45Å; V43-Q121 VanDerWaalsContact CG1-NE2 3.29Å
44F90.1Very high87.1Confident49 Ų4947.4 Ų47.422%0.21524%0.239CC..Hα-helixtrans-63.8-43.7-179.8172.8-110.9000112.4W40 Y41 S47 A48 V88 V92 S95W40-F44 VanDerWaalsContact O-CB 3.27Å; W40-F44 WeakPolarHBondContact O-CB 3.45Å; W40-F44 PolarHBondContact O-N 3.38Å; Y41-F44 PolarHBondContact O-N 3.39Å; F44-S47 WeakPolarHBondContact O-CB 3.24Å; F44-S47 PolarHBondContact O-N 3.02Å; F44-A48 PolarHBondContact O-N 3.25Å; F44-V88 HydrophobicContact CE2-CG1 4.34Å; F44-V88 HydrophobicContact CZ-CG1 4.32Å; F44-V92 HydrophobicContact CD2-CB 4.45Å; F44-V92 HydrophobicContact CD2-CG2 3.72Å; F44-V92 HydrophobicContact CE2-CB 4.39Å; F44-V92 HydrophobicContact CE2-CG2 3.33Å; F44-V92 HydrophobicContact CG-CG2 4.48Å; F44-V92 HydrophobicContact CZ-CG2 3.78Å; F44-S95 WeakPolarHBondContact CA-OG 3.4Å; F44-S95 PolarHBondContact N-OG 3.34Å
45L88.6Confident87.2Confident45 Ų4545.1 Ų45.124%0.23623%0.226CC..Hα-helixtrans-67.6-42.6-177.5-174.2143.2000111.5L22 Y41 S47 A48 V49L22-L45 HydrophobicContact CB-CD2 3.78Å; L22-L45 HydrophobicContact CD2-CD2 4.04Å; L22-L45 HydrophobicContact CG-CD2 4.39Å; L22-L45 VanDerWaalsContact O-CD1 3.28Å; L22-L45 WeakPolarHBondContact O-CD1 3.49Å; Y41-L45 WeakPolarHBondContact O-CB 3.49Å; Y41-L45 PolarHBondContact O-N 2.89Å; L45-S47 VanDerWaalsContact C-N 3.27Å; L45-S47 PolarHBondContact O-N 3.45Å; L45-A48 PolarHBondContact O-N 3.32Å; L45-V49 HydrophobicContact CD2-CG2 4.12Å; L45-V49 VanDerWaalsContact O-CG2 3.32Å; L45-V49 WeakPolarHBondContact O-CG2 3.32Å; L45-V49 PolarHBondContact O-N 3.48Å
46W88.7Confident87.1Confident29 Ų2945.9 Ų45.911%0.1123%0.23CC..Hα-helixtrans-65.9-31.9174.6-75.3118.2000112.6F18 L22 G42 S50 F115F18-W46 AromaticContact CD1-CH2 3.92Å; F18-W46 HydrophobicContact CD1-CH2 3.92Å; F18-W46 AromaticContact CD1-CZ2 3.82Å; F18-W46 HydrophobicContact CD1-CZ2 3.82Å; F18-W46 HydrophobicContact CE1-CH2 4.2Å; F18-W46 HydrophobicContact CE1-CZ2 4.47Å; L22-W46 HydrophobicContact CD1-CH2 3.98Å; L22-W46 HydrophobicContact CD1-CZ2 4.23Å; G42-W46 PolarHBondContact O-N 3.37Å; W46-S50 WeakPolarHBondContact O-CB 3.23Å; W46-S50 PolarHBondContact O-N 2.89Å; W46-S50 PolarHBondContact O-OG 2.93Å; W46-F115 HydrophobicContact CD2-CB 4.28Å; W46-F115 AromaticContact CD2-CD2 3.77Å; W46-F115 HydrophobicContact CD2-CD2 3.77Å; W46-F115 AromaticContact CE3-CD2 3.64Å; W46-F115 HydrophobicContact CE3-CD2 3.64Å; W46-F115 HydrophobicContact CE3-CE2 4.19Å; W46-F115 HydrophobicContact CG-CB 4.18Å; W46-F115 HydrophobicContact CG-CD2 4.22Å; W46-F115 HydrophobicContact CH2-CD2 4.5Å; W46-F115 HydrophobicContact CZ3-CD2 4.03Å; W46-F115 HydrophobicContact CZ3-CE2 4.34Å
47S89.7Confident87Confident9 Ų945 Ų456%0.06323%0.233CC..Hα-helixtrans-63.5-47.5169.3-177.60000112.3V43 F44 L45 S50 S51 G118 Q121 S122V43-S47 WeakPolarHBondContact O-CB 3.17Å; V43-S47 PolarHBondContact O-N 3.32Å; F44-S47 WeakPolarHBondContact O-CB 3.24Å; F44-S47 PolarHBondContact O-N 3.02Å; L45-S47 VanDerWaalsContact C-N 3.27Å; L45-S47 PolarHBondContact O-N 3.45Å; S47-S50 WeakPolarHBondContact CA-OG 3.32Å; S47-S50 PolarHBondContact O-N 3.31Å; S47-S50 PolarHBondContact O-OG 3.11Å; S47-S51 WeakPolarHBondContact O-CB 3.32Å; S47-S51 PolarHBondContact O-N 2.74Å; S47-G118 VanDerWaalsContact CA-O 3.3Å; S47-G118 WeakPolarHBondContact CA-O 3.45Å; S47-Q121 VanDerWaalsContact OG-CD 3.25Å; S47-Q121 WeakPolarHBondContact OG-CG 3.41Å; S47-S122 PolarHBondContact O-OG 2.93Å; S47-S122 PolarHBondContact OG-OG 3.38Å
48A86.3Confident86.8Confident30 Ų3044.6 Ų44.625%0.24823%0.233CC..Hα-helixtrans-62.7-46177.800000112.5F44 L45 S50 S51 I52F44-A48 PolarHBondContact O-N 3.25Å; L45-A48 PolarHBondContact O-N 3.32Å; A48-S50 PolarHBondContact O-N 2.84Å; A48-S51 PolarHBondContact O-N 3.49Å; A48-I52 WeakPolarHBondContact O-CG1 3.34Å; A48-I52 PolarHBondContact O-N 3.39Å
49V87Confident86.6Confident50 Ų5044.3 Ų44.330%0.30323%0.233SC..Hα-helixtrans-60.1-47.6178170.70000110.8L45 I52 I53L45-V49 HydrophobicContact CD2-CG2 4.12Å; L45-V49 VanDerWaalsContact O-CG2 3.32Å; L45-V49 WeakPolarHBondContact O-CG2 3.32Å; L45-V49 PolarHBondContact O-N 3.48Å; V49-I52 PolarHBondContact O-N 3.06Å; V49-I53 HydrophobicContact CG1-CD1 4.1Å; V49-I53 WeakPolarHBondContact O-CG1 3.43Å; V49-I53 PolarHBondContact O-N 3.46Å
50S87.4Confident86.3Confident7 Ų749.1 Ų49.15%0.04926%0.258CS..Hα-helixtrans-64.8-40.3178.253.20000112.6W46 S47 A48 I52 I53 F54 S122W46-S50 WeakPolarHBondContact O-CB 3.23Å; W46-S50 PolarHBondContact O-N 2.89Å; W46-S50 PolarHBondContact O-OG 2.93Å; S47-S50 WeakPolarHBondContact CA-OG 3.32Å; S47-S50 PolarHBondContact O-N 3.31Å; S47-S50 PolarHBondContact O-OG 3.11Å; A48-S50 PolarHBondContact O-N 2.84Å; S50-I52 PolarHBondContact O-N 3.04Å; S50-I53 WeakPolarHBondContact O-CB 3.26Å; S50-I53 PolarHBondContact O-N 3.47Å; S50-F54 WeakPolarHBondContact O-CD2 3.3Å; S50-F54 PolarHBondContact O-N 2.7Å; S50-F54 VanDerWaalsContact O-N 3.16Å; S50-S122 WeakPolarHBondContact OG-CB 3.21Å; S50-S122 PolarHBondContact OG-OG 3.16Å
51S84.8Confident86.1Confident11 Ų1151.8 Ų51.88%0.07728%0.276CS..Hα-helixtrans-60.7-42.3176.4-176.20000112.4S47 A48 I53 F54 H55S47-S51 WeakPolarHBondContact O-CB 3.32Å; S47-S51 PolarHBondContact O-N 2.74Å; A48-S51 PolarHBondContact O-N 3.49Å; S51-I53 VanDerWaalsContact C-N 3.31Å; S51-I53 PolarHBondContact O-N 2.93Å; S51-F54 PolarHBondContact O-N 3.35Å; S51-H55 PolarHBondContact O-N 3.25Å; S51-H55 PolarHBondContact O-ND1 2.92Å; S51-H55 PolarHBondContact OG-ND1 3.25Å
52I83.6Confident86Confident95 Ų9547.8 Ų47.849%0.48726%0.263SS..Hα-helixtrans-61.1-42.3175.9-67.6164.9000110.6A48 V49 S50 F54 H55 L56A48-I52 WeakPolarHBondContact O-CG1 3.34Å; A48-I52 PolarHBondContact O-N 3.39Å; V49-I52 PolarHBondContact O-N 3.06Å; S50-I52 PolarHBondContact O-N 3.04Å; I52-F54 VanDerWaalsContact C-N 3.29Å; I52-F54 PolarHBondContact O-N 3.47Å; I52-H55 PolarHBondContact O-N 2.97Å; I52-L56 WeakPolarHBondContact O-CB 3.38Å; I52-L56 PolarHBondContact O-N 3.18Å
53I85.9Confident85.8Confident110 Ų11050.5 Ų50.556%0.56428%0.277SS*.Hα-helixtrans-60.8-38179-67.9165.9000111.5V49 S50 S51 P57V49-I53 HydrophobicContact CG1-CD1 4.1Å; V49-I53 WeakPolarHBondContact O-CG1 3.43Å; V49-I53 PolarHBondContact O-N 3.46Å; S50-I53 WeakPolarHBondContact O-CB 3.26Å; S50-I53 PolarHBondContact O-N 3.47Å; S51-I53 VanDerWaalsContact C-N 3.31Å; S51-I53 PolarHBondContact O-N 2.93Å; I53-P57 WeakPolarHBondContact O-CD 3.09Å; I53-P57 WeakPolarHBondContact O-CG 3.41Å
54F83.6Confident85.5Confident83 Ų8353.6 Ų53.636%0.36430%0.302SS..Hα-helixtrans-75.1-39.1177.6-68.2-61.2000113.2S50 S51 I52 V126S50-F54 WeakPolarHBondContact O-CD2 3.3Å; S50-F54 PolarHBondContact O-N 2.7Å; S50-F54 VanDerWaalsContact O-N 3.16Å; S51-F54 PolarHBondContact O-N 3.35Å; I52-F54 VanDerWaalsContact C-N 3.29Å; I52-F54 PolarHBondContact O-N 3.47Å; F54-V126 HydrophobicContact CB-CG2 4.12Å; F54-V126 HydrophobicContact CD2-CG2 4.08Å; F54-V126 HydrophobicContact CG-CG2 4.06Å
55H82.2Confident85.1Confident37 Ų3756 Ų5617%0.17132%0.321CS..Hα-helixtrans-86.1-25-174.1-67.988.6000113.7S51 I52 A58 A59 L80 G83S51-H55 PolarHBondContact O-N 3.25Å; S51-H55 PolarHBondContact O-ND1 2.92Å; S51-H55 PolarHBondContact OG-ND1 3.25Å; I52-H55 PolarHBondContact O-N 2.97Å; H55-A58 PolarHBondContact O-N 2.58Å; H55-A59 WeakPolarHBondContact O-CB 3.27Å; H55-A59 PolarHBondContact O-N 3.34Å; H55-L80 HydrophobicContact CB-CD2 4.07Å; H55-G83 PolarHBondContact CE1-O 3.5Å; H55-G83 PolarHBondContact NE2-O 3.27Å
56L83.8Confident84.6Confident93 Ų9355.6 Ų55.649%0.48732%0.319SS..Hα-helixtrans-64.2-45.7-178.7-173.773.8000113.1I52 A58 A59 L60I52-L56 WeakPolarHBondContact O-CB 3.38Å; I52-L56 PolarHBondContact O-N 3.18Å; L56-A58 PolarHBondContact O-N 3.01Å; L56-A59 PolarHBondContact O-N 2.87Å; L56-L60 HydrophobicContact CG-CD1 4.25Å; L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 WeakPolarHBondContact O-CG 3.38Å; L56-L60 PolarHBondContact O-N 3.43Å
57P85.6Confident83.9Confident66 Ų6662.3 Ų62.343%0.42934%0.344SS..Hα-helixtrans-61.5-42.1174.1-22.834.2000112.3I53 A59 L60 I61I53-P57 WeakPolarHBondContact O-CD 3.09Å; I53-P57 WeakPolarHBondContact O-CG 3.41Å; P57-A59 VanDerWaalsContact C-N 3.33Å; P57-A59 PolarHBondContact O-N 2.92Å; P57-L60 PolarHBondContact O-N 3.38Å; P57-I61 WeakPolarHBondContact O-CB 3.43Å; P57-I61 VanDerWaalsContact O-CG1 3.24Å; P57-I61 WeakPolarHBondContact O-CG1 3.32Å; P57-I61 PolarHBondContact O-N 3.24Å
58A82.7Confident83Confident49 Ų4970.3 Ų70.341%0.40538%0.381SS..Hα-helixtrans-61.4-42.9177.200000111.6H55 L56 I61 S62H55-A58 PolarHBondContact O-N 2.58Å; L56-A58 PolarHBondContact O-N 3.01Å; A58-I61 PolarHBondContact O-N 3.25Å; A58-S62 WeakPolarHBondContact O-CB 3.45Å; A58-S62 PolarHBondContact O-N 2.87Å
59A82.6Confident82.4Confident8 Ų874.9 Ų74.97%0.06640%0.396CS..Hα-helixtrans-66.3-39.7175.900000112.5H55 L56 P57 S62 L63 L80H55-A59 WeakPolarHBondContact O-CB 3.27Å; H55-A59 PolarHBondContact O-N 3.34Å; L56-A59 PolarHBondContact O-N 2.87Å; P57-A59 VanDerWaalsContact C-N 3.33Å; P57-A59 PolarHBondContact O-N 2.92Å; A59-S62 PolarHBondContact O-N 3.42Å; A59-L63 VanDerWaalsContact O-CB 3.23Å; A59-L63 WeakPolarHBondContact O-CB 3.3Å; A59-L63 PolarHBondContact O-N 2.9Å; A59-L80 HydrophobicContact CB-CD1 3.73Å; A59-L80 HydrophobicContact CB-CD2 3.69Å; A59-L80 HydrophobicContact CB-CG 3.62Å
60L85.2Confident81.6Confident101 Ų10182.3 Ų82.353%0.52943%0.425SS..Hα-helixtrans-64.5-44.4176-76.8170000111.9L56 P57 L63 A64L56-L60 HydrophobicContact CG-CD1 4.25Å; L56-L60 WeakPolarHBondContact O-CB 3.37Å; L56-L60 WeakPolarHBondContact O-CG 3.38Å; L56-L60 PolarHBondContact O-N 3.43Å; P57-L60 PolarHBondContact O-N 3.38Å; L60-L63 PolarHBondContact O-N 2.82Å; L60-A64 WeakPolarHBondContact O-CB 3.06Å; L60-A64 PolarHBondContact O-N 3.16Å
61I86.4Confident80.4Confident114 Ų11489.8 Ų89.859%0.58546%0.462SS*.Hα-helixtrans-62.9-47.1176.1-67164.5000109.8P57 A58 L63 A64 T65P57-I61 WeakPolarHBondContact O-CB 3.43Å; P57-I61 VanDerWaalsContact O-CG1 3.24Å; P57-I61 WeakPolarHBondContact O-CG1 3.32Å; P57-I61 PolarHBondContact O-N 3.24Å; A58-I61 PolarHBondContact O-N 3.25Å; I61-L63 VanDerWaalsContact C-N 3.31Å; I61-L63 PolarHBondContact O-N 3.24Å; I61-A64 PolarHBondContact O-N 3.19Å; I61-T65 PolarHBondContact O-N 3.19Å; I61-T65 PolarHBondContact O-OG1 3.04Å
62S84.9Confident79.6Confident18 Ų1890.4 Ų90.413%0.12647%0.468CS..Hα-helixtrans-58.5-44175.9-174.80000111.4A58 A59 T65 L66A58-S62 WeakPolarHBondContact O-CB 3.45Å; A58-S62 PolarHBondContact O-N 2.87Å; A59-S62 PolarHBondContact O-N 3.42Å; S62-T65 PolarHBondContact O-N 3.49Å; S62-L66 VanDerWaalsContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CB 3.49Å; S62-L66 WeakPolarHBondContact O-CD1 3.36Å; S62-L66 PolarHBondContact O-N 3.36Å
63L82.9Confident79.1Confident57 Ų5793.7 Ų93.730%0.29847%0.474SS..Hα-helixtrans-65.1-43.3178.3-171.968000111.7A59 L60 I61 T65 R67 P76A59-L63 VanDerWaalsContact O-CB 3.23Å; A59-L63 WeakPolarHBondContact O-CB 3.3Å; A59-L63 PolarHBondContact O-N 2.9Å; L60-L63 PolarHBondContact O-N 2.82Å; I61-L63 VanDerWaalsContact C-N 3.31Å; I61-L63 PolarHBondContact O-N 3.24Å; L63-T65 VanDerWaalsContact C-N 3.33Å; L63-T65 PolarHBondContact O-N 3.43Å; L63-R67 HydrophobicContact CD1-CG 4.36Å; L63-R67 HydrophobicContact CG-CG 4.27Å; L63-R67 VanDerWaalsContact O-CB 3.26Å; L63-R67 WeakPolarHBondContact O-CB 3.12Å; L63-R67 VanDerWaalsContact O-CD 3.31Å; L63-R67 WeakPolarHBondContact O-CD 3.42Å; L63-R67 WeakPolarHBondContact O-CG 2.97Å; L63-R67 PolarHBondContact O-N 3.32Å; L63-P76 HydrophobicContact CB-CB 4.44Å; L63-P76 HydrophobicContact CB-CG 4.19Å; L63-P76 HydrophobicContact CD1-CG 4.13Å
64A83.4Confident78.6Confident64 Ų6494.9 Ų94.953%0.52948%0.476SS..Hα-helixtrans-59-44.7176.300000111.6L60 I61L60-A64 WeakPolarHBondContact O-CB 3.06Å; L60-A64 PolarHBondContact O-N 3.16Å; I61-A64 PolarHBondContact O-N 3.19Å
65T82.8Confident78.4Confident99 Ų9993.7 Ų93.761%0.60748%0.475SS*.Hα-helixtrans-72.8-39.4-178.8-54.80000112.8I61 S62 L63I61-T65 PolarHBondContact O-N 3.19Å; I61-T65 PolarHBondContact O-OG1 3.04Å; S62-T65 PolarHBondContact O-N 3.49Å; L63-T65 VanDerWaalsContact C-N 3.33Å; L63-T65 PolarHBondContact O-N 3.43Å
66L77.6Confident78.3Confident37 Ų3792.3 Ų92.319%0.19447%0.469CS..Hα-helixtrans-94.3-4.7-172.6-79.867.1000113.9S62 Q68 H69 A72 T75S62-L66 VanDerWaalsContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CB 3.49Å; S62-L66 WeakPolarHBondContact O-CD1 3.36Å; S62-L66 PolarHBondContact O-N 3.36Å; L66-Q68 PolarHBondContact O-N 3.27Å; L66-H69 PolarHBondContact O-N 2.91Å; L66-A72 HydrophobicContact CB-CB 4.14Å; L66-A72 HydrophobicContact CD2-CB 3.67Å; L66-A72 WeakPolarHBondContact CD2-O 3.48Å; L66-A72 HydrophobicContact CG-CB 3.88Å; L66-T75 HydrophobicContact CD2-CG2 3.94Å
67R73.1Confident78Confident170 Ų17092.2 Ų92.264%0.64247%0.469SS*.THydrogen-bonded Turntrans-54.6-25.7179.1-99.8164.5-174.4-166.45.5114.5L63L63-R67 HydrophobicContact CD1-CG 4.36Å; L63-R67 HydrophobicContact CG-CG 4.27Å; L63-R67 VanDerWaalsContact O-CB 3.26Å; L63-R67 WeakPolarHBondContact O-CB 3.12Å; L63-R67 VanDerWaalsContact O-CD 3.31Å; L63-R67 WeakPolarHBondContact O-CD 3.42Å; L63-R67 WeakPolarHBondContact O-CG 2.97Å; L63-R67 PolarHBondContact O-N 3.32Å
68Q71.3Confident77.7Confident178 Ų17891.8 Ų91.883%0.83247%0.471SS*.THydrogen-bonded Turntrans-83.3-12.1-178.4-63-79-3900113.4L66L66-Q68 PolarHBondContact O-N 3.27Å
69H74Confident77.4Confident125 Ų12593.1 Ų93.158%0.57947%0.47SS*.  trans-107124.5-173.3-77.8-76.5000113.3L66 I71 A72 R73L66-H69 PolarHBondContact O-N 2.91Å; H69-I71 VanDerWaalsContact C-N 3.27Å; H69-I71 PolarHBondContact O-N 2.93Å; H69-A72 HydrophobicContact CB-CB 3.71Å; H69-A72 PolarHBondContact O-N 2.82Å; H69-R73 PolarHBondContact O-N 3.41Å
70K69.3Low77.1Confident207 Ų20795.2 Ų95.290%0.948%0.48SS*.THydrogen-bonded Turntrans-60.5-29.6-176.5-149.2-178.9-173-170.80114.3
71I64Low76.8Confident163 Ų16395 Ų9584%0.83648%0.479SS*.THydrogen-bonded Turntrans-98.2-33.3-178.9-71.6156.3000112H69 R73H69-I71 VanDerWaalsContact C-N 3.27Å; H69-I71 PolarHBondContact O-N 2.93Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.29Å
72A67.8Low76.4Confident24 Ų2497.1 Ų97.120%0.19849%0.488CS..G310 helixtrans-84.5-4.9-173.500000113.7L66 H69 F74 T75L66-A72 HydrophobicContact CB-CB 4.14Å; L66-A72 HydrophobicContact CD2-CB 3.67Å; L66-A72 WeakPolarHBondContact CD2-O 3.48Å; L66-A72 HydrophobicContact CG-CB 3.88Å; H69-A72 HydrophobicContact CB-CB 3.71Å; H69-A72 PolarHBondContact O-N 2.82Å; A72-F74 PolarHBondContact O-N 3.49Å; A72-T75 WeakPolarHBondContact O-CB 3.29Å; A72-T75 PolarHBondContact O-N 2.8Å; A72-T75 VanDerWaalsContact O-N 3.1Å; A72-T75 PolarHBondContact O-OG1 2.92Å; A72-T75 VanDerWaalsContact O-OG1 3.14Å
73R71.2Confident75.7Confident164 Ų16496.9 Ų96.962%0.61949%0.489SS*.G310 helixtrans-49.6-33.8177.8161.7175.2-86.2-168.7-4.9114.1H69 I71 P76H69-R73 PolarHBondContact O-N 3.41Å; I71-R73 VanDerWaalsContact C-N 3.33Å; I71-R73 PolarHBondContact O-N 3.29Å; R73-P76 WeakPolarHBondContact O-CD 3.33Å
74F76.1Confident75.3Confident136 Ų13697 Ų9760%0.59649%0.489SS*.G310 helixtrans-92.9-7.7-174.9-60.2-73.8000114.1A72 P76 I77 A78A72-F74 PolarHBondContact O-N 3.49Å; F74-P76 VanDerWaalsContact C-CD 3.45Å; F74-I77 HydrophobicContact CD1-CD1 3.99Å; F74-I77 WeakPolarHBondContact O-CB 3.4Å; F74-I77 PolarHBondContact O-N 3.45Å; F74-I77 VanDerWaalsContact O-N 3.13Å; F74-A78 PolarHBondContact O-N 3.32Å; F74-A78 VanDerWaalsContact O-N 3.12Å
75T80.3Confident75.1Confident58 Ų5899 Ų9936%0.35649%0.49SS..Hα-helixtrans-59.1-40.2179-50.40000113.8L66 A72 I77 A78 I79L66-T75 HydrophobicContact CD2-CG2 3.94Å; A72-T75 WeakPolarHBondContact O-CB 3.29Å; A72-T75 PolarHBondContact O-N 2.8Å; A72-T75 VanDerWaalsContact O-N 3.1Å; A72-T75 PolarHBondContact O-OG1 2.92Å; A72-T75 VanDerWaalsContact O-OG1 3.14Å; T75-I77 VanDerWaalsContact C-N 3.25Å; T75-I77 PolarHBondContact O-N 3.35Å; T75-A78 PolarHBondContact O-N 3.28Å; T75-I79 HydrophobicContact CG2-CD1 3.97Å; T75-I79 HydrophobicContact CG2-CG1 4.43Å; T75-I79 WeakPolarHBondContact O-CG1 3.15Å; T75-I79 PolarHBondContact O-N 3.45Å
76P78.7Confident74.8Confident7 Ų796.6 Ų96.65%0.04549%0.486CS..Hα-helixtrans-61.2-34.2175.7-18.729.1000112.8L63 R73 F74 L80L63-P76 HydrophobicContact CB-CB 4.44Å; L63-P76 HydrophobicContact CB-CG 4.19Å; L63-P76 HydrophobicContact CD1-CG 4.13Å; R73-P76 WeakPolarHBondContact O-CD 3.33Å; F74-P76 VanDerWaalsContact C-CD 3.45Å; P76-L80 WeakPolarHBondContact O-CB 3.25Å; P76-L80 WeakPolarHBondContact O-CG 3.39Å; P76-L80 PolarHBondContact O-N 3.31Å
77I79.3Confident74.7Confident92 Ų9296.3 Ų96.347%0.47249%0.486SS..Hα-helixtrans-69.7-42.4177.3-65161000110F74 T75 L80 L81F74-I77 HydrophobicContact CD1-CD1 3.99Å; F74-I77 WeakPolarHBondContact O-CB 3.4Å; F74-I77 PolarHBondContact O-N 3.45Å; F74-I77 VanDerWaalsContact O-N 3.13Å; T75-I77 VanDerWaalsContact C-N 3.25Å; T75-I77 PolarHBondContact O-N 3.35Å; I77-L80 PolarHBondContact O-N 3.26Å; I77-L81 HydrophobicContact CG2-CD1 3.99Å; I77-L81 HydrophobicContact CG2-CG 4.49Å; I77-L81 WeakPolarHBondContact O-CB 3.28Å; I77-L81 WeakPolarHBondContact O-CG 3.3Å; I77-L81 PolarHBondContact O-N 2.87Å
78A78.5Confident75.1Confident57 Ų5790.6 Ų90.647%0.47147%0.47SS..Hα-helixtrans-63.5-40.6175.700000112.2F74 T75 L81 M82F74-A78 PolarHBondContact O-N 3.32Å; F74-A78 VanDerWaalsContact O-N 3.12Å; T75-A78 PolarHBondContact O-N 3.28Å; A78-L81 PolarHBondContact O-N 2.94Å; A78-M82 WeakPolarHBondContact O-CB 3.36Å; A78-M82 PolarHBondContact O-N 3.4Å
79I76.7Confident75.8Confident76 Ų7686.4 Ų86.439%0.3946%0.459SS..Hα-helixtrans-63.9-43.4175.6-67.8167.1000110.8T75 G83T75-I79 HydrophobicContact CG2-CD1 3.97Å; T75-I79 HydrophobicContact CG2-CG1 4.43Å; T75-I79 WeakPolarHBondContact O-CG1 3.15Å; T75-I79 PolarHBondContact O-N 3.45Å; I79-G83 PolarHBondContact O-N 2.88Å
80L75.9Confident76.3Confident53 Ų5382.1 Ų82.128%0.27745%0.448SS..Hα-helixtrans-62.4-47.3174.3-80174.5000111.8H55 A59 P76 I77 M82 G83 I84H55-L80 HydrophobicContact CB-CD2 4.07Å; A59-L80 HydrophobicContact CB-CD1 3.73Å; A59-L80 HydrophobicContact CB-CD2 3.69Å; A59-L80 HydrophobicContact CB-CG 3.62Å; P76-L80 WeakPolarHBondContact O-CB 3.25Å; P76-L80 WeakPolarHBondContact O-CG 3.39Å; P76-L80 PolarHBondContact O-N 3.31Å; I77-L80 PolarHBondContact O-N 3.26Å; L80-M82 PolarHBondContact O-N 3.14Å; L80-G83 PolarHBondContact O-N 2.98Å; L80-I84 HydrophobicContact CB-CD1 4.32Å; L80-I84 HydrophobicContact CD2-CD1 4.18Å; L80-I84 WeakPolarHBondContact O-CB 3.11Å; L80-I84 WeakPolarHBondContact O-CD1 3.48Å; L80-I84 WeakPolarHBondContact O-CG1 3.43Å; L80-I84 PolarHBondContact O-N 2.93Å
81L78.8Confident77.1Confident95 Ų9572.3 Ų72.350%0.49741%0.407SS..Hα-helixtrans-61.6-46.3179.7-78.9168.9000111.8I77 A78 I84 L85I77-L81 HydrophobicContact CG2-CD1 3.99Å; I77-L81 HydrophobicContact CG2-CG 4.49Å; I77-L81 WeakPolarHBondContact O-CB 3.28Å; I77-L81 WeakPolarHBondContact O-CG 3.3Å; I77-L81 PolarHBondContact O-N 2.87Å; A78-L81 PolarHBondContact O-N 2.94Å; L81-I84 PolarHBondContact O-N 3.42Å; L81-L85 HydrophobicContact CB-CD1 4.44Å; L81-L85 HydrophobicContact CD2-CD1 4.39Å; L81-L85 VanDerWaalsContact O-CB 3.3Å; L81-L85 WeakPolarHBondContact O-CB 3.41Å; L81-L85 WeakPolarHBondContact O-CG 3.44Å; L81-L85 PolarHBondContact O-N 3.35Å
82M77.5Confident78.4Confident159 Ų15967 Ų6778%0.78338%0.381SS*.Hα-helixtrans-66.2-42.3178.8-165.3-157.917500111.7A78 L80 I84A78-M82 WeakPolarHBondContact O-CB 3.36Å; A78-M82 PolarHBondContact O-N 3.4Å; L80-M82 PolarHBondContact O-N 3.14Å; M82-I84 VanDerWaalsContact C-N 3.27Å; M82-I84 PolarHBondContact O-N 3.38Å
83G70.7Confident79.6Confident14 Ų1471.9 Ų71.914%0.14440%0.404CS..Hα-helixtrans-72.8-14.7179.100000114.4H55 I79 L80 P87H55-G83 PolarHBondContact CE1-O 3.5Å; H55-G83 PolarHBondContact NE2-O 3.27Å; I79-G83 PolarHBondContact O-N 2.88Å; L80-G83 PolarHBondContact O-N 2.98Å; G83-P87 WeakPolarHBondContact O-CD 3.4Å; G83-P87 WeakPolarHBondContact O-CG 3.23Å
84I73.7Confident80.6Confident58 Ų5867.1 Ų67.130%0.29739%0.393SS..Hα-helixtrans-103.7-45.8179.1-66.1168.6000111.1L80 L81 M82 G86 P87 V88L80-I84 HydrophobicContact CB-CD1 4.32Å; L80-I84 HydrophobicContact CD2-CD1 4.18Å; L80-I84 WeakPolarHBondContact O-CB 3.11Å; L80-I84 WeakPolarHBondContact O-CD1 3.48Å; L80-I84 WeakPolarHBondContact O-CG1 3.43Å; L80-I84 PolarHBondContact O-N 2.93Å; L81-I84 PolarHBondContact O-N 3.42Å; M82-I84 VanDerWaalsContact C-N 3.27Å; M82-I84 PolarHBondContact O-N 3.38Å; I84-G86 PolarHBondContact O-N 2.86Å; I84-P87 WeakPolarHBondContact O-CD 3.36Å; I84-V88 HydrophobicContact CG2-CG2 3.61Å; I84-V88 WeakPolarHBondContact O-CB 3.11Å; I84-V88 WeakPolarHBondContact O-CG2 3.32Å; I84-V88 PolarHBondContact O-N 3.42Å
85L79.1Confident81.4Confident106 Ų10660.7 Ų60.756%0.55536%0.364SS*.Hα-helixtrans-63.2-48.1-171.1-73.1170.3000113.5L81 V88 C89L81-L85 HydrophobicContact CB-CD1 4.44Å; L81-L85 HydrophobicContact CD2-CD1 4.39Å; L81-L85 VanDerWaalsContact O-CB 3.3Å; L81-L85 WeakPolarHBondContact O-CB 3.41Å; L81-L85 WeakPolarHBondContact O-CG 3.44Å; L81-L85 PolarHBondContact O-N 3.35Å; L85-V88 PolarHBondContact O-N 2.85Å; L85-C89 PolarHBondContact O-N 3.47Å; L85-C89 PolarHBondContact O-SG 2.96Å
86G77.6Confident82Confident50 Ų5059.1 Ų59.152%0.51536%0.358SS..Hα-helixtrans-62.2-52.4177.600000111.9I84 V88 C89 G90I84-G86 PolarHBondContact O-N 2.86Å; G86-V88 VanDerWaalsContact C-N 3.31Å; G86-V88 PolarHBondContact O-N 2.9Å; G86-C89 PolarHBondContact O-N 2.86Å; G86-G90 PolarHBondContact O-N 3.42Å
87P75.8Confident82.8Confident31 Ų3161.7 Ų61.720%0.20138%0.379CS..Hα-helixtrans-64.8-28177.2-30.242.2000114.6G83 I84 G91 V125G83-P87 WeakPolarHBondContact O-CD 3.4Å; G83-P87 WeakPolarHBondContact O-CG 3.23Å; I84-P87 WeakPolarHBondContact O-CD 3.36Å; P87-G91 VanDerWaalsContact O-CA 3.23Å; P87-G91 WeakPolarHBondContact O-CA 3.42Å; P87-G91 PolarHBondContact O-N 3.04Å; P87-V125 HydrophobicContact CB-CG1 4.3Å; P87-V125 HydrophobicContact CG-CG1 3.87Å
88V80.7Confident83.5Confident50 Ų5059 Ų5930%0.30337%0.365SS..Hα-helixtrans-70.8-49174.1165.70000110.7F44 I84 L85 G86 G91 V92F44-V88 HydrophobicContact CE2-CG1 4.34Å; F44-V88 HydrophobicContact CZ-CG1 4.32Å; I84-V88 HydrophobicContact CG2-CG2 3.61Å; I84-V88 WeakPolarHBondContact O-CB 3.11Å; I84-V88 WeakPolarHBondContact O-CG2 3.32Å; I84-V88 PolarHBondContact O-N 3.42Å; L85-V88 PolarHBondContact O-N 2.85Å; G86-V88 VanDerWaalsContact C-N 3.31Å; G86-V88 PolarHBondContact O-N 2.9Å; V88-G91 PolarHBondContact O-N 3.21Å; V88-V92 WeakPolarHBondContact O-CB 3.35Å; V88-V92 VanDerWaalsContact O-CG2 3.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.29Å; V88-V92 PolarHBondContact O-N 2.85Å
89C85.5Confident84.2Confident90 Ų9056.2 Ų56.261%0.60834%0.343SS*.Hα-helixtrans-62.7-46177.7-70.10000111.7L85 G86 L93L85-C89 PolarHBondContact O-N 3.47Å; L85-C89 PolarHBondContact O-SG 2.96Å; G86-C89 PolarHBondContact O-N 2.86Å; C89-L93 PolarHBondContact O-N 3.32Å
90G85.1Confident84.9Confident34 Ų3453.9 Ų53.935%0.35134%0.337SS..Hα-helixtrans-61.3-47.7174.400000111.6G86 V92 L93 T94G86-G90 PolarHBondContact O-N 3.42Å; G90-V92 PolarHBondContact O-N 3.05Å; G90-L93 PolarHBondContact O-N 3.22Å; G90-L93 VanDerWaalsContact O-N 3.11Å; G90-T94 WeakPolarHBondContact O-CG2 3.44Å; G90-T94 PolarHBondContact O-N 3.43Å; G90-T94 PolarHBondContact O-OG1 3.08Å
91G86.8Confident85.9Confident2 Ų256.1 Ų56.12%0.02135%0.353CS..Hα-helixtrans-61.8-37.9-179.600000113.6P87 V88 T94 S95P87-G91 VanDerWaalsContact O-CA 3.23Å; P87-G91 WeakPolarHBondContact O-CA 3.42Å; P87-G91 PolarHBondContact O-N 3.04Å; V88-G91 PolarHBondContact O-N 3.21Å; G91-T94 WeakPolarHBondContact CA-OG1 3.18Å; G91-T94 PolarHBondContact O-OG1 3.22Å; G91-S95 WeakPolarHBondContact O-CB 3.38Å; G91-S95 PolarHBondContact O-N 2.74Å; G91-S95 PolarHBondContact O-OG 3.24Å
92V91.4Very high86.5Confident50 Ų5053 Ų5330%0.30334%0.335SS..Hα-helixtrans-59.3-49.3171.9160.80000110.4W40 F44 V88 G90 A96W40-V92 HydrophobicContact CZ2-CG1 3.86Å; W40-V92 PolarHBondContact NE1-O 2.83Å; F44-V92 HydrophobicContact CD2-CB 4.45Å; F44-V92 HydrophobicContact CD2-CG2 3.72Å; F44-V92 HydrophobicContact CE2-CB 4.39Å; F44-V92 HydrophobicContact CE2-CG2 3.33Å; F44-V92 HydrophobicContact CG-CG2 4.48Å; F44-V92 HydrophobicContact CZ-CG2 3.78Å; V88-V92 WeakPolarHBondContact O-CB 3.35Å; V88-V92 VanDerWaalsContact O-CG2 3.32Å; V88-V92 WeakPolarHBondContact O-CG2 3.29Å; V88-V92 PolarHBondContact O-N 2.85Å; G90-V92 PolarHBondContact O-N 3.05Å; V92-A96 WeakPolarHBondContact O-CB 3.39Å; V92-A96 PolarHBondContact O-N 2.94Å
93L92.3Very high87.2Confident128 Ų12850.7 Ų50.767%0.6732%0.32SS*.Hα-helixtrans-71-45.4-174.9-173.865.7000112.2C89 G90 S95 A96 A97C89-L93 PolarHBondContact O-N 3.32Å; G90-L93 PolarHBondContact O-N 3.22Å; G90-L93 VanDerWaalsContact O-N 3.11Å; L93-S95 VanDerWaalsContact C-N 3.35Å; L93-A96 PolarHBondContact O-N 2.98Å; L93-A97 PolarHBondContact O-N 3.21Å
94T92.2Very high88.2Confident64 Ų6454.4 Ų54.439%0.39335%0.349SS..Hα-helixtrans-65-39.8177.749.90000111.4G90 G91 A96 A97 I98 Q121G90-T94 WeakPolarHBondContact O-CG2 3.44Å; G90-T94 PolarHBondContact O-N 3.43Å; G90-T94 PolarHBondContact O-OG1 3.08Å; G91-T94 WeakPolarHBondContact CA-OG1 3.18Å; G91-T94 PolarHBondContact O-OG1 3.22Å; T94-A96 VanDerWaalsContact C-N 3.31Å; T94-A96 PolarHBondContact O-N 3.08Å; T94-A97 WeakPolarHBondContact O-CB 3.47Å; T94-A97 PolarHBondContact O-N 3.05Å; T94-I98 VanDerWaalsContact O-CG1 3.29Å; T94-I98 WeakPolarHBondContact O-CG1 3.44Å; T94-I98 PolarHBondContact O-N 2.91Å; T94-Q121 PolarHBondContact OG1-OE1 2.81Å
95S92.6Very high89.1Confident0 Ų054.6 Ų54.60%036%0.36CS..Hα-helixtrans-64.3-39175.1-56.70000111.2W40 V43 F44 G91 L93 A97 I98 A99 Q121W40-S95 VanDerWaalsContact CD1-C 3.44Å; V43-S95 WeakPolarHBondContact CG1-OG 3.44Å; F44-S95 WeakPolarHBondContact CA-OG 3.4Å; F44-S95 PolarHBondContact N-OG 3.34Å; G91-S95 WeakPolarHBondContact O-CB 3.38Å; G91-S95 PolarHBondContact O-N 2.74Å; G91-S95 PolarHBondContact O-OG 3.24Å; L93-S95 VanDerWaalsContact C-N 3.35Å; S95-A97 VanDerWaalsContact C-N 3.34Å; S95-I98 PolarHBondContact O-N 2.82Å; S95-A99 WeakPolarHBondContact O-CB 3.42Å; S95-A99 PolarHBondContact O-N 2.91Å; S95-Q121 PolarHBondContact OG-NE2 3.43Å
96A93.6Very high89.5Confident26 Ų2652.9 Ų52.922%0.21537%0.368CS..Hα-helixtrans-66.5-39.3176.800000110.9F36 W40 V92 L93 T94 G100F36-A96 HydrophobicContact CZ-CB 4.29Å; W40-A96 HydrophobicContact CG-CB 4.4Å; V92-A96 WeakPolarHBondContact O-CB 3.39Å; V92-A96 PolarHBondContact O-N 2.94Å; L93-A96 PolarHBondContact O-N 2.98Å; T94-A96 VanDerWaalsContact C-N 3.31Å; T94-A96 PolarHBondContact O-N 3.08Å; A96-G100 PolarHBondContact O-N 3.39Å
97A95.3Very high90Very high60 Ų6057.1 Ų57.150%0.49637%0.372SS..Hα-helixtrans-62.1-45.4174.300000111.7L93 T94 S95 G100 V101L93-A97 PolarHBondContact O-N 3.21Å; T94-A97 WeakPolarHBondContact O-CB 3.47Å; T94-A97 PolarHBondContact O-N 3.05Å; S95-A97 VanDerWaalsContact C-N 3.34Å; A97-G100 PolarHBondContact O-N 3.14Å; A97-V101 WeakPolarHBondContact O-CG2 3.43Å; A97-V101 PolarHBondContact O-N 3.02Å
98I93.7Very high90.5Very high35 Ų3558.7 Ų58.718%0.17938%0.381CS..Hα-helixtrans-60.5-51.2177.2-67.4163.2000110.5V43 T94 S95 G100 V101 Y102 F117V43-I98 HydrophobicContact CG1-CD1 4.01Å; V43-I98 HydrophobicContact CG2-CG2 4.25Å; T94-I98 VanDerWaalsContact O-CG1 3.29Å; T94-I98 WeakPolarHBondContact O-CG1 3.44Å; T94-I98 PolarHBondContact O-N 2.91Å; S95-I98 PolarHBondContact O-N 2.82Å; I98-G100 VanDerWaalsContact C-N 3.26Å; I98-G100 PolarHBondContact O-N 2.64Å; I98-V101 PolarHBondContact O-N 3.32Å; I98-Y102 HydrophobicContact CG2-CD2 4.24Å; I98-Y102 HydrophobicContact CG2-CE2 4.31Å; I98-Y102 WeakPolarHBondContact O-CD2 3.33Å; I98-Y102 PolarHBondContact O-N 3.44Å; I98-Y102 VanDerWaalsContact O-N 3.08Å; I98-F117 HydrophobicContact CD1-CB 4.13Å; I98-F117 HydrophobicContact CD1-CD1 4.15Å; I98-F117 HydrophobicContact CD1-CG 4.27Å; I98-F117 HydrophobicContact CG2-CD2 4.09Å; I98-F117 HydrophobicContact CG2-CE2 4.43Å; I98-F117 HydrophobicContact CG2-CG 4.19Å
99A93.3Very high90.7Very high0 Ų056.3 Ų56.30%037%0.367CS..Hα-helixtrans-60.5-37176.900000112.3F36 M39 W40 S95 Y102 K103F36-A99 HydrophobicContact CD2-CB 3.81Å; F36-A99 HydrophobicContact CE2-CB 3.71Å; F36-A99 HydrophobicContact CZ-CB 4.47Å; M39-A99 HydrophobicContact CB-CB 3.75Å; W40-A99 HydrophobicContact CB-CB 3.81Å; S95-A99 WeakPolarHBondContact O-CB 3.42Å; S95-A99 PolarHBondContact O-N 2.91Å; A99-Y102 PolarHBondContact O-N 2.82Å; A99-K103 WeakPolarHBondContact O-CB 3.14Å; A99-K103 PolarHBondContact O-N 2.77Å
100G92.3Very high90.7Very high26 Ų2654.6 Ų54.627%0.26835%0.35SS..Hα-helixtrans-63.6-43.6176.300000112.3A96 A97 I98 K103 A104A96-G100 PolarHBondContact O-N 3.39Å; A97-G100 PolarHBondContact O-N 3.14Å; I98-G100 VanDerWaalsContact C-N 3.26Å; I98-G100 PolarHBondContact O-N 2.64Å; G100-K103 PolarHBondContact O-N 3.37Å; G100-A104 VanDerWaalsContact O-CB 3.29Å; G100-A104 WeakPolarHBondContact O-CB 3.39Å; G100-A104 PolarHBondContact O-N 3.15Å
101V95.1Very high90.6Very high100 Ų10053.4 Ų53.461%0.60634%0.337SS*.Hα-helixtrans-62.9-45.1175.5170.70000111.1A97 I98 K103 A104 A105A97-V101 WeakPolarHBondContact O-CG2 3.43Å; A97-V101 PolarHBondContact O-N 3.02Å; I98-V101 PolarHBondContact O-N 3.32Å; V101-K103 VanDerWaalsContact C-N 3.33Å; V101-K103 PolarHBondContact O-N 2.88Å; V101-A104 PolarHBondContact O-N 3.39Å; V101-A105 VanDerWaalsContact O-CB 3.25Å; V101-A105 WeakPolarHBondContact O-CB 3.25Å; V101-A105 PolarHBondContact O-N 3.11Å
102Y92.5Very high90.4Very high31 Ų3157.7 Ų57.712%0.12236%0.355CS..Hα-helixtrans-59.4-45.1175.5-92.1-100000111.6M39 I98 A99 A105 G106 K107 M109 E113 F117M39-Y102 HydrophobicContact SD-CD1 4.43Å; M39-Y102 HydrophobicContact SD-CG 4.26Å; I98-Y102 HydrophobicContact CG2-CD2 4.24Å; I98-Y102 HydrophobicContact CG2-CE2 4.31Å; I98-Y102 WeakPolarHBondContact O-CD2 3.33Å; I98-Y102 PolarHBondContact O-N 3.44Å; I98-Y102 VanDerWaalsContact O-N 3.08Å; A99-Y102 PolarHBondContact O-N 2.82Å; Y102-A105 PolarHBondContact O-N 3.5Å; Y102-G106 PolarHBondContact O-N 3.11Å; Y102-K107 HydrophobicContact CD1-CB 3.96Å; Y102-K107 HydrophobicContact CE1-CB 4.47Å; Y102-K107 PolarHBondContact O-N 3.14Å; Y102-M109 HydrophobicContact CD1-CB 3.68Å; Y102-M109 HydrophobicContact CD1-CG 4.18Å; Y102-M109 HydrophobicContact CE1-CB 3.72Å; Y102-M109 HydrophobicContact CE1-CG 3.83Å; Y102-M109 HydrophobicContact CE2-CG 4.39Å; Y102-M109 HydrophobicContact CE2-SD 4.45Å; Y102-M109 HydrophobicContact CG-CB 4.25Å; Y102-E113 PolarHBondContact OH-OE1 3.27Å; Y102-E113 PolarHBondContact OH-OE2 3.33Å; Y102-F117 AromaticContact CE2-CE2 3.87Å; Y102-F117 HydrophobicContact CE2-CE2 3.87Å; Y102-F117 HydrophobicContact CE2-CZ 4.43Å
103K91.4Very high90.2Very high109 Ų10958.7 Ų58.747%0.47436%0.356SS..Hα-helixtrans-65.6-43.8179.1-169.361.1171.4-173.10112.3M39 A99 G100 V101 A105 G106M39-K103 HydrophobicContact CE-CB 4.17Å; M39-K103 HydrophobicContact CE-CD 4.47Å; A99-K103 WeakPolarHBondContact O-CB 3.14Å; A99-K103 PolarHBondContact O-N 2.77Å; G100-K103 PolarHBondContact O-N 3.37Å; V101-K103 VanDerWaalsContact C-N 3.33Å; V101-K103 PolarHBondContact O-N 2.88Å; K103-A105 VanDerWaalsContact C-N 3.29Å; K103-A105 PolarHBondContact O-N 3.44Å; K103-G106 PolarHBondContact O-N 3.18Å; K103-G106 VanDerWaalsContact O-N 3.11Å
104A92.6Very high90Very high92 Ų9252.6 Ų52.676%0.7633%0.325SS*.Hα-helixtrans-64.8-33.6177.300000112.2G100 V101 G106G100-A104 VanDerWaalsContact O-CB 3.29Å; G100-A104 WeakPolarHBondContact O-CB 3.39Å; G100-A104 PolarHBondContact O-N 3.15Å; V101-A104 PolarHBondContact O-N 3.39Å; A104-G106 VanDerWaalsContact C-N 3.25Å; A104-G106 PolarHBondContact O-N 3.44Å
105A91.6Very high89.8Confident63 Ų6351.9 Ų51.952%0.52132%0.316SS..THydrogen-bonded Turntrans-79.3-3.7175.200000113.7V101 Y102 K103 K107V101-A105 VanDerWaalsContact O-CB 3.25Å; V101-A105 WeakPolarHBondContact O-CB 3.25Å; V101-A105 PolarHBondContact O-N 3.11Å; Y102-A105 PolarHBondContact O-N 3.5Å; K103-A105 VanDerWaalsContact C-N 3.29Å; K103-A105 PolarHBondContact O-N 3.44Å; A105-K107 HydrophobicContact CB-CD 4.4Å; A105-K107 HydrophobicContact CB-CG 4.04Å; A105-K107 PolarHBondContact O-N 3.33Å
106G88Confident89.7Confident70 Ų7055.2 Ų55.272%0.72234%0.336SS*.THydrogen-bonded Turntrans63.422-174.600000113.6Y102 K103 A104Y102-G106 PolarHBondContact O-N 3.11Å; K103-G106 PolarHBondContact O-N 3.18Å; K103-G106 VanDerWaalsContact O-N 3.11Å; A104-G106 VanDerWaalsContact C-N 3.25Å; A104-G106 PolarHBondContact O-N 3.44Å
107K87.8Confident89.6Confident138 Ų13857.9 Ų57.960%0.634%0.343SS*.PPolyproline II helixtrans-98.5139-178.5-63.6-169.879.8115.40110.8Y102 A105Y102-K107 HydrophobicContact CD1-CB 3.96Å; Y102-K107 HydrophobicContact CE1-CB 4.47Å; Y102-K107 PolarHBondContact O-N 3.14Å; A105-K107 HydrophobicContact CB-CD 4.4Å; A105-K107 HydrophobicContact CB-CG 4.04Å; A105-K107 PolarHBondContact O-N 3.33Å
108T87.3Confident89.4Confident65 Ų6555 Ų5540%0.39932%0.32SS..PPolyproline II helixtrans-80.1145.6166.657.10000109.9I34I34-T108 HydrophobicContact CG1-CG2 4.02Å; I34-T108 HydrophobicContact CG2-CG2 4.47Å
109M84.9Confident89.3Confident0 Ų055.4 Ų55.40%032%0.324CS..EExtended strand (participates in β ladder)trans-102.2131178.7-170.5179.368.500110.3F32 L33 M39 V43 Y102 E113 A114F32-M109 CarbonylContact C-O 3.54Å; F32-M109 WeakPolarHBondContact CA-O 3.43Å; L33-M109 HydrophobicContact CB-CE 4.48Å; L33-M109 HydrophobicContact CD1-CE 3.5Å; L33-M109 PolarHBondContact N-O 2.92Å; L33-M109 PolarHBondContact O-N 2.91Å; M39-M109 VanDerWaalsContact CA-CE 3.44Å; M39-M109 HydrophobicContact CB-CE 3.64Å; M39-M109 HydrophobicContact CB-SD 4.34Å; M39-M109 HydrophobicContact CG-CB 3.85Å; M39-M109 HydrophobicContact CG-CE 3.89Å; M39-M109 WeakPolarHBondContact O-CE 3.35Å; M39-M109 HydrophobicContact SD-CB 3.68Å; V43-M109 HydrophobicContact CG2-CE 3.83Å; V43-M109 HydrophobicContact CG2-SD 3.77Å; Y102-M109 HydrophobicContact CD1-CB 3.68Å; Y102-M109 HydrophobicContact CD1-CG 4.18Å; Y102-M109 HydrophobicContact CE1-CB 3.72Å; Y102-M109 HydrophobicContact CE1-CG 3.83Å; Y102-M109 HydrophobicContact CE2-CG 4.39Å; Y102-M109 HydrophobicContact CE2-SD 4.45Å; Y102-M109 HydrophobicContact CG-CB 4.25Å; M109-E113 HydrophobicContact CG-CB 3.9Å; M109-A114 HydrophobicContact CE-CB 3.4Å; M109-A114 VanDerWaalsContact CE-CB 3.4Å; M109-A114 HydrophobicContact SD-CB 4.24Å
110M85.3Confident89.2Confident53 Ų5356.9 Ų56.926%0.26134%0.339SS..EExtended strand (participates in β ladder)trans-74.3147.1174.1-166.6-179.1-68.500110.2F32 F112 E113 A114F32-M110 HydrophobicContact CD1-CB 4.28Å; F32-M110 HydrophobicContact CE1-CB 4.25Å; F32-M110 HydrophobicContact CE1-CE 3.77Å; F32-M110 HydrophobicContact CE1-CG 4.42Å; F32-M110 HydrophobicContact CZ-CE 3.85Å; M110-F112 HydrophobicContact CG-CB 4.4Å; M110-F112 PolarHBondContact O-N 3.18Å; M110-F112 VanDerWaalsContact O-N 3.12Å; M110-F112 HydrophobicContact SD-CB 4.27Å; M110-E113 HydrophobicContact CB-CG 4.11Å; M110-E113 PolarHBondContact N-OE2 3.39Å; M110-E113 VanDerWaalsContact N-OE2 3.1Å; M110-E113 WeakPolarHBondContact O-CB 3.25Å; M110-E113 PolarHBondContact O-N 3.44Å; M110-A114 PolarHBondContact O-N 3.44Å; M110-A114 VanDerWaalsContact O-N 3.11Å
111S83.3Confident89.2Confident10 Ų1057 Ų577%0.0733%0.333CS..Hα-helixtrans-53.4-34.9175.4-65.40000113.1R25 T31 A114 F115R25-S111 PolarHBondContact NH1-OG 2.95Å; R25-S111 PolarHBondContact NH2-OG 2.98Å; T31-S111 PolarHBondContact O-N 3.39Å; T31-S111 PolarHBondContact O-OG 3Å; S111-A114 WeakPolarHBondContact O-CB 3.38Å; S111-A114 PolarHBondContact O-N 3.18Å; S111-F115 PolarHBondContact O-N 3.08Å; S111-F115 VanDerWaalsContact O-N 3.14Å
112F81.6Confident89Confident91 Ų9152.6 Ų52.640%0.39931%0.306SS..Hα-helixtrans-66.9-38.5175.4-177.9-106.3000112.8F18 M110 A114 F115 V116F18-F112 AromaticContact CD2-CD2 3.81Å; F18-F112 HydrophobicContact CD2-CD2 3.81Å; F18-F112 HydrophobicContact CD2-CE2 4.37Å; F18-F112 AromaticContact CE2-CD2 3.94Å; F18-F112 HydrophobicContact CE2-CD2 3.94Å; F18-F112 HydrophobicContact CE2-CE2 4.04Å; M110-F112 HydrophobicContact CG-CB 4.4Å; M110-F112 PolarHBondContact O-N 3.18Å; M110-F112 VanDerWaalsContact O-N 3.12Å; M110-F112 HydrophobicContact SD-CB 4.27Å; F112-A114 VanDerWaalsContact C-N 3.32Å; F112-A114 PolarHBondContact O-N 2.93Å; F112-F115 HydrophobicContact CD2-CD1 4.28Å; F112-F115 HydrophobicContact CE2-CD1 4.17Å; F112-F115 WeakPolarHBondContact O-CB 3.48Å; F112-F115 PolarHBondContact O-N 3.06Å; F112-V116 HydrophobicContact CD1-CG2 4.11Å; F112-V116 HydrophobicContact CE1-CG2 3.66Å; F112-V116 HydrophobicContact CE2-CG2 4.17Å; F112-V116 HydrophobicContact CZ-CG2 3.7Å; F112-V116 WeakPolarHBondContact O-CG2 3.16Å; F112-V116 PolarHBondContact O-N 3.5Å
113E87.1Confident88.8Confident71 Ų7156.6 Ų56.633%0.33232%0.324SS..Hα-helixtrans-64.1-41.5174.9-66.4-177.4134.900110.7Y102 M109 M110 F115 V116 F117Y102-E113 PolarHBondContact OH-OE1 3.27Å; Y102-E113 PolarHBondContact OH-OE2 3.33Å; M109-E113 HydrophobicContact CG-CB 3.9Å; M110-E113 HydrophobicContact CB-CG 4.11Å; M110-E113 PolarHBondContact N-OE2 3.39Å; M110-E113 VanDerWaalsContact N-OE2 3.1Å; M110-E113 WeakPolarHBondContact O-CB 3.25Å; M110-E113 PolarHBondContact O-N 3.44Å; E113-F115 VanDerWaalsContact C-N 3.27Å; E113-F115 PolarHBondContact O-N 3.42Å; E113-V116 PolarHBondContact O-N 2.87Å; E113-F117 HydrophobicContact CB-CD2 4.37Å; E113-F117 HydrophobicContact CB-CE2 4.33Å; E113-F117 WeakPolarHBondContact O-CD2 3.35Å; E113-F117 PolarHBondContact O-N 2.75Å
114A88.7Confident88.8Confident1 Ų154.5 Ų54.51%0.00832%0.322CS..Hα-helixtrans-54.5-46.1174.500000111.7L33 V43 M109 M110 S111 F112 G118L33-A114 HydrophobicContact CD1-CB 4.09Å; V43-A114 HydrophobicContact CG2-CB 4.23Å; M109-A114 HydrophobicContact CE-CB 3.4Å; M109-A114 VanDerWaalsContact CE-CB 3.4Å; M109-A114 HydrophobicContact SD-CB 4.24Å; M110-A114 PolarHBondContact O-N 3.44Å; M110-A114 VanDerWaalsContact O-N 3.11Å; S111-A114 WeakPolarHBondContact O-CB 3.38Å; S111-A114 PolarHBondContact O-N 3.18Å; F112-A114 VanDerWaalsContact C-N 3.32Å; F112-A114 PolarHBondContact O-N 2.93Å; A114-G118 PolarHBondContact O-N 3.29Å
115F88.5Confident88.6Confident49 Ų4952.7 Ų52.722%0.21530%0.302CS..Hα-helixtrans-62-49.6176.3164.9-100.3000111.7F18 W46 S111 F112 E113 F117 G118 V119F18-F115 HydrophobicContact CD1-CB 4Å; F18-F115 HydrophobicContact CD1-CD1 4.27Å; F18-F115 AromaticContact CD1-CD2 3.82Å; F18-F115 HydrophobicContact CD1-CD2 3.82Å; F18-F115 HydrophobicContact CD1-CE2 4.35Å; F18-F115 AromaticContact CD1-CG 3.75Å; F18-F115 HydrophobicContact CD1-CG 3.75Å; F18-F115 HydrophobicContact CE1-CB 4.11Å; F18-F115 AromaticContact CE1-CD1 3.64Å; F18-F115 HydrophobicContact CE1-CD1 3.64Å; F18-F115 AromaticContact CE1-CD2 3.19Å; F18-F115 HydrophobicContact CE1-CD2 3.19Å; F18-F115 AromaticContact CE1-CE1 3.77Å; F18-F115 HydrophobicContact CE1-CE1 3.77Å; F18-F115 AromaticContact CE1-CE2 3.32Å; F18-F115 HydrophobicContact CE1-CE2 3.32Å; F18-F115 AromaticContact CE1-CG 3.34Å; F18-F115 HydrophobicContact CE1-CG 3.34Å; F18-F115 AromaticContact CE1-CZ 3.61Å; F18-F115 HydrophobicContact CE1-CZ 3.61Å; F18-F115 HydrophobicContact CE2-CD1 4.19Å; F18-F115 HydrophobicContact CE2-CE1 4.22Å; F18-F115 AromaticContact CZ-CD1 3.59Å; F18-F115 HydrophobicContact CZ-CD1 3.59Å; F18-F115 AromaticContact CZ-CD2 3.93Å; F18-F115 HydrophobicContact CZ-CD2 3.93Å; F18-F115 AromaticContact CZ-CE1 3.42Å; F18-F115 HydrophobicContact CZ-CE1 3.42Å; F18-F115 VanDerWaalsContact CZ-CE1 3.42Å; F18-F115 AromaticContact CZ-CE2 3.76Å; F18-F115 HydrophobicContact CZ-CE2 3.76Å; F18-F115 AromaticContact CZ-CG 3.84Å; F18-F115 HydrophobicContact CZ-CG 3.84Å; F18-F115 AromaticContact CZ-CZ 3.5Å; F18-F115 HydrophobicContact CZ-CZ 3.5Å; W46-F115 HydrophobicContact CD2-CB 4.28Å; W46-F115 AromaticContact CD2-CD2 3.77Å; W46-F115 HydrophobicContact CD2-CD2 3.77Å; W46-F115 AromaticContact CE3-CD2 3.64Å; W46-F115 HydrophobicContact CE3-CD2 3.64Å; W46-F115 HydrophobicContact CE3-CE2 4.19Å; W46-F115 HydrophobicContact CG-CB 4.18Å; W46-F115 HydrophobicContact CG-CD2 4.22Å; W46-F115 HydrophobicContact CH2-CD2 4.5Å; W46-F115 HydrophobicContact CZ3-CD2 4.03Å; W46-F115 HydrophobicContact CZ3-CE2 4.34Å; S111-F115 PolarHBondContact O-N 3.08Å; S111-F115 VanDerWaalsContact O-N 3.14Å; F112-F115 HydrophobicContact CD2-CD1 4.28Å; F112-F115 HydrophobicContact CE2-CD1 4.17Å; F112-F115 WeakPolarHBondContact O-CB 3.48Å; F112-F115 PolarHBondContact O-N 3.06Å; E113-F115 VanDerWaalsContact C-N 3.27Å; E113-F115 PolarHBondContact O-N 3.42Å; F115-F117 PolarHBondContact O-N 2.85Å; F115-G118 PolarHBondContact O-N 3.12Å; F115-V119 HydrophobicContact CD2-CG2 3.73Å; F115-V119 HydrophobicContact CE1-CG2 4.39Å; F115-V119 HydrophobicContact CE2-CG2 3.31Å; F115-V119 HydrophobicContact CG-CG2 4.45Å; F115-V119 HydrophobicContact CZ-CG2 3.69Å; F115-V119 WeakPolarHBondContact O-CG2 3.38Å; F115-V119 PolarHBondContact O-N 3.15Å
116V90.7Very high88.3Confident69 Ų6951 Ų5142%0.41829%0.285SS..Hα-helixtrans-61.2-44.4-179.3171.90000111F112 E113 G120F112-V116 HydrophobicContact CD1-CG2 4.11Å; F112-V116 HydrophobicContact CE1-CG2 3.66Å; F112-V116 HydrophobicContact CE2-CG2 4.17Å; F112-V116 HydrophobicContact CZ-CG2 3.7Å; F112-V116 WeakPolarHBondContact O-CG2 3.16Å; F112-V116 PolarHBondContact O-N 3.5Å; E113-V116 PolarHBondContact O-N 2.87Å; V116-G120 WeakPolarHBondContact O-CA 3.45Å; V116-G120 PolarHBondContact O-N 3.37Å
117F91.7Very high88.3Confident82 Ų8251.7 Ų51.736%0.3627%0.272SS..Hα-helixtrans-65.9-40.8175.5-76.8-60000112.5V43 I98 Y102 E113 F115 Q121V43-F117 HydrophobicContact CG1-CB 3.93Å; V43-F117 HydrophobicContact CG2-CB 4.26Å; I98-F117 HydrophobicContact CD1-CB 4.13Å; I98-F117 HydrophobicContact CD1-CD1 4.15Å; I98-F117 HydrophobicContact CD1-CG 4.27Å; I98-F117 HydrophobicContact CG2-CD2 4.09Å; I98-F117 HydrophobicContact CG2-CE2 4.43Å; I98-F117 HydrophobicContact CG2-CG 4.19Å; Y102-F117 AromaticContact CE2-CE2 3.87Å; Y102-F117 HydrophobicContact CE2-CE2 3.87Å; Y102-F117 HydrophobicContact CE2-CZ 4.43Å; E113-F117 HydrophobicContact CB-CD2 4.37Å; E113-F117 HydrophobicContact CB-CE2 4.33Å; E113-F117 WeakPolarHBondContact O-CD2 3.35Å; E113-F117 PolarHBondContact O-N 2.75Å; F115-F117 PolarHBondContact O-N 2.85Å; F117-Q121 WeakPolarHBondContact O-CG 2.9Å; F117-Q121 PolarHBondContact O-N 3.29Å
118G90.9Very high88.3Confident0 Ų050.4 Ų50.40%027%0.27CS..Hα-helixtrans-61.6-51.3176.500000113.1V43 S47 A114 F115 Q121 S122V43-G118 WeakPolarHBondContact O-CA 3.45Å; S47-G118 VanDerWaalsContact CA-O 3.3Å; S47-G118 WeakPolarHBondContact CA-O 3.45Å; A114-G118 PolarHBondContact O-N 3.29Å; F115-G118 PolarHBondContact O-N 3.12Å; G118-Q121 WeakPolarHBondContact O-CG 3.44Å; G118-S122 PolarHBondContact O-N 3.07Å
119V91Very high88.2Confident43 Ų4350.1 Ų50.126%0.26127%0.271SS..Hα-helixtrans-68.3-40.6177175.70000111.2F115 Q121 S122 F123F115-V119 HydrophobicContact CD2-CG2 3.73Å; F115-V119 HydrophobicContact CE1-CG2 4.39Å; F115-V119 HydrophobicContact CE2-CG2 3.31Å; F115-V119 HydrophobicContact CG-CG2 4.45Å; F115-V119 HydrophobicContact CZ-CG2 3.69Å; F115-V119 WeakPolarHBondContact O-CG2 3.38Å; F115-V119 PolarHBondContact O-N 3.15Å; V119-Q121 PolarHBondContact O-N 2.81Å; V119-S122 PolarHBondContact O-N 2.97Å; V119-F123 WeakPolarHBondContact O-CB 3.25Å; V119-F123 PolarHBondContact O-N 2.99Å
120G92.1Very high88.1Confident31 Ų3157 Ų5732%0.3230%0.301SS..Hα-helixtrans-58.7-45.3-179.300000112.5V116 F123 C124V116-G120 WeakPolarHBondContact O-CA 3.45Å; V116-G120 PolarHBondContact O-N 3.37Å; G120-F123 PolarHBondContact O-N 3.5Å; G120-C124 WeakPolarHBondContact O-CB 3.36Å; G120-C124 PolarHBondContact O-N 2.87Å; G120-C124 PolarHBondContact O-SG 3.12Å
121Q91.3Very high88.2Confident30 Ų3059.1 Ų59.114%0.1431%0.313CS..Hα-helixtrans-64.9-43.1177.564.2-179.5-55.800112.5V43 S47 T94 S95 F117 G118 V119 F123 C124 V125V43-Q121 VanDerWaalsContact CG1-NE2 3.29Å; S47-Q121 VanDerWaalsContact OG-CD 3.25Å; S47-Q121 WeakPolarHBondContact OG-CG 3.41Å; T94-Q121 PolarHBondContact OG1-OE1 2.81Å; S95-Q121 PolarHBondContact OG-NE2 3.43Å; F117-Q121 WeakPolarHBondContact O-CG 2.9Å; F117-Q121 PolarHBondContact O-N 3.29Å; G118-Q121 WeakPolarHBondContact O-CG 3.44Å; V119-Q121 PolarHBondContact O-N 2.81Å; Q121-F123 VanDerWaalsContact C-N 3.34Å; Q121-F123 PolarHBondContact O-N 3.34Å; Q121-C124 PolarHBondContact O-N 3.04Å; Q121-V125 WeakPolarHBondContact O-CG2 3.38Å; Q121-V125 PolarHBondContact O-N 2.93Å
122S90.1Very high88.2Confident6 Ų667.9 Ų67.94%0.04235%0.345CS..Hα-helixtrans-62.9-41.1176.7-68.80000112S47 S50 G118 V119 V125 V126S47-S122 PolarHBondContact O-OG 2.93Å; S47-S122 PolarHBondContact OG-OG 3.38Å; S50-S122 WeakPolarHBondContact OG-CB 3.21Å; S50-S122 PolarHBondContact OG-OG 3.16Å; G118-S122 PolarHBondContact O-N 3.07Å; V119-S122 PolarHBondContact O-N 2.97Å; S122-V125 PolarHBondContact O-N 3.26Å; S122-V126 WeakPolarHBondContact O-CG2 3.33Å; S122-V126 PolarHBondContact O-N 2.82Å
123F90.2Very high88.2Confident115 Ų11568.3 Ų68.350%0.50435%0.35SS..Hα-helixtrans-62-46.3175180-102.2000111.8V119 G120 Q121 V125 V126 L127V119-F123 WeakPolarHBondContact O-CB 3.25Å; V119-F123 PolarHBondContact O-N 2.99Å; G120-F123 PolarHBondContact O-N 3.5Å; Q121-F123 VanDerWaalsContact C-N 3.34Å; Q121-F123 PolarHBondContact O-N 3.34Å; F123-V125 VanDerWaalsContact C-N 3.34Å; F123-V125 PolarHBondContact O-N 3.23Å; F123-V126 PolarHBondContact O-N 3.39Å; F123-L127 WeakPolarHBondContact O-CB 3.44Å; F123-L127 PolarHBondContact O-N 2.93Å
124C89.9Confident87.5Confident65 Ų6570.6 Ų70.644%0.43936%0.364SS..Hα-helixtrans-60.2-42.8175.4-720000112G120 Q121 L127 I128G120-C124 WeakPolarHBondContact O-CB 3.36Å; G120-C124 PolarHBondContact O-N 2.87Å; G120-C124 PolarHBondContact O-SG 3.12Å; Q121-C124 PolarHBondContact O-N 3.04Å; C124-L127 PolarHBondContact O-N 3.1Å; C124-I128 WeakPolarHBondContact O-CB 3.4Å; C124-I128 VanDerWaalsContact O-CG1 3.25Å; C124-I128 WeakPolarHBondContact O-CG1 3.22Å; C124-I128 PolarHBondContact O-N 3Å
125V87.8Confident87Confident54 Ų5474.5 Ų74.533%0.32740%0.396SS..Hα-helixtrans-60.6-46.4177167.10000111P87 Q121 S122 F123 S129P87-V125 HydrophobicContact CB-CG1 4.3Å; P87-V125 HydrophobicContact CG-CG1 3.87Å; Q121-V125 WeakPolarHBondContact O-CG2 3.38Å; Q121-V125 PolarHBondContact O-N 2.93Å; S122-V125 PolarHBondContact O-N 3.26Å; F123-V125 VanDerWaalsContact C-N 3.34Å; F123-V125 PolarHBondContact O-N 3.23Å; V125-S129 WeakPolarHBondContact O-CB 3.31Å; V125-S129 PolarHBondContact O-N 2.83Å; V125-S129 PolarHBondContact O-OG 2.92Å
126V86.3Confident86.6Confident28 Ų2877.4 Ų77.417%0.1742%0.418CS..Hα-helixtrans-61.5-47.4176.5169.70000110.4F54 S122 F123 I128 S129 F130F54-V126 HydrophobicContact CB-CG2 4.12Å; F54-V126 HydrophobicContact CD2-CG2 4.08Å; F54-V126 HydrophobicContact CG-CG2 4.06Å; S122-V126 WeakPolarHBondContact O-CG2 3.33Å; S122-V126 PolarHBondContact O-N 2.82Å; F123-V126 PolarHBondContact O-N 3.39Å; V126-I128 PolarHBondContact O-N 3.25Å; V126-S129 WeakPolarHBondContact O-CB 3.15Å; V126-S129 PolarHBondContact O-N 3.41Å; V126-S129 VanDerWaalsContact O-N 3.16Å; V126-F130 HydrophobicContact CG1-CD2 3.61Å; V126-F130 HydrophobicContact CG1-CE2 3.49Å; V126-F130 VanDerWaalsContact CG1-CE2 3.49Å; V126-F130 VanDerWaalsContact O-CD2 3.26Å; V126-F130 WeakPolarHBondContact O-CD2 3.33Å; V126-F130 PolarHBondContact O-N 2.92Å
127L89Confident85.3Confident84 Ų8483.2 Ų83.244%0.4445%0.446SS..Hα-helixtrans-59.5-49.3179.6-177.265.6000111.9F123 C124 S129 F130 L131F123-L127 WeakPolarHBondContact O-CB 3.44Å; F123-L127 PolarHBondContact O-N 2.93Å; C124-L127 PolarHBondContact O-N 3.1Å; L127-S129 VanDerWaalsContact C-N 3.27Å; L127-S129 PolarHBondContact O-N 3.32Å; L127-F130 PolarHBondContact O-N 2.85Å; L127-L131 HydrophobicContact CG-CD1 4.17Å; L127-L131 VanDerWaalsContact O-CG 3.3Å; L127-L131 WeakPolarHBondContact O-CG 3.38Å; L127-L131 PolarHBondContact O-N 3.18Å
128I87.6Confident85Confident111 Ų11183.3 Ų83.357%0.56945%0.45SS*.Hα-helixtrans-61.1-39.2176.7-67.7165.9000110.6C124 V126 L131 R132C124-I128 WeakPolarHBondContact O-CB 3.4Å; C124-I128 VanDerWaalsContact O-CG1 3.25Å; C124-I128 WeakPolarHBondContact O-CG1 3.22Å; C124-I128 PolarHBondContact O-N 3Å; V126-I128 PolarHBondContact O-N 3.25Å; I128-L131 PolarHBondContact O-N 2.94Å; I128-R132 WeakPolarHBondContact O-CB 3.3Å; I128-R132 PolarHBondContact O-N 2.79Å
129S84.7Confident84.7Confident60 Ų6087.7 Ų87.742%0.4247%0.474SS..Hα-helixtrans-63.1-43.7177.7-58.80000111.6V125 V126 L127 R132 I133V125-S129 WeakPolarHBondContact O-CB 3.31Å; V125-S129 PolarHBondContact O-N 2.83Å; V125-S129 PolarHBondContact O-OG 2.92Å; V126-S129 WeakPolarHBondContact O-CB 3.15Å; V126-S129 PolarHBondContact O-N 3.41Å; V126-S129 VanDerWaalsContact O-N 3.16Å; L127-S129 VanDerWaalsContact C-N 3.27Å; L127-S129 PolarHBondContact O-N 3.32Å; S129-R132 PolarHBondContact O-N 3.01Å; S129-I133 WeakPolarHBondContact O-CG1 3.48Å; S129-I133 PolarHBondContact O-N 3.35Å
130F83.1Confident84.4Confident144 Ų14490.2 Ų90.263%0.63249%0.486SS*.Hα-helixtrans-62.6-46.7173.6-85.4-70.9000112.4V126 L127 R132 I133 L134V126-F130 HydrophobicContact CG1-CD2 3.61Å; V126-F130 HydrophobicContact CG1-CE2 3.49Å; V126-F130 VanDerWaalsContact CG1-CE2 3.49Å; V126-F130 VanDerWaalsContact O-CD2 3.26Å; V126-F130 WeakPolarHBondContact O-CD2 3.33Å; V126-F130 PolarHBondContact O-N 2.92Å; L127-F130 PolarHBondContact O-N 2.85Å; F130-R132 VanDerWaalsContact C-N 3.28Å; F130-R132 PolarHBondContact O-N 3.32Å; F130-I133 PolarHBondContact O-N 3.47Å; F130-L134 PolarHBondContact O-N 3.37Å
131L86.5Confident83.9Confident98 Ų9893.6 Ų93.651%0.51350%0.496SS..Hα-helixtrans-61.5-37.4178.5-70.3173.3000112.1L127 I128 L134 A135L127-L131 HydrophobicContact CG-CD1 4.17Å; L127-L131 VanDerWaalsContact O-CG 3.3Å; L127-L131 WeakPolarHBondContact O-CG 3.38Å; L127-L131 PolarHBondContact O-N 3.18Å; I128-L131 PolarHBondContact O-N 2.94Å; L131-L134 PolarHBondContact O-N 3.43Å; L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 3.18Å
132R83.7Confident83.4Confident194 Ų19497.6 Ų97.673%0.73252%0.518SS*.Hα-helixtrans-64.5-44.6176.7-174.2-176.8179.3127.91.6111.8I128 S129 F130 L134 A135 T136I128-R132 WeakPolarHBondContact O-CB 3.3Å; I128-R132 PolarHBondContact O-N 2.79Å; S129-R132 PolarHBondContact O-N 3.01Å; F130-R132 VanDerWaalsContact C-N 3.28Å; F130-R132 PolarHBondContact O-N 3.32Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3.17Å; R132-A135 PolarHBondContact O-N 3.42Å; R132-T136 PolarHBondContact O-N 3.07Å; R132-T136 PolarHBondContact O-OG1 3.39Å
133I80.6Confident83Confident99 Ų99103.7 Ų103.751%0.50855%0.55SS..Hα-helixtrans-60.7-45177-67.1164.6000109.9S129 F130 A135 T136 L137S129-I133 WeakPolarHBondContact O-CG1 3.48Å; S129-I133 PolarHBondContact O-N 3.35Å; F130-I133 PolarHBondContact O-N 3.47Å; I133-A135 VanDerWaalsContact C-N 3.29Å; I133-A135 PolarHBondContact O-N 3.11Å; I133-T136 PolarHBondContact O-N 3.27Å; I133-T136 VanDerWaalsContact O-N 3.14Å; I133-T136 PolarHBondContact O-OG1 3.07Å; I133-L137 HydrophobicContact CG2-CD1 4.04Å; I133-L137 PolarHBondContact O-N 3.2Å
134L73.3Confident82.5Confident119 Ų119102.9 Ų102.962%0.62355%0.553SS**Hα-helixtrans-60-38.3176.7-177.363.7000112.4F130 L131 R132 T136F130-L134 PolarHBondContact O-N 3.37Å; L131-L134 PolarHBondContact O-N 3.43Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3.17Å; L134-T136 VanDerWaalsContact C-N 3.27Å; L134-T136 PolarHBondContact O-N 3.41Å
135A77.8Confident81.9Confident83 Ų83105.8 Ų105.869%0.68656%0.562SS**Hα-helixtrans-72.6-17178.400000114.1L131 R132 I133L131-A135 WeakPolarHBondContact O-CB 3.48Å; L131-A135 PolarHBondContact O-N 3.18Å; R132-A135 PolarHBondContact O-N 3.42Å; I133-A135 VanDerWaalsContact C-N 3.29Å; I133-A135 PolarHBondContact O-N 3.11Å
136T80.8Confident81.4Confident111 Ų111110.2 Ų110.268%0.68158%0.581SS**THydrogen-bonded Turntrans-98.9-3.9178.552.90000114.1R132 I133 L134R132-T136 PolarHBondContact O-N 3.07Å; R132-T136 PolarHBondContact O-OG1 3.39Å; I133-T136 PolarHBondContact O-N 3.27Å; I133-T136 VanDerWaalsContact O-N 3.14Å; I133-T136 PolarHBondContact O-OG1 3.07Å; L134-T136 VanDerWaalsContact C-N 3.27Å; L134-T136 PolarHBondContact O-N 3.41Å
137L63.6Low81Confident191 Ų191117.6 Ų117.6100%162%0.618SS**  trans-94.20173.4-80161.4000110.2I133I133-L137 HydrophobicContact CG2-CD1 4.04Å; I133-L137 PolarHBondContact O-N 3.2Å

Retrieved 137 of 137 residues in 30.4 ms (Link to these results)